Model name: model_name=MEAM_LAMMPS_ShimKoKim_2013_NiVH__MO_612225165948_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391749382019
cohesive_energy=4.450350014972497
mass=58.6934
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=[2.44846235384514e-19, 3.22699202383842e-19, 3.8083257937189797e-19, 4.2788690493584396e-19, 4.67463872148912e-19, 5.0148609297190195e-19, 5.31123156347634e-19, 5.571569244734999e-19, 5.8014014828823e-19, 6.00481382833494e-19, 6.1849625690619e-19, 6.34434710061222e-19, 6.484954122012059e-19, 6.608449896960779e-19, 6.71621229736362e-19, 6.8094429556960795e-19, 6.889119199704899e-19, 6.95613824830512e-19, 7.01125312451472e-19, 7.05515276428632e-19, 7.08844599474084e-19, 7.1116455124011595e-19, 7.12524799202382e-19, 7.1296860213e-19, 7.124879491398e-19, 7.109322356281859e-19, 7.0809798516264e-19, 7.037464734246959e-19, 6.97590910796868e-19, 6.89283624949578e-19, 6.784032434280839e-19, 6.64435467532872e-19, 6.4675224402341395e-19, 6.245749150555859e-19, 5.969405724723539e-19, 5.626379707384139e-19, 5.20143439874832e-19, 4.67510335271298e-19, 4.02240863555406e-19, 3.21081003983502e-19, 2.1974653623626997e-19, 9.252169517191499e-20, -6.83413249762602e-20, -2.73526799309748e-19, -5.380541724663179e-19, -8.835058852295938e-19, -1.3417428221432999e-18, -1.9611763523803798e-18, -2.8180845033089394e-18, -4.03794974890386e-18, -5.8381714366325995e-18, -8.6213925763857e-18, -1.3199708438638738e-17, -2.14119691897662e-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: 0.01808958664959747
Energy: 0.018603408232736946
Energy: 0.018618509935814768
Energy: 0.01840319363758189
Energy: 0.6714077112416958
Energy: 0.01862464302626993
Energy: 0.018603408232406443
Energy: 0.16004755504032026
Energy: 0.15998085340722584
Energy: 0.15972441849099242
Energy: 0.15975150414772438
Energy: 0.16135354188578105
Energy: 0.01861850993548426
Energy: 0.15998085340755633
Energy: 0.16140213794178593
Energy: 0.01857862604987725
Energy: 0.15968727022485038
Energy: 0.16078064761028243
Energy: 0.01840319363758189
Energy: 0.1597244184922777
Energy: 0.01857862604987725
Energy: 0.018557245952636647
Energy: 0.15989762135748806
Energy: 0.018514757804488895
Energy: 0.6714077112407411
Energy: 0.15975150414805486
Energy: 0.15968727022485038
Energy: 0.15989762135748806
Energy: 0.15972735008136726
Energy: 0.15965525944181586
Energy: 0.01862464302656371
Energy: 0.16135354188545054
Energy: 0.1607806476106129
Energy: 0.0185147578048194
Energy: 0.15965525944214637
Energy: 0.018505244393245034

minimum gb energy = 0.01808958664959747 eV
minimum distance =  2.48701823379375 Angstroms
sigma value = 1


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

Energy: 2.059800162691912
Energy: 1.5507500241382528
Energy: 1.4122672382083306
Energy: 1.4438061858651416
Energy: 1.736666084160451
Energy: 1.9082601595423514
Energy: 1.9230102024977895
Energy: 1.3450679623549993
Energy: 1.344903767351692
Energy: 1.3959768936828572
Energy: 1.3450074096168003
Energy: 1.3439224847173572
Energy: 1.8705408278487965
Energy: 1.3441514500162415
Energy: 1.3442083888059435
Energy: 1.3549124735884481
Energy: 1.3442559174740918
Energy: 1.3050350729051854
Energy: 1.96420560719068
Energy: 1.2961566342153321
Energy: 1.342112157833949
Energy: 1.3265935158492228
Energy: 1.3492460830761364
Energy: 1.326324990178063
Energy: 1.8651963655596155
Energy: 1.4008897001420886
Energy: 1.400785673966552
Energy: 1.403109754822424
Energy: 1.401262230256588
Energy: 1.400554400827343
Energy: 1.818531549834345
Energy: 1.4007447852123476
Energy: 1.3997561643625922
Energy: 1.3827590319007943
Energy: 1.4010728460895665
Energy: 1.3815078723145198
Energy: 1.8205688688204653
Energy: 1.380634623154629
Energy: 1.3804977297535594
Energy: 1.3799596008951704
Energy: 1.396239242022739
Energy: 1.3806486106149118
Energy: 1.7356898664569846
Energy: 1.4015403244573694
Energy: 1.4020520046939813
Energy: 1.3928392142316046
Energy: 1.39943897553405
Energy: 1.3813932001062381
Energy: 1.4868533257008483
Energy: 1.3969754780011636
Energy: 1.3816689541204838
Energy: 1.4067357825315014
Energy: 1.3967967394900085
Energy: 1.379311860563001
Energy: 1.4834994841151536
Energy: 1.400955609185683
Energy: 1.3636382400076352
Energy: 1.3766581193695189
Energy: 1.4009457360257516
Energy: 1.3635638119985956
Energy: 1.5200782405252722
Energy: 1.3531009049676657
Energy: 1.3540932876451686
Energy: 1.5198616289735427
Energy: 1.3535761560051192
Energy: 1.3520536382380248
Energy: 1.3442974247870716
Energy: 1.358745404808672
Energy: 1.3592948480139828
Energy: 1.3443288480995885
Energy: 1.3713851544490696
Energy: 1.3441183429139336
Energy: 1.3447380710563948
Energy: 1.387559886410704
Energy: 1.3874481878423721
Energy: 1.3446652763923552
Energy: 1.3706303249888363
Energy: 1.3442375013382484
Energy: 1.3943227076371327
Energy: 1.375870379666609
Energy: 1.3562929594326871
Energy: 1.3939006787715604
Energy: 1.3551674117171648
Energy: 1.3279502104352512
Energy: 1.3945430684809548
Energy: 1.4015470405216222
Energy: 1.3270266083572118
Energy: 1.3441031640644432
Energy: 1.4032160745221638
Energy: 1.3442450170670628
Energy: 1.3978374905656166
Energy: 1.3254789260596493
Energy: 1.3254705789839216
Energy: 1.3785614863076139
Energy: 1.3714990683889412
Energy: 1.345401726285649
Energy: 1.7002303817705458
Energy: 1.3915503981454826
Energy: 1.3914592157543617
Energy: 1.357969752222147
Energy: 1.3791469987382068
Energy: 1.328105845494414
Energy: 1.647192175050641
Energy: 1.3999187140696918
Energy: 1.39921792573927
Energy: 1.4002248071933328
Energy: 1.446922921236615
Energy: 1.3993198490822494
Energy: 1.6509616446408997
Energy: 1.3995812578443434
Energy: 1.3989700984322029
Energy: 1.3996047960070261
Energy: 1.3994795125976154
Energy: 1.4121899691240416
Energy: 1.8710614235255774
Energy: 1.40028716202523
Energy: 1.413217361616714
Energy: 1.399670911018124
Energy: 1.3995957956203187
Energy: 1.398425874103671
Energy: 1.8852791301149843
Energy: 1.3958213956014447
Energy: 1.3755859528892709
Energy: 1.354942504237847
Energy: 1.432360910387986
Energy: 1.395835399175455
Energy: 1.8878958400320265
Energy: 1.3737783443805724
Energy: 1.3722600688382394
Energy: 1.3838328788586955
Energy: 1.3891341163477426
Energy: 1.3408598299362464
Energy: 1.9228762096149892
Energy: 1.3440886050150926
Energy: 1.3442477208620314
Energy: 1.3822382837925615
Energy: 1.3441643251271032
Energy: 1.3439082013021408

minimum gb energy = 1.2961566342153321 eV
minimum distance =  2.32703661927519 Angstroms
sigma value = 33


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

Energy: 2.41246049733124
Energy: 1.525100653038596
Energy: 1.8281761409045232
Energy: 1.8244337469125216
Energy: 1.44095654429988
Energy: 1.9295917638523283
Energy: 1.6621166832715968
Energy: 1.3780339096013337
Energy: 1.3780584972658028
Energy: 1.37768498906604
Energy: 1.3781287006656362
Energy: 1.37739037401769
Energy: 1.9473235013134325
Energy: 1.387489213577573
Energy: 1.4160009199689738
Energy: 1.5032830590978008
Energy: 1.3877303863734753
Energy: 1.5402143329923415
Energy: 1.8649846027218944
Energy: 1.527532375992905
Energy: 1.518580239469218
Energy: 1.4606299721187075
Energy: 1.524793422359043
Energy: 1.4288516119711905
Energy: 1.8306849757575203
Energy: 1.5196674934159127
Energy: 1.5184684986798926
Energy: 1.4096101963844712
Energy: 1.5191353174121407
Energy: 1.5504197119141305
Energy: 1.9109481494594824
Energy: 1.5623144244430511
Energy: 1.5642390914410558
Energy: 1.529664596365414
Energy: 1.5336174509309646
Energy: 1.513543335274409
Energy: 1.9097046502122996
Energy: 1.518004219395469
Energy: 1.5200567758846772
Energy: 1.5177640750639145
Energy: 1.5564405196280078
Energy: 1.5165601396494237
Energy: 1.8271356817668443
Energy: 1.485106228857628
Energy: 1.4849668377585412
Energy: 1.6184616933908142
Energy: 1.4864036152041766
Energy: 1.4869828283934194
Energy: 1.601186548155998
Energy: 1.494878300139653
Energy: 1.5529360416481386
Energy: 1.5638279696518844
Energy: 1.4947815297615656
Energy: 1.5562115484873553
Energy: 1.6019834073635708
Energy: 1.565262019414594
Energy: 1.5479179892767525
Energy: 1.5469734944783704
Energy: 1.548247046294669
Energy: 1.5503192803452275
Energy: 1.7888550777703813
Energy: 1.823203122828561
Energy: 1.822888599404836
Energy: 1.48018191742797
Energy: 1.823550772872679
Energy: 1.8321563339898421
Energy: 1.522730524390928
Energy: 1.3497390161656833
Energy: 1.5075335846553273
Energy: 1.5228079311574991
Energy: 1.3230628057053433
Energy: 1.5060712104927474
Energy: 1.5024234213180971
Energy: 1.565393679861332
Energy: 1.5398597899869557
Energy: 1.5022087637465742
Energy: 1.571887931963384
Energy: 1.5062099364638555
Energy: 1.6543976926780932
Energy: 1.7305098165262667
Energy: 1.458876382459059
Energy: 1.7829727345830289
Energy: 1.7295926712048688
Energy: 1.4622814273212061
Energy: 1.6112813957013354
Energy: 1.5671435856042149
Energy: 1.5405920084918192
Energy: 1.5203048272194166
Energy: 1.5668458170416162
Energy: 1.542383239197966
Energy: 1.6058540070391787
Energy: 1.5213661880739242
Energy: 1.5182957921031655
Energy: 1.5588103412120922
Energy: 1.557767206394614
Energy: 1.5623711715680813
Energy: 1.7579986765010407
Energy: 1.5289291730750116
Energy: 1.5447509464695266
Energy: 1.606257841930061
Energy: 1.5332762424770383
Energy: 1.4330569347418962
Energy: 1.6620610768180484
Energy: 1.565970602239367
Energy: 1.572596572992923
Energy: 1.4847394722700016
Energy: 1.616867823127963
Energy: 1.4873583754289146
Energy: 1.6614100240363507
Energy: 1.4512875726071501
Energy: 1.5896666726807092
Energy: 1.4865354940657318
Energy: 1.447154539938557
Energy: 1.4070172763887578
Energy: 1.8240127171243348
Energy: 1.4226017910062763
Energy: 1.4249734677528265
Energy: 1.601047176759585
Energy: 1.4238140042781144
Energy: 1.422827576262541
Energy: 1.958800544815023
Energy: 1.42285646297371
Energy: 1.3896177416350581
Energy: 1.3624339803586825
Energy: 1.490870481494363
Energy: 1.350231147215347
Energy: 1.5586118271888258
Energy: 1.395509278111673
Energy: 1.3955995681835207
Energy: 1.4646844333215843
Energy: 1.3957231416093652
Energy: 1.3512267630099404
Energy: 1.7911072902985872
Energy: 1.3874384751278248
Energy: 1.540982161010532
Energy: 1.5827471186680884
Energy: 1.3874625607881337
Energy: 1.3712873151581217
Energy: 2.0135738342902525
Energy: 1.535465983345229
Energy: 1.6904124525515338
Energy: 1.730016969796458
Energy: 1.571343851103444
Energy: 1.7305447556444127
Energy: 1.775510804131127
Energy: 1.5191970403516595
Energy: 1.5194209516944588
Energy: 1.583452342155197
Energy: 1.5203306669067178
Energy: 1.550060226061876
Energy: 1.9141943683163132
Energy: 1.56158688854358
Energy: 1.5638354392360172
Energy: 1.5677904448173237
Energy: 1.5749175710350904
Energy: 1.512528376106542
Energy: 1.8977454390793262
Energy: 1.6021084383231416
Energy: 1.5330599130689102
Energy: 1.5326579604231088
Energy: 1.5523924053144507
Energy: 1.5370805233827713
Energy: 1.8230857416775057
Energy: 1.484380137465781
Energy: 1.488306783239363
Energy: 1.56864829856888
Energy: 1.4850110942031536
Energy: 1.5766276417710257
Energy: 1.6027565997805853
Energy: 1.4846473929555426
Energy: 1.4859043829332563
Energy: 1.5507500380446235
Energy: 1.4845889215375698
Energy: 1.5519539734007404
Energy: 1.602412097116912
Energy: 1.5655375280894979
Energy: 1.551008005003869
Energy: 1.548276521487405
Energy: 1.5674162974639945
Energy: 1.549385430703063
Energy: 1.645321414770156
Energy: 1.2874744470075543
Energy: 1.2865894304813568
Energy: 1.5342525401563203
Energy: 1.284562506053143
Energy: 1.2856405910549973
Energy: 1.5208455241558758
Energy: 1.3501136123847342
Energy: 1.3218899782260092
Energy: 1.525739757946372
Energy: 1.3508906088098922
Energy: 1.5283649126731331
Energy: 1.5022669119984364
Energy: 1.5664870397252426
Energy: 1.5383707441766918
Energy: 1.5028486603890627
Energy: 1.5670718363623017
Energy: 1.5080285979717176
Energy: 1.500976203484812
Energy: 1.7317777385749307
Energy: 1.7307401450525535
Energy: 1.5020872513635861
Energy: 1.7294790132013806
Energy: 1.4590310030090696
Energy: 1.5866498851009359
Energy: 1.566860666980172
Energy: 1.5419280795183323
Energy: 1.516556230416
Energy: 1.576419123794495
Energy: 1.5413086450170286
Energy: 1.5993237543580514
Energy: 1.559445339632296
Energy: 1.558389864780356
Energy: 1.5663340258509688
Energy: 1.5566911333204643
Energy: 1.5574751554236508
Energy: 1.5864970024598402
Energy: 1.5887465564780447
Energy: 1.4254352874067393
Energy: 1.4471402407872926
Energy: 1.4268288610024535
Energy: 1.585407272265601
Energy: 1.661234949999741
Energy: 1.5723612890387324
Energy: 1.569812218382461
Energy: 1.4961441803627944
Energy: 1.5692243502587595
Energy: 1.57192427068138
Energy: 1.6621291691851265
Energy: 1.4465364776297078
Energy: 1.4080599107557565
Energy: 1.5196581176139543
Energy: 1.44889293512817
Energy: 1.4873038470555506
Energy: 1.989414669088196
Energy: 1.4223772645755848
Energy: 1.425022159656279
Energy: 1.4145236807013943
Energy: 1.4235617306815147
Energy: 1.5814087912851897
Energy: 2.094983651869707
Energy: 1.3654036021719407
Energy: 1.2998502695680931
Energy: 1.2808375210084118
Energy: 1.4090303004021973
Energy: 1.3940017180432445

minimum gb energy = 1.2808375210084118 eV
minimum distance =  2.25145330206791 Angstroms
sigma value = 51


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

Energy: 2.1145457910727816
Energy: 1.5602579693525997
Energy: 2.2114938202019245
Energy: 1.7751091513470798
Energy: 1.4076412929481508
Energy: 1.7747788697436857
Energy: 1.727782559187867
Energy: 1.4216100504062954
Energy: 1.4154561253602778
Energy: 1.3947092801588348
Energy: 1.4074704676159953
Energy: 1.4164517037382813
Energy: 1.9057446466225774
Energy: 1.4044359343880388
Energy: 1.4034258202159706
Energy: 1.4343458746572364
Energy: 1.4043026083167571
Energy: 1.3488664330095546
Energy: 1.8215929976800191
Energy: 1.4031690155866885
Energy: 1.3536208109490522
Energy: 1.380053103724559
Energy: 1.539625518743263
Energy: 1.378148625276651
Energy: 1.773678884026001
Energy: 1.482987610762731
Energy: 1.484156738572155
Energy: 1.3412409508832273
Energy: 1.4835519062617721
Energy: 1.431951558030776
Energy: 1.6120798963985399
Energy: 1.433321682734791
Energy: 1.4320251124949854
Energy: 1.4305978696133748
Energy: 1.468097556934675
Energy: 1.4307237091347116
Energy: 1.6123204895747225
Energy: 1.4024179432994015
Energy: 1.4319411049732624
Energy: 1.432697633370268
Energy: 1.4330042514456047
Energy: 1.4312855785896577
Energy: 1.622744207557927
Energy: 1.298550993018068
Energy: 1.294305003767277
Energy: 1.518724818997707
Energy: 1.2991440835162338
Energy: 1.297992529133027
Energy: 1.403700620522728
Energy: 1.2966135253924895
Energy: 1.2967368433865556
Energy: 1.4037746666661255
Energy: 1.2944857897295359
Energy: 1.4009378073619756
Energy: 1.401267218510024
Energy: 1.3619354520880693
Energy: 1.4158150321576017
Energy: 1.4012699210455695
Energy: 1.3558008413494615
Energy: 1.4160112426777474
Energy: 1.4001040712373858
Energy: 1.517911101708281
Energy: 1.5180410449596666
Energy: 1.4053889421829306
Energy: 1.4022003490302688
Energy: 1.5020063263885068
Energy: 1.464597873097878
Energy: 1.3612273927515615
Energy: 1.4157536508252748
Energy: 1.4156918754390435
Energy: 1.33879749517181
Energy: 1.4159284418565226
Energy: 1.442621100222218
Energy: 1.3354204512182433
Energy: 1.3322323071488542
Energy: 1.427636635780306
Energy: 1.4193513487509695
Energy: 1.4286753332808353
Energy: 1.443963962899003
Energy: 1.6783836705774056
Energy: 1.67788013188301
Energy: 1.433737601719349
Energy: 1.6785349850929023
Energy: 1.4864687354161903
Energy: 1.7280251357449525
Energy: 1.3880793861035166
Energy: 1.3760084641206294
Energy: 1.3802705364346695
Energy: 1.4009103106699712
Energy: 1.3751102352356321
Energy: 1.7399321741182079
Energy: 1.4344356163144132
Energy: 1.4336575424695241
Energy: 1.568935165404594
Energy: 1.4335059665789074
Energy: 1.4517660337409501
Energy: 1.7521205637540143
Energy: 1.4343760656579632
Energy: 1.4342603030160292
Energy: 1.4818481575557718
Energy: 1.43468058075373
Energy: 1.4512088477056297
Energy: 1.9403779380320476
Energy: 1.4157204326094612
Energy: 1.3929510088724204
Energy: 1.2902337411597722
Energy: 1.4207036687019217
Energy: 1.3995329892553192

minimum gb energy = 1.2902337411597722 eV
minimum distance =  2.32792670741361 Angstroms
sigma value = 19


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

Energy: 1.8551714262484704
Energy: 1.4949165627036114
Energy: 1.543323831921513
Energy: 1.5449126925423584
Energy: 1.625852822970736
Energy: 1.620585637131236
Energy: 1.9039167277052138
Energy: 1.340869606539441
Energy: 1.3409586094319328
Energy: 1.279743718183762
Energy: 1.3408061960046151
Energy: 1.3413468264590207
Energy: 2.000291800785192
Energy: 1.3941185836903118
Energy: 1.3600713677622855
Energy: 1.336237099031102
Energy: 1.340861324818182
Energy: 1.3943872899946335
Energy: 1.5565822740421196
Energy: 1.421029913745395
Energy: 1.4203720302770602
Energy: 1.4705188251555292
Energy: 1.4202869653746295
Energy: 1.3735586775363113
Energy: 1.997325727407852
Energy: 1.4281671746326399
Energy: 1.4226729803855942
Energy: 1.268905056050245
Energy: 1.420476127638943
Energy: 1.4295838775964953
Energy: 1.6631739757241506
Energy: 1.3051085405113392
Energy: 1.43865242942359
Energy: 1.4103298653356198
Energy: 1.3050040610916334
Energy: 1.404525227492546
Energy: 1.6650842333347573
Energy: 1.4592875811768096
Energy: 1.4079339733423584
Energy: 1.4089043621060962
Energy: 1.3804637084946147
Energy: 1.401890970755107
Energy: 1.5662837295084184
Energy: 1.1367976505187372
Energy: 1.139263101550038
Energy: 1.5701340314781504
Energy: 1.2537130064190327
Energy: 1.1688935257287596
Energy: 1.4089845796573004
Energy: 1.139629131944286
Energy: 1.1507786526152937
Energy: 1.409208536840259
Energy: 1.1383701068493923
Energy: 1.2227480652619884
Energy: 1.408754441854003
Energy: 1.4084746668244914
Energy: 1.4100859910143566
Energy: 1.4088057974805617
Energy: 1.5591752864825408
Energy: 1.4109231703798986
Energy: 1.4703025158165504
Energy: 1.4712459864624998
Energy: 1.4714738055812813
Energy: 1.4708887987508947
Energy: 1.4719317365050386
Energy: 1.4545812246781535
Energy: 1.5682806492207313
Energy: 1.5187020009971208
Energy: 1.4633228543532038
Energy: 1.429520505402702
Energy: 1.4294089683331792
Energy: 1.4317315496145775
Energy: 1.3046069667021616
Energy: 1.4105773274756555
Energy: 1.5428026038023526
Energy: 1.3048191363564885
Energy: 1.4125132394794686
Energy: 1.5423723423684632
Energy: 1.5700679721249202
Energy: 1.5495193790308592
Energy: 1.549369512144308
Energy: 1.453924667416479
Energy: 1.548932434633382
Energy: 1.5513314052660845
Energy: 1.8115156524902538
Energy: 1.409749101145075
Energy: 1.4099629940056795
Energy: 1.138536422218092
Energy: 1.409202577522194
Energy: 1.2227620625540219
Energy: 1.755611897190425
Energy: 1.4582609459737716
Energy: 1.2529435432315181
Energy: 1.5459489869289702
Energy: 1.406345991009218
Energy: 1.370997060019588
Energy: 1.9231992798983841
Energy: 1.4087260141013092
Energy: 1.4107721452246345
Energy: 1.443318181494525
Energy: 1.4093847942629476
Energy: 1.410744765819918
Energy: 1.5535167206214675
Energy: 1.4095783044346426
Energy: 1.4098507518312369
Energy: 1.4705549229170458
Energy: 1.4094175043055697
Energy: 1.4095121330527398
Energy: 1.5535672547032495
Energy: 1.404080797072683
Energy: 1.4044218359678635
Energy: 1.4706566177248894
Energy: 1.4035213643673135
Energy: 1.5154884910404334
Energy: 1.668414328208065
Energy: 1.3049495893300147
Energy: 1.4816502429121403
Energy: 1.4689190909149694
Energy: 1.3048355216275571
Energy: 1.516501984137012
Energy: 1.6314469540825889
Energy: 1.4109912642150804
Energy: 1.4655817982835149
Energy: 1.5483031797418438
Energy: 1.4418547202847325
Energy: 1.5574398254165591
Energy: 1.6658900835439934
Energy: 1.459314187278049
Energy: 1.4626383985338283
Energy: 1.4104160443986786
Energy: 1.459293147136874
Energy: 1.410944052384537
Energy: 1.6687500627962744
Energy: 1.5446008260300703
Energy: 1.544376523530888
Energy: 1.5084569015718763
Energy: 1.5450359139316654
Energy: 1.544227015785898
Energy: 1.4047070381148272
Energy: 1.3588604966152753
Energy: 1.4095920223785263
Energy: 1.4084162659908712
Energy: 1.2656336292183175
Energy: 1.4051050024135152
Energy: 1.4045782664115452
Energy: 1.4867013413655188
Energy: 1.4093886096222055
Energy: 1.4081554968126713
Energy: 1.4378521671401057
Energy: 1.4046431851787085
Energy: 1.5788489055133375
Energy: 1.4719650294332898
Energy: 1.4715330355797933
Energy: 1.58496011581075
Energy: 1.4710336540062001
Energy: 1.2700519557916197
Energy: 1.6495730204561085
Energy: 1.5360314068245817
Energy: 1.4702030553425323
Energy: 1.3065087231080088
Energy: 1.471394012662729
Energy: 1.4029817587876388
Energy: 1.304805535143407
Energy: 1.4052683488657962
Energy: 1.3426196716206347
Energy: 1.304779448622184
Energy: 1.394539043116944
Energy: 1.458589120237678
Energy: 1.6509264953397131
Energy: 1.343405937880828
Energy: 1.3411385348665572
Energy: 1.3041372215115377
Energy: 1.3441020327202786
Energy: 1.3973543100994272
Energy: 1.888020604780661
Energy: 1.3765590459104515
Energy: 1.1688377386833233
Energy: 1.137957442146096
Energy: 1.5038277057319247
Energy: 1.215849344328087

minimum gb energy = 1.1367976505187372 eV
minimum distance =  2.3474159571849 Angstroms
sigma value = 27


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

Energy: 1.486335516397286
Energy: 1.4723526486389746
Energy: 1.475791164262097
Energy: 1.3996290311867303
Energy: 2.0498481168542635
Energy: 2.0211403314210874
Energy: 1.3436404661304415
Energy: 1.2957655614610875
Energy: 1.2958982116029718
Energy: 1.2481060605440337
Energy: 1.2957560332660658
Energy: 1.2955184082736675
Energy: 1.3475131164501033
Energy: 1.2870427129314084
Energy: 1.2848893496630776
Energy: 1.2771825925853808
Energy: 1.2861060931786419
Energy: 1.284644276245374
Energy: 1.1983474715958524
Energy: 1.2286611525341622
Energy: 1.2298285881899402
Energy: 1.2778824223937169
Energy: 1.5984906428106895
Energy: 1.2282746789498524
Energy: 1.492090371125458
Energy: 1.3636659266408266
Energy: 1.2491863328837078
Energy: 1.3821776624629214
Energy: 1.3631814805543063
Energy: 1.136714188710519
Energy: 1.2849973184435206
Energy: 1.3647693810479666
Energy: 1.3652121854791301
Energy: 1.2849398556223275
Energy: 1.4030970102116653
Energy: 1.1412321795825588
Energy: 1.285905646213055
Energy: 1.1937347625481718
Energy: 1.1937065919673477
Energy: 1.2865306901045863
Energy: 1.2480131850434877
Energy: 1.286688631452131
Energy: 1.3609847009208615
Energy: 1.224081435091198
Energy: 1.2249055763060257
Energy: 1.361093516227447
Energy: 1.2230075249613628
Energy: 1.28298713086549
Energy: 1.3484903834162605
Energy: 1.2247190104434584
Energy: 1.2617269709586638
Energy: 1.3565211938465662
Energy: 1.2722602110549968
Energy: 1.2615171328020913
Energy: 1.3492584572673887
Energy: 1.2560615030469162
Energy: 1.2013066476837944
Energy: 1.2999300597814258
Energy: 1.3010916743548384
Energy: 1.3010550036179342
Energy: 1.3472473142272083
Energy: 1.3092141958030754
Energy: 1.3111380092064324
Energy: 1.3006842076036411
Energy: 1.3082819290633854
Energy: 1.310839262170825
Energy: 1.3471196931361582
Energy: 1.2851074651397698
Energy: 1.2851963481571207
Energy: 1.2481224693499795
Energy: 1.2849262502145615
Energy: 1.2854344814504333

minimum gb energy = 1.136714188710519 eV
minimum distance =  2.31895376943529 Angstroms
sigma value = 9


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

Energy: 2.281248270244161
Energy: 1.3426245906369187
Energy: 1.3382617612913184
Energy: 1.5967444147064669
Energy: 1.4789402887155727
Energy: 1.4840969821873589
Energy: 1.328612124468491
Energy: 1.1261445192857293
Energy: 1.1266490355863643
Energy: 1.0926516277055345
Energy: 1.126563181025326
Energy: 1.1266309559607033
Energy: 1.136301958923577
Energy: 1.106969403425858
Energy: 1.1074156026543605
Energy: 1.0927064089767495
Energy: 1.1065369375139962
Energy: 1.1075416734091752
Energy: 1.4852931816195896
Energy: 1.0698578035079598
Energy: 1.1865398453201197
Energy: 1.0686323194933018
Energy: 1.2954714420767415
Energy: 1.3082775354452487
Energy: 1.3141168988519145
Energy: 1.161195205229418
Energy: 1.3359999831225962
Energy: 1.1574881391854173
Energy: 1.2019937477885239
Energy: 1.2466951402718496
Energy: 1.1739115120462145
Energy: 1.4292398044490273
Energy: 1.249752216455188
Energy: 1.1742796072912052
Energy: 1.4225691487050822
Energy: 1.1204413027689832
Energy: 1.1715076658433785
Energy: 1.0950400674714755
Energy: 1.2136579101611362
Energy: 1.1719951668815487
Energy: 1.1165841230615916
Energy: 1.1724213172727298
Energy: 1.1627060395499764
Energy: 1.295152238543074
Energy: 1.1645755702198515
Energy: 1.163419280439936
Energy: 1.290587162835683
Energy: 1.1598093016397846
Energy: 1.1079149942591227
Energy: 1.141890505883124
Energy: 1.2307634062584676
Energy: 1.0991405347438552
Energy: 1.183042876629519
Energy: 1.1382829644314212
Energy: 1.7488793092368233
Energy: 1.1975908468316867
Energy: 1.1649504954530792
Energy: 0.9752942815562003
Energy: 1.2713322702121774
Energy: 1.1551802355809437
Energy: 1.0532603171975776
Energy: 1.1589968154697359
Energy: 1.1590883178593572
Energy: 0.9753872327257423
Energy: 1.1587634612740048
Energy: 1.158861947873724
Energy: 1.1087379408804905
Energy: 1.176201879940218
Energy: 1.1765734679279503
Energy: 1.1159737635743447
Energy: 1.1756181881299244
Energy: 1.1750606186006294
Energy: 2.0103381870826187
Energy: 1.1449444047125636
Energy: 1.4692646437399153
Energy: 1.3153431969608596
Energy: 1.1419108700922052
Energy: 1.4685254024911933
Energy: 1.2284155916244999
Energy: 1.1714876454696432
Energy: 1.1333520886614326
Energy: 1.1165494630663864
Energy: 1.171872206753238
Energy: 1.1082157198681013
Energy: 1.1074132783571864
Energy: 1.1751738392897333
Energy: 1.1814127840705488
Energy: 1.1070129336507557
Energy: 1.174446093034373
Energy: 1.3672905095699266
Energy: 1.1269891009704656
Energy: 1.140104800210134
Energy: 1.1507387661319535
Energy: 1.1281082140450984
Energy: 1.1257699154949092
Energy: 1.126448357058904
Energy: 1.1258900922924857
Energy: 1.2740782162436308
Energy: 1.1754992134642142
Energy: 1.1260151072294486
Energy: 1.1430019395032593
Energy: 1.1267330170320145
Energy: 1.1366303376487985
Energy: 1.1266134965155439
Energy: 1.1750246989687743
Energy: 1.1378864094152834
Energy: 1.1620787899667633
Energy: 1.1740084910391493
Energy: 1.1357207781295777
Energy: 1.1269252095848654
Energy: 1.1102170026082872
Energy: 1.1076601765521163
Energy: 1.1245769446337788
Energy: 1.1619261529596268
Energy: 1.1361287616599034
Energy: 1.1063665488845857
Energy: 1.1070978651658236
Energy: 1.1060596399958507
Energy: 1.1058401994353744
Energy: 1.135788528440443
Energy: 1.1361683629609125
Energy: 1.10806777439543
Energy: 1.107876117130321
Energy: 1.108211148252713
Energy: 1.1079127924668946
Energy: 1.1281044814625303
Energy: 1.1988941409619305
Energy: 1.1251361490404932
Energy: 1.1842321341614694
Energy: 1.2015116602258031
Energy: 1.1383069956542855
Energy: 1.0813786694902854
Energy: 1.1916620958696438
Energy: 1.1261453960085983
Energy: 1.1264392866368318
Energy: 1.2089400531451318
Energy: 1.12591367483262
Energy: 1.2564422431299915
Energy: 1.1361396277952727
Energy: 1.1069177688492593
Energy: 1.1071767625415339
Energy: 1.1241443342980997
Energy: 1.10702610572707
Energy: 1.1078470468924324
Energy: 1.476202362919591
Energy: 1.1066416052157135
Energy: 1.3116679452906996
Energy: 1.3556505114753399
Energy: 1.1141472144449847
Energy: 1.3519666958384937
Energy: 1.4070676110537013
Energy: 1.0962890144033126
Energy: 1.086377110533024
Energy: 1.1339666231751517
Energy: 1.0897058970918965
Energy: 1.1741509303372477
Energy: 1.297888590000674
Energy: 1.5199729848772223
Energy: 1.5185856873811732
Energy: 1.2976737315715592
Energy: 1.5190481495349977
Energy: 1.282262403288031
Energy: 1.1771347956856142
Energy: 1.1995882828837827
Energy: 1.1617283839451624
Energy: 1.1754857939632755
Energy: 1.0966172672731733
Energy: 1.1747894947689121
Energy: 1.159683599499309
Energy: 1.206894834768188
Energy: 1.1971402211688829
Energy: 1.1595823357422315
Energy: 1.1419081466394692
Energy: 1.1602831361382833
Energy: 1.2713206685372287
Energy: 1.2946474673275343
Energy: 1.23092863303587
Energy: 1.2715681138258121
Energy: 1.2905563663996757
Energy: 1.1649645159418736
Energy: 1.0525470573977855
Energy: 1.1654277628428984
Energy: 1.1647126461694999
Energy: 1.0817272379790255
Energy: 1.1971040494296357
Energy: 1.25894233497507
Energy: 1.7489333022448517
Energy: 1.1592188809269997
Energy: 1.1580318319715739
Energy: 1.0258336329874584
Energy: 1.1584780440554878
Energy: 1.1547260596350877
Energy: 1.126504935202026
Energy: 1.1712169219461055
Energy: 1.17137529841997
Energy: 1.116069677377083
Energy: 1.1710764614403864
Energy: 1.1710359606821543
Energy: 1.472661390181225
Energy: 1.1755485581290335
Energy: 1.1755899428941803
Energy: 1.1033395945889506
Energy: 1.175699812842311
Energy: 1.128306873461497
Energy: 1.12359170827373
Energy: 1.1758512333698499
Energy: 1.1756787500152621
Energy: 1.1039332076673245
Energy: 1.1758756792250837
Energy: 1.3377863636228515
Energy: 1.2952550459518952
Energy: 1.1480058500397867
Energy: 1.0936326751303476
Energy: 1.2954201499402933
Energy: 1.1489634738119727
Energy: 1.1890527440529222
Energy: 1.1298268579173671
Energy: 1.0935706676995463
Energy: 1.104955937902664
Energy: 1.1305175348763383
Energy: 1.1217059574706278
Energy: 1.1074096103580695
Energy: 1.1251081704964585
Energy: 1.1238216832529169
Energy: 1.0790752810661113
Energy: 1.1253220194923825
Energy: 1.1133629826614593
Energy: 1.1259679003227683
Energy: 1.531059101219594
Energy: 1.486589264140789
Energy: 1.4865487109896638
Energy: 1.5309733002678043
Energy: 1.4859566168892588
Energy: 1.1333847428361028
Energy: 1.1349738385122068
Energy: 1.124368330307945
Energy: 1.0790921590437792
Energy: 1.1250287955765164
Energy: 1.1048690360588072
Energy: 1.1570173897321774
Energy: 1.1349529049804317
Energy: 1.1086369167753718
Energy: 1.0797132565220655
Energy: 1.1157553796976323
Energy: 1.1082253428388456
Energy: 1.1182292775285398
Energy: 1.1361050759354128
Energy: 1.1070011939294604
Energy: 1.1068067604088605
Energy: 1.1079096357872615
Energy: 1.1065646718011672
Energy: 1.1349859179252086
Energy: 1.191472378900372
Energy: 1.1259859312773683
Energy: 1.1263834189282897
Energy: 1.2067196924707326
Energy: 1.1258781338313673
Energy: 1.2567059962170144

minimum gb energy = 0.9752942815562003 eV
minimum distance =  2.25859381671004 Angstroms
sigma value = 57


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

Energy: 0.6736278637356135
Energy: 0.6645242716594918
Energy: 0.6451547090020306
Energy: 0.5295206816265705
Energy: 0.9507312495075503
Energy: 0.6751637508076985
Energy: 0.6745610689290382
Energy: 0.8511576444301427
Energy: 0.8533502224129604
Energy: 0.8162286586550163
Energy: 0.8219193858924616
Energy: 0.8693771147888896
Energy: 0.9151566193198222
Energy: 0.8616167982229548
Energy: 0.8608449054816775
Energy: 0.8717023965458102
Energy: 0.8610132183779731
Energy: 0.8603124322370405
Energy: 0.9161669290578982
Energy: 0.8534654738825953
Energy: 0.8705430998473724
Energy: 0.8703296099161139
Energy: 0.8704183782014892
Energy: 0.8542138620630249
Energy: 0.9118844185158784
Energy: 0.5266633415752859
Energy: 0.574906269615517
Energy: 0.9359527083203324
Energy: 0.5263434544052739
Energy: 0.895861099010631
Energy: 0.8636152325284968
Energy: 0.526324608924905
Energy: 0.52671413105292
Energy: 0.9083346800874562
Energy: 0.5262271405461815
Energy: 0.574383061706017
Energy: 0.8580565837505699
Energy: 0.8181472500485119
Energy: 0.8763031269098494
Energy: 0.8589468334456808
Energy: 0.8573608140364433
Energy: 0.8934936861532042
Energy: 0.8641202985320448
Energy: 0.9391517503765949
Energy: 0.9384959419973579
Energy: 0.863814811996655
Energy: 0.9392163353472253
Energy: 0.8640977624021218
Energy: 0.9267452854407274
Energy: 0.8973975613646579
Energy: 0.8601864234554021
Energy: 0.8579431805504032
Energy: 0.8614044047451986
Energy: 0.8592234722030427
Energy: 0.5260573782939764
Energy: 0.8645813785157046
Energy: 0.5765536261504239
Energy: 0.5261656593826116
Energy: 0.8648240637824613
Energy: 0.5289105246352714
Energy: 0.5261800755153047
Energy: 0.8269031610062161
Energy: 0.8280250152822528
Energy: 0.5263159082053095
Energy: 0.8264054944772536
Energy: 0.5747959762130819
Energy: 0.9301104746422064
Energy: 0.8625118698380813
Energy: 0.8981560467042
Energy: 0.9454562372275519
Energy: 0.8617678879914477
Energy: 0.8983132704093935
Energy: 0.9292279040399989
Energy: 0.9367029696433646
Energy: 0.9364895217740467
Energy: 0.9374573488464735
Energy: 0.9315728074325728
Energy: 0.9372194115007731
Energy: 0.926063481687924
Energy: 0.8570316647988524
Energy: 0.8577036455315066
Energy: 0.9282870599749137
Energy: 0.857324736367837
Energy: 0.8594508970010726
Energy: 0.9047264469151679
Energy: 0.5259640333281844
Energy: 0.5261477426309924
Energy: 0.8455650209602606
Energy: 0.5263030542365268
Energy: 0.5270340920144411
Energy: 0.8478015659110526
Energy: 0.8711189689299201
Energy: 0.8996069199512119
Energy: 0.8698204773418529
Energy: 0.5263601319841527
Energy: 0.8451069150761507
Energy: 0.8488891519106601
Energy: 0.8150467542790515
Energy: 0.9026623786750582
Energy: 0.8711542829406403
Energy: 0.8611996423622981
Energy: 0.8496255728543537
Energy: 0.9490925094135673
Energy: 0.9322076035898814
Energy: 0.9298279305395294
Energy: 0.9393078331246452
Energy: 0.8605781174234888
Energy: 0.8545638467343893
Energy: 0.6745206691868835
Energy: 0.99204133899913
Energy: 0.9571961715072612
Energy: 0.5263334207481256
Energy: 1.003813465692691
Energy: 0.8592047192466838

minimum gb energy = 0.5259640333281844 eV
minimum distance =  2.36471596452455 Angstroms
sigma value = 11


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

Energy: 1.8431586440473267
Energy: 1.8859920271105837
Energy: 1.2634647512714174
Energy: 1.6381444094744753
Energy: 1.315309313165594
Energy: 1.2629037650229495
Energy: 0.9559676575633713
Energy: 0.9240011331043894
Energy: 0.978333928849427
Energy: 0.9852471159736885
Energy: 0.9238950354025464
Energy: 1.0208377645144386
Energy: 0.9247758285981477
Energy: 0.9254533941437553
Energy: 0.9544109834769993
Energy: 0.9262549516165935
Energy: 0.9260200484133263
Energy: 0.9545723429358569
Energy: 0.9247469877000283
Energy: 1.0056194455920615
Energy: 1.0582522111137966
Energy: 0.9258968072693712
Energy: 0.9274214962017987
Energy: 0.9528847325955628
Energy: 0.9260972802800973
Energy: 1.0726310924916982
Energy: 1.0239179552407558
Energy: 0.9259637690886383
Energy: 1.148424729283731
Energy: 0.9805306359529892
Energy: 1.2438435568448576
Energy: 1.3256134685008367
Energy: 1.3265970470052852
Energy: 1.2435100135616486
Energy: 1.325368534524227
Energy: 1.0127604706398154
Energy: 1.0026558434188277
Energy: 0.9682500373948614
Energy: 1.0394322827544564
Energy: 0.9248159628923294
Energy: 1.0109161550045558
Energy: 1.0087820014281912
Energy: 0.9557414036128826
Energy: 1.0176741852292435
Energy: 1.0187187925781305
Energy: 0.9564035015223615
Energy: 1.0171943739586897
Energy: 1.1927334864836963
Energy: 1.2407386250800136
Energy: 1.010059164351095
Energy: 0.9545534874311256
Energy: 0.9563007910466278
Energy: 1.009970453524734
Energy: 0.9466455814244213
Energy: 1.5875505380548371
Energy: 1.0141332045182918
Energy: 1.0147591113374532
Energy: 1.4896936065689845
Energy: 1.0145516872870743
Energy: 1.146132999894327
Energy: 1.3107721836610073
Energy: 1.009823911986954
Energy: 1.0367479215355204
Energy: 1.1468845845893028
Energy: 1.2364920732367457
Energy: 1.0365889497957739
Energy: 1.2415181298460747
Energy: 0.8897615334243203
Energy: 1.0053547060376409
Energy: 1.2410237860020519
Energy: 0.8934252825195749
Energy: 0.9846856873665715
Energy: 1.153473988324976
Energy: 0.8911749273930422
Energy: 1.0407808676347892
Energy: 1.1538586219752174
Energy: 0.8936313690538422
Energy: 1.1536322374180854
Energy: 1.150059661358757
Energy: 0.9840303637168614
Energy: 1.1049097930148846
Energy: 1.1481959534794832
Energy: 1.0823022142610552
Energy: 1.0903929457383212
Energy: 1.148130559878047
Energy: 1.481376873002932
Energy: 1.484531971168691
Energy: 1.1483351426114403
Energy: 1.4721748223302105
Energy: 1.148086202074235
Energy: 1.5809387273889723
Energy: 1.0605540016497097
Energy: 1.0041708585443507
Energy: 1.4039341312634301
Energy: 1.1485221398779717
Energy: 1.1230133973156406
Energy: 1.3685618988055657
Energy: 1.4871477638835775
Energy: 1.329934701931285
Energy: 1.3354327944039075
Energy: 1.6037532862229769
Energy: 1.163206838243465
Energy: 1.6328670894736896
Energy: 1.1469599688199112
Energy: 1.1441268922703107
Energy: 1.1300620786630213
Energy: 1.146964156944639
Energy: 1.0511130368847608
Energy: 1.3410322559978014
Energy: 1.062841701579805
Energy: 1.0625237458301895
Energy: 1.0112852170875126
Energy: 1.149065159252754
Energy: 1.0345842520237443
Energy: 1.1617309643828777
Energy: 1.3581434933572483
Energy: 1.177955140103622
Energy: 1.1582418104489218
Energy: 1.339632056156891
Energy: 1.2633736873457215
Energy: 1.5803682512670163
Energy: 1.1359476478567838
Energy: 1.003586721063283
Energy: 1.1680714602724083
Energy: 1.1644981272113335
Energy: 1.0363376045899422
Energy: 1.0137825468121129
Energy: 1.4145978815801332
Energy: 1.4152993161516279
Energy: 1.0138738930779871
Energy: 1.338069742526377
Energy: 1.2040907851932117
Energy: 1.0130437408428696
Energy: 0.9503961937455614
Energy: 1.0240847623657263
Energy: 1.0129286463988827
Energy: 0.9943009354358937
Energy: 1.0261044659787983
Energy: 1.0156817076759006
Energy: 0.9559795023710843
Energy: 1.011549499470504
Energy: 1.018072086136458
Energy: 0.9279079411440528
Energy: 1.0120197528964592
Energy: 0.9248322277925299
Energy: 0.924793479734641
Energy: 0.9253109021915157
Energy: 0.9262920518438327
Energy: 0.9260603762720988
Energy: 1.044584828450234
Energy: 1.529991488620694
Energy: 0.9526866282385897
Energy: 0.9796195793283173
Energy: 1.1665718131513483
Energy: 0.9274896386531176
Energy: 0.9488293015643839

minimum gb energy = 0.8897615334243203 eV
minimum distance =  2.32727078635363 Angstroms
sigma value = 41


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

Energy: 1.7899026013902526
Energy: 1.0671342978158538
Energy: 1.0671013791373778
Energy: 1.4254004443985993
Energy: 1.1148025079474873
Energy: 1.3667711906168412
Energy: 1.0723978067060276
Energy: 1.0224362095279886
Energy: 1.089036702833242
Energy: 1.0476395332210435
Energy: 1.0222837251726604
Energy: 1.0560590671962933
Energy: 1.025151625480162
Energy: 1.0256972145859378
Energy: 1.0260357222425007
Energy: 1.02499012482508
Energy: 1.0245683372532437
Energy: 1.0825164199240704
Energy: 1.0243432089346072
Energy: 1.1039581129602678
Energy: 1.1031977076695711
Energy: 1.0240407117328874
Energy: 1.0230337324264718
Energy: 1.0662046176779094
Energy: 1.0230624768773486
Energy: 1.1530399518078571
Energy: 1.1092051892155468
Energy: 1.022978511444044
Energy: 1.1163594865534407
Energy: 1.0822116138178213
Energy: 1.44585974388623
Energy: 1.205818319034149
Energy: 1.166354041760143
Energy: 1.4444694367509614
Energy: 1.2056661688658792
Energy: 1.1669337893819542
Energy: 1.1472779789689531
Energy: 1.0252643075289742
Energy: 1.0235260632813143
Energy: 1.0228703543960138
Energy: 1.067545851120911
Energy: 1.126418338262652
Energy: 1.0729738361179677
Energy: 1.1900781224282853
Energy: 1.190242303702644
Energy: 1.073500770551848
Energy: 1.1900197914999506
Energy: 1.104774311856346
Energy: 1.4409566720711127
Energy: 1.133153963054872
Energy: 1.076641758088648
Energy: 1.0593439167906427
Energy: 1.1174760077674069
Energy: 1.056097121793662
Energy: 1.3932900229480976
Energy: 1.1666584431902993
Energy: 1.1668728266501438
Energy: 1.2996507341002903
Energy: 1.1665589241140797
Energy: 1.0248552171876166
Energy: 1.4586700434299096
Energy: 1.024435750416176
Energy: 1.0571547263340706
Energy: 1.0223712464582848
Energy: 1.0486743951700588
Energy: 1.1162010095789177
Energy: 1.6262229111683362
Energy: 1.0067319296088846
Energy: 1.1222459270022946
Energy: 1.4427774892846248
Energy: 0.9691180563828606
Energy: 1.0627916401082598
Energy: 1.1668443042930814
Energy: 0.9700645425112933
Energy: 1.3413169395580047
Energy: 1.166876504736275
Energy: 0.9697790855293362
Energy: 1.3414183906086357
Energy: 1.1175776463317029
Energy: 1.1021890757170225
Energy: 1.05508838944081
Energy: 1.1178102911260908
Energy: 1.0830725362381235
Energy: 1.0898606852432415
Energy: 1.1763380856763577
Energy: 1.297580917125853
Energy: 1.2957042489982382
Energy: 1.1768493345255424
Energy: 1.3054220427528982
Energy: 1.1764268076176068
Energy: 1.022424420066152
Energy: 1.0239645079063535
Energy: 1.1260164164854358
Energy: 1.0864236050322622
Energy: 1.0226500317745009
Energy: 1.0236454706777482
Energy: 1.7127774891074037
Energy: 1.5535674899867011
Energy: 0.9701806343935291
Energy: 1.4093472188399183
Energy: 1.5153590867535536
Energy: 1.3756828728764177
Energy: 1.0718059149524881
Energy: 1.0231199876377715
Energy: 1.0899132567677932
Energy: 1.2612152460545798
Energy: 1.0229623113660753
Energy: 1.0481933236699914
Energy: 1.023471607379625
Energy: 1.0254351138782984
Energy: 1.0260265147252752
Energy: 1.0232955151580612
Energy: 1.024165284575007
Energy: 1.094103387996722
Energy: 1.0252026981490072
Energy: 1.0941431880057462
Energy: 1.0218891387401856
Energy: 1.025428215281865
Energy: 1.0237649915075142
Energy: 1.025373700774222
Energy: 1.022365954914757
Energy: 1.0750867406380873
Energy: 1.058154920543663
Energy: 1.0223100247308805
Energy: 1.1339836490038886
Energy: 1.1262252024442043
Energy: 1.706339246904515
Energy: 1.20600867606244
Energy: 1.2054638046774724
Energy: 1.7059107466422536
Energy: 1.6732689896766486
Energy: 1.2052757831159857
Energy: 1.439431765078273
Energy: 1.0751570449673482
Energy: 1.0581955870245783
Energy: 1.0222664538410011
Energy: 1.1576342543938989
Energy: 1.1262839919852436
Energy: 1.0726981251873478
Energy: 1.203018455344162
Energy: 1.1964388268948125
Energy: 1.073220445971026
Energy: 1.1767380579782343
Energy: 1.182895448529559
Energy: 1.4415065091722485
Energy: 1.0246297378984464
Energy: 1.05661548550593
Energy: 1.0228609785822278
Energy: 1.118723106300404
Energy: 1.0556362990686743
Energy: 1.4583789574711146
Energy: 1.024189653242945
Energy: 1.0249730482466506
Energy: 1.0223085054969743
Energy: 1.1665854797726711
Energy: 1.1160961972795593
Energy: 1.3934625076394058
Energy: 1.166718561534418
Energy: 1.0240946088868863
Energy: 1.2999580373050563
Energy: 1.4409719616830277
Energy: 1.0571672298561219
Energy: 1.4413424477829668
Energy: 1.0073653791625563
Energy: 1.1156999696769023
Energy: 1.0256389858539132
Energy: 0.9685787960874361
Energy: 1.0558195779422992
Energy: 1.1667697811859556
Energy: 1.4206745140689432
Energy: 1.3795874789104692
Energy: 1.1666847903160296
Energy: 1.4185842212111222
Energy: 1.3791785973156383
Energy: 1.1167448121758872
Energy: 1.055310163271763
Energy: 1.1494996286899748
Energy: 1.117044605148607
Energy: 1.0563995490833669
Energy: 1.1491935896612961
Energy: 1.188957932781743
Energy: 1.2737995359563485
Energy: 1.1610951567899714
Energy: 1.189440715550722
Energy: 1.306486079180507
Energy: 1.1604052869606332
Energy: 1.0226891200236659
Energy: 1.0265840440485794
Energy: 1.09301044525097
Energy: 1.022711513135785
Energy: 1.023148916218953
Energy: 1.0669089250083201
Energy: 1.7127351390545595
Energy: 1.0495526643388613
Energy: 0.9697905605485803
Energy: 1.4095110794959969
Energy: 1.4427696095234772
Energy: 1.0481567629019235

minimum gb energy = 0.9685787960874361 eV
minimum distance =  2.31546939095309 Angstroms
sigma value = 33


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

Energy: 1.3812507122090858
Energy: 1.1200222440984893
Energy: 1.120428809608736
Energy: 1.3843341066511037
Energy: 1.3325316689965563
Energy: 1.1207920374996538
Energy: 1.2960161568946371
Energy: 1.123066710578652
Energy: 1.0871040120400735
Energy: 1.0885750500981033
Energy: 1.126074314888786
Energy: 1.0868416759754673
Energy: 1.130805627881973
Energy: 1.090914966937687
Energy: 1.0917798434585668
Energy: 1.1309138702344033
Energy: 1.1792780008019323
Energy: 1.094685969584442
Energy: 1.1336471886673858
Energy: 1.1328588138072306
Energy: 1.0908764505166044
Energy: 1.1310641292991834
Energy: 1.1769754740557772
Energy: 1.0895084131532908
Energy: 1.1273779033810485
Energy: 1.0915662324449034
Energy: 1.0537117928735817
Energy: 1.1234930442119528
Energy: 1.1331985034663694
Energy: 1.190482260526476
Energy: 1.2325551304983773
Energy: 1.0606115911411624
Energy: 1.0607715428447206
Energy: 1.2321405726773986
Energy: 1.49172905142048
Energy: 1.0603386552316354
Energy: 1.2945875858685771
Energy: 1.053734589199394
Energy: 1.0916373058327267
Energy: 1.1279897061286654
Energy: 1.090620501067588
Energy: 1.0889738684003272
Energy: 1.1922736665253653
Energy: 1.1023864119362754
Energy: 1.1288824569856755
Energy: 1.1999312436006309
Energy: 1.103777717327221
Energy: 1.0917625810907587
Energy: 1.197349319654356
Energy: 1.0511997188214584
Energy: 1.0510855937611738
Energy: 1.20545954916903
Energy: 1.0538532705071413
Energy: 1.0512745008681148
Energy: 1.2949785583209943
Energy: 1.057142207544176
Energy: 1.0607432960120433
Energy: 1.1305449187039833
Energy: 1.0600877852696358
Energy: 1.0543979157080698
Energy: 1.2950947267568869
Energy: 1.1719417074037368
Energy: 1.0910222233267306
Energy: 1.1321317725794384
Energy: 1.1395406124841743
Energy: 1.0907452753267772
Energy: 1.1950352865189664
Energy: 1.0528681679358871
Energy: 1.0517229958500582
Energy: 1.194602039433168
Energy: 1.057295735162026
Energy: 1.052573682468376
Energy: 1.126272295818114
Energy: 1.053096859228182
Energy: 1.0515974935086745
Energy: 1.1260206693364856
Energy: 1.0566444692119863
Energy: 1.214716800290024
Energy: 1.1284026565883705
Energy: 1.1699037070266678
Energy: 1.0897266553479068
Energy: 1.1299204009049078
Energy: 1.2119432638562506
Energy: 1.0885205092602768
Energy: 1.0530280963459073
Energy: 1.2114601095388762
Energy: 1.1286985509710064
Energy: 1.1309351030378447
Energy: 1.1803117632018794
Energy: 1.0909678259826494
Energy: 1.1241719154742862
Energy: 1.1260242192168939
Energy: 1.1784476710067173
Energy: 1.1375109278983502
Energy: 1.1283577206912025
Energy: 1.0886606073467269
Energy: 1.6414822904783386
Energy: 1.160892993025957
Energy: 1.3802966359992614
Energy: 1.4907006070678348
Energy: 1.1640633651145424
Energy: 1.0553799745775456
Energy: 1.1973502362609945
Energy: 1.1253465988133877
Energy: 1.186877253342175
Energy: 1.130427733869721
Energy: 1.20700629586128
Energy: 1.0513756710270215
Energy: 1.1313678098406077
Energy: 1.0542647373206566
Energy: 1.0537751356477236
Energy: 1.132573222270019
Energy: 1.1999321558917373
Energy: 1.0882223697260622
Energy: 1.0547108621732206
Energy: 1.0514711529383847
Energy: 1.051388593921463
Energy: 1.054386950779167
Energy: 1.1998697854894962
Energy: 1.093655557440454
Energy: 1.0535515339623405
Energy: 1.089369108255573
Energy: 1.0517763411082126
Energy: 1.054370185722044
Energy: 1.1792008476506666
Energy: 1.0532946684488544
Energy: 1.349667810562971
Energy: 1.0630373337950223
Energy: 1.0618417532266762
Energy: 1.3498098475108335
Energy: 1.1675150821098506
Energy: 1.3804670291099932
Energy: 1.2224467373773802
Energy: 1.1234012668899591
Energy: 1.090866139241536
Energy: 1.0889087868331937
Energy: 1.125081436357598
Energy: 1.0518600616217915
Energy: 1.2000986014949315
Energy: 1.869886798695822
Energy: 1.3908372966171965
Energy: 1.0492277794839528
Energy: 1.820252410677041
Energy: 1.0595766756433362
Energy: 1.2955841778986412
Energy: 1.1228957539741835
Energy: 1.0885457373201226
Energy: 1.0547748064526699
Energy: 1.1239977473634617
Energy: 1.088717250716045
Energy: 1.134922539565526
Energy: 1.1802948026460471
Energy: 1.0884309891050157
Energy: 1.130243288705741
Energy: 1.1309395454232327
Energy: 1.0940623823625002
Energy: 1.1307334149777066
Energy: 1.0925735355961614
Energy: 1.129007641228471
Energy: 1.130553076530596
Energy: 1.1794480366392073
Energy: 1.0898028627470424
Energy: 1.1262281618984478
Energy: 1.052814026858622
Energy: 1.051044990898242
Energy: 1.1268914142574213
Energy: 1.1313214285957327
Energy: 1.0874804349473797
Energy: 1.494246433848002
Energy: 1.0608169623251322
Energy: 1.0609823639558444
Energy: 1.4941166025536181
Energy: 1.4911011611503604
Energy: 1.0618623379606336
Energy: 1.1971407228857909
Energy: 1.0515756521567508
Energy: 1.0511583556519681
Energy: 1.1265140257442392
Energy: 1.0901896849396446
Energy: 1.0899948691741583
Energy: 1.1933600680466723
Energy: 1.090792878120535
Energy: 1.070439549128073
Energy: 1.1988466840515095
Energy: 1.090776077963462
Energy: 1.0683511586872385
Energy: 1.199667577205939
Energy: 1.0540871420848543
Energy: 1.052856040220261
Energy: 1.126284961111313
Energy: 1.0556848529902814
Energy: 1.0518483634632085
Energy: 1.295404459446223
Energy: 1.138020934832216
Energy: 1.1378373004904252
Energy: 1.1304262782072314
Energy: 1.1406804601325984
Energy: 1.0930432023591157
Energy: 1.294720980966201
Energy: 1.089556293244906
Energy: 1.091339253200928
Energy: 1.1359042396379007
Energy: 1.3772908079880568
Energy: 1.0925531637042991
Energy: 1.199608321999389
Energy: 1.0529998651115966
Energy: 1.0520409751792594
Energy: 1.2008169628850338
Energy: 1.0563385987338216
Energy: 1.051368460436344
Energy: 1.1326304041994617
Energy: 1.2138591469360236
Energy: 1.0493859422889789
Energy: 1.1331364760178706
Energy: 1.0491322338472089
Energy: 1.0492960030792384
Energy: 1.1248573284854733
Energy: 1.170926483161812
Energy: 1.0901919659461041
Energy: 1.1259828085652792
Energy: 1.2115408496989148
Energy: 1.0881856220980988
Energy: 1.0785761419879907
Energy: 1.090923873705546
Energy: 1.090311920302927
Energy: 1.0785761979968091
Energy: 1.1315653751266075
Energy: 1.0902360204217882
Energy: 1.125006795891195
Energy: 1.1770924981886477
Energy: 1.1780745925985272
Energy: 1.1383461146255243
Energy: 1.1299296039848798
Energy: 1.087440424119559
Energy: 1.6416696256483385
Energy: 1.1242355325421383
Energy: 1.1609893369890842
Energy: 1.4917602281151856
Energy: 1.1244698705523
Energy: 1.0521546691371781
Energy: 1.1965802016228675
Energy: 1.2431692157559324
Energy: 1.1603579375386484
Energy: 1.132720649053402
Energy: 1.2067096294338666
Energy: 1.054158879155172
Energy: 1.128682913045495
Energy: 1.2917335277998387
Energy: 1.0527190548598435
Energy: 1.1439807917712204
Energy: 1.1993670237537615
Energy: 1.0923268344682087
Energy: 1.0580197300496934
Energy: 1.0496088513729926
Energy: 1.0531930184283842
Energy: 1.1387944576980034
Energy: 1.2001688351937316
Energy: 1.0527110522201162
Energy: 1.051569602495725
Energy: 1.0517700682295814
Energy: 1.0546076438854475
Energy: 1.0524035988443337
Energy: 1.1731573436532947
Energy: 1.0508334379543873
Energy: 1.175428264986617
Energy: 1.063903436794125
Energy: 1.091114543090746
Energy: 1.1740885937359438
Energy: 1.1615871726277287
Energy: 1.0963187074851783
Energy: 1.1236556493537704
Energy: 1.1789733177828885
Energy: 1.0893248324482832
Energy: 1.0550861819462032
Energy: 1.125424802055831
Energy: 1.0876674732188798
Energy: 1.3886867987313039
Energy: 1.4556179219914476
Energy: 1.0494276126220066
Energy: 1.0516323110632053
Energy: 1.4563864648742473
Energy: 1.133782024913112

minimum gb energy = 1.0491322338472089 eV
minimum distance =  2.30680980370696 Angstroms
sigma value = 67


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

Energy: 1.6058706699544207
Energy: 1.1097702801100033
Energy: 1.1096637625081833
Energy: 1.6099609640616757
Energy: 2.317992989629727
Energy: 1.1096101292259284
Energy: 1.3695735743499193
Energy: 1.1230328343982432
Energy: 1.1226543172081382
Energy: 1.2313282372761607
Energy: 1.19940742192381
Energy: 1.114127424353264
Energy: 1.358527100595049
Energy: 1.0727424485419041
Energy: 1.1273504490028903
Energy: 1.2332203531590031
Energy: 1.0726058091544401
Energy: 1.1273046197814194
Energy: 1.2302930450595537
Energy: 1.1250447389304243
Energy: 1.1247494506167308
Energy: 1.2304258529765066
Energy: 1.141049349497965
Energy: 1.1247383177248598
Energy: 1.2099222713262474
Energy: 1.1426248879596197
Energy: 1.1427210370953422
Energy: 1.2104672823883647
Energy: 1.1425508600303218
Energy: 1.1434647874492911
Energy: 1.21167070719487
Energy: 1.0894520381554988
Energy: 1.2123140154781638
Energy: 1.2118669650567957
Energy: 1.3492647357186072
Energy: 1.2117546707233466
Energy: 1.364705679457087
Energy: 1.141956334818381
Energy: 1.1387423194591606
Energy: 1.3647320126748308
Energy: 1.2109488091347982
Energy: 1.1123859511127068

minimum gb energy = 1.0726058091544401 eV
minimum distance =  2.35654721336397 Angstroms
sigma value = 3


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

Energy: 2.113734622785265
Energy: 1.5518849437852353
Energy: 1.3909809609324162
Energy: 1.6433650942367186
Energy: 1.6017741089504767
Energy: 1.402903262349534
Energy: 1.1840148513797675
Energy: 1.3588633040298586
Energy: 1.305497482076866
Energy: 1.3028470509282999
Energy: 1.4492037128385917
Energy: 1.1938164492289605
Energy: 1.2566022935374375
Energy: 1.18546883134778
Energy: 1.1845976220988337
Energy: 1.2568500448344468
Energy: 1.1853551572275738
Energy: 1.1931068066339672
Energy: 1.1996149193916485
Energy: 1.1932015527992077
Energy: 1.192981157441276
Energy: 1.1997675258942417
Energy: 1.1845012607008691
Energy: 1.192934327834947
Energy: 1.1916053998802791
Energy: 1.1946453358489888
Energy: 1.1943187789809657
Energy: 1.1922418655081073
Energy: 1.261103413651554
Energy: 1.1932236614357266
Energy: 1.1922676082531662
Energy: 1.2612859976181217
Energy: 1.1951677197332506
Energy: 1.1926794745839757
Energy: 1.2910352806995047
Energy: 1.1942806663961525
Energy: 1.1922872678836665
Energy: 1.4212724659197833
Energy: 1.248604932710971
Energy: 1.2809952202051946
Energy: 1.425964925424956
Energy: 1.217821271464826
Energy: 1.954609052764593
Energy: 1.6171758117037187
Energy: 1.3796664474335838
Energy: 1.9588489015000583
Energy: 1.616289088268942
Energy: 1.3968471656260095
Energy: 1.1948959122456246
Energy: 1.2214431860373662
Energy: 1.298321004327885
Energy: 1.2551132756455228
Energy: 1.358036231339746
Energy: 1.2151395232590783
Energy: 1.7852434118784963
Energy: 1.2259366344628773
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Energy: 1.706410449944741
Energy: 1.2264068254578664
Energy: 1.3519872052078208
Energy: 1.3728183838001338
Energy: 1.2458756505703312
Energy: 1.2463367766853644
Energy: 1.3743392328670019
Energy: 1.374725074024885
Energy: 1.2357157864471957
Energy: 1.3655090383680206
Energy: 1.2466359507625209
Energy: 1.1958540034515626
Energy: 1.3426653672765059
Energy: 1.1947932395446015
Energy: 1.1968300640441338
Energy: 1.3499157930062295
Energy: 1.1949529404785508
Energy: 1.1968353353036347
Energy: 1.3293986411745369
Energy: 1.1943817643813375
Energy: 1.197088080648773
Energy: 1.3387564359781448
Energy: 1.1942653529283314
Energy: 1.1943289019753682
Energy: 1.3408601914841567
Energy: 1.2013712634017004
Energy: 1.1948691957432651
Energy: 1.7238985313692103
Energy: 1.1965324996131077
Energy: 1.1966779801581837
Energy: 1.2918474124177042
Energy: 1.1961130288964952
Energy: 1.1969437900369473
Energy: 1.4516663589737542
Energy: 1.1958404362671315
Energy: 1.2587881972737276
Energy: 1.453921718771057
Energy: 1.2529956724812437
Energy: 1.2583112596555535
Energy: 1.5891906162807374
Energy: 1.2806674170193035
Energy: 1.2809632934028956
Energy: 1.5764116835271655
Energy: 1.217949699044952
Energy: 1.4317643442812993
Energy: 1.3838229666240576
Energy: 1.2659077228046751
Energy: 1.266870704731086
Energy: 1.3837643751387345
Energy: 1.4088532205895399
Energy: 1.2656779807339884
Energy: 1.5371645638793834
Energy: 1.4373083981903676
Energy: 1.239044497107522
Energy: 1.380413094919455
Energy: 1.1945204667159606
Energy: 1.1933714692050565
Energy: 1.5950362633545165
Energy: 1.2662695634552723
Energy: 1.2390686876903287
Energy: 1.3106862203937915
Energy: 1.267106655462729
Energy: 1.2260124879636198
Energy: 1.273993809322853
Energy: 1.2629651462292881
Energy: 1.265622271403447
Energy: 1.278627692538722
Energy: 1.2789431397093807
Energy: 1.2704517179369057
Energy: 1.2781714092469256
Energy: 1.2659828471800927
Energy: 1.2742137625557906
Energy: 1.2838846391832925
Energy: 1.2635952647891022
Energy: 1.2753783723361358
Energy: 1.2740043651608788
Energy: 1.269928979138121
Energy: 1.3440874485701901
Energy: 1.2763826724178575
Energy: 1.2909090640449203
Energy: 1.3454410664743968
Energy: 1.2743084393158712
Energy: 1.1954359447433915
Energy: 1.194958322512975
Energy: 1.274919982240313
Energy: 1.1961943347886705
Energy: 1.275988162251249
Energy: 1.1900433843375686
Energy: 1.1776257959927057
Energy: 1.1772221841870332
Energy: 1.1769415006575688
Energy: 1.4471827959318908
Energy: 1.1773791318707034
Energy: 2.0008212408036066
Energy: 1.4844684088238354
Energy: 1.3639609940044564
Energy: 1.1789641203921215
Energy: 1.383988294507219
Energy: 1.3068490438911802
Energy: 1.3184423519850772
Energy: 1.5350408876586719
Energy: 1.377608102763745
Energy: 1.3189735288891657
Energy: 1.4439672543578839
Energy: 1.1774287140174728
Energy: 1.177235942007714
Energy: 1.177585430834411
Energy: 1.1771698099966759
Energy: 1.1771417363111063
Energy: 1.4974313421475332
Energy: 1.1775230500175653
Energy: 1.2103750965890119
Energy: 1.1864238711822146
Energy: 1.1853546367427972
Energy: 1.2100908078644814
Energy: 1.186039585799234
Energy: 1.2115398433851363
Energy: 1.2097068523191905
Energy: 1.2493173211089754
Energy: 1.2373884478665031
Energy: 1.2120964573975042
Energy: 1.3773414401793682
Energy: 1.2255776963227134
Energy: 1.2118419231309305
Energy: 1.2668487041861007
Energy: 1.2432948761986975
Energy: 1.212403126690561
Energy: 1.3191710697466263
Energy: 1.266243360945143
Energy: 1.2195558302337064
Energy: 1.2650061897922438
Energy: 1.2656557662489827
Energy: 1.2091193009250194
Energy: 1.4507777056789457
Energy: 1.273718202213883
Energy: 1.8025427637406255
Energy: 1.4038118758411031
Energy: 1.3222252616035872
Energy: 1.194652367837388
Energy: 1.4035912843521836
Energy: 1.281195970355742
Energy: 1.2500118475970299
Energy: 1.37201569644938
Energy: 1.195611823660094
Energy: 1.2771743108613949
Energy: 1.194782033104245
Energy: 1.196633264666769
Energy: 1.2697099198060537
Energy: 1.2458116912834607
Energy: 1.2464239202486362
Energy: 1.2698449747024718
Energy: 1.4260233974433731
Energy: 1.2424419672615192
Energy: 1.3970614800957806
Energy: 1.2255420856206025
Energy: 1.225732201775528
Energy: 1.3968054918851163
Energy: 1.2263131483357679
Energy: 1.352160624802243
Energy: 1.4030940409874662
Energy: 1.1950352611305641
Energy: 1.1950428029232563
Energy: 1.2828686033724919
Energy: 1.329562727483078
Energy: 1.3530783729456968
Energy: 1.617724928871142
Energy: 1.1964884490731074
Energy: 1.1959861568589891
Energy: 1.359133834673745
Energy: 1.1958471965215307
Energy: 1.35554164875186
Energy: 1.3430276901512928
Energy: 1.1944804459490401
Energy: 1.1944871697134996
Energy: 1.3447156152833828
Energy: 1.2016605288032558
Energy: 1.1951106888588472
Energy: 1.7195530209281842
Energy: 1.1947943279758135
Energy: 1.1960461449353543
Energy: 1.2435276159056468
Energy: 1.1942898377454514
Energy: 1.1963299079027945
Energy: 1.415884739697116
Energy: 1.1947360734093975
Energy: 1.1948348445707182
Energy: 1.3082351263122256
Energy: 1.1943911883426668
Energy: 1.1945118418111142
Energy: 1.4147741147602069
Energy: 1.353263529660542
Energy: 1.349245825735571
Energy: 1.414694961779454
Energy: 1.237195888892443
Energy: 1.2907885729058723
Energy: 1.600861909322551
Energy: 1.2805755236826413
Energy: 1.2804776198847472
Energy: 1.6003971912130495
Energy: 1.1843200210159177
Energy: 1.3494495810712968
Energy: 1.3038405275074418
Energy: 1.249700005594018
Energy: 1.19484109973019
Energy: 1.3779679382224246
Energy: 1.382134906582985
Energy: 1.1946413917179848
Energy: 1.8415872511235398
Energy: 1.2576351129612247
Energy: 1.2720255848142168
Energy: 1.842458500939575
Energy: 1.257455233074912
Energy: 1.2724236675154115
Energy: 1.2587823761386152
Energy: 1.2665174493311198
Energy: 1.2397516914178905
Energy: 1.2709485195499262
Energy: 1.259944989639948
Energy: 1.276222607187672
Energy: 1.2572889616220173
Energy: 1.2799815952273068
Energy: 1.2329614187657265
Energy: 1.259970092944568
Energy: 1.27528386628949
Energy: 1.2342772039130312
Energy: 1.2705544749340338
Energy: 1.2404430566531335
Energy: 1.2400046851256232
Energy: 1.2567669536517656
Energy: 1.2751938762718253
Energy: 1.2394918303117652
Energy: 1.2656050837992052
Energy: 1.1935062284211082
Energy: 1.193243340185128
Energy: 1.2667931637779781
Energy: 1.1946101099865891
Energy: 1.1932151500957373
Energy: 1.3457974233778578
Energy: 1.1936007715391836
Energy: 1.1931672430466278
Energy: 1.346813989266932
Energy: 1.1957411499065347
Energy: 1.1932139344038877
Energy: 1.1835471553522823
Energy: 1.2741698461315654
Energy: 1.2376060588533464
Energy: 1.37278331581277
Energy: 1.4195248941022907
Energy: 1.3066514124695814

minimum gb energy = 1.1769415006575688 eV
minimum distance =  2.29257697548235 Angstroms
sigma value = 81


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

Energy: 2.1222486305378894
Energy: 1.3361822511999422
Energy: 1.2105554941809737
Energy: 1.2103843203266567
Energy: 1.1868075106830542
Energy: 1.2751162892289152
Energy: 1.232829505881542
Energy: 1.261004591272418
Energy: 1.1887310127603512
Energy: 1.2545146123722908
Energy: 1.2561237001228724
Energy: 1.2852784076900274
Energy: 1.2678468639987586
Energy: 1.2470916649274826
Energy: 1.205926535967998
Energy: 1.1874362876890276
Energy: 1.2250262524554718
Energy: 1.2927576617382086
Energy: 1.2727419586704565
Energy: 1.2063609376258086
Energy: 1.3120602282608826
Energy: 1.2711689016137082
Energy: 1.2253918495848581
Energy: 1.3041965173092902
Energy: 1.273438139508288
Energy: 1.3053962802287447
Energy: 1.3272106456879451
Energy: 1.2713515622870095
Energy: 1.3476610555212478
Energy: 1.3452522378068965
Energy: 1.3716528081846318
Energy: 1.2878732129767054
Energy: 1.2864362187662117
Energy: 1.419437027377021
Energy: 1.3308881900183664
Energy: 1.264848938154684
Energy: 1.272960394128526
Energy: 1.274792537666237
Energy: 1.3133190196083153
Energy: 1.292132144008093
Energy: 1.2747027611586284
Energy: 1.3273164364040508
Energy: 1.698684569233925
Energy: 1.6820137979573249
Energy: 1.5361013057305888
Energy: 1.6988343496660605
Energy: 1.5540261188089606
Energy: 1.3547139169342048
Energy: 1.2987299556526546
Energy: 1.2928718452733192
Energy: 1.3290556123336816
Energy: 1.3034507853916246
Energy: 1.295506082946752
Energy: 1.3491875810974205
Energy: 1.3634410199882872
Energy: 1.1608592435732066
Energy: 1.1605867961877285
Energy: 1.363151624108538
Energy: 1.1610189045089931
Energy: 1.1607269528760056
Energy: 1.2812871683642464
Energy: 1.1600072511676207
Energy: 1.159721001937733
Energy: 1.287563370202491
Energy: 1.1597635922763196
Energy: 1.2547584841963608
Energy: 1.224705993836216
Energy: 1.4083639126528302
Energy: 1.2728822369268036
Energy: 1.2247093758032173
Energy: 1.2817715554415094
Energy: 1.2740236416637256
Energy: 1.226148761807327
Energy: 1.2749832596251047
Energy: 1.3865311112073573
Energy: 1.2265521407815296
Energy: 1.2741532320877065
Energy: 1.2488883445619055
Energy: 1.2802156849753634
Energy: 1.2737398890986058
Energy: 1.3358928646915957
Energy: 1.3002640782344308
Energy: 1.2756087932532
Energy: 1.3333089247314052
Energy: 1.7500577760709264
Energy: 1.4137554991508683
Energy: 1.375871298082154
Energy: 1.3168963508011589
Energy: 1.3347303149462446
Energy: 1.3289546381238415
Energy: 1.2799091386943466
Energy: 1.334276808649305
Energy: 1.332008184445067
Energy: 1.2805451864856252
Energy: 1.3014039573309546
Energy: 1.3340566707960686
Energy: 1.5265094825248817
Energy: 1.2086719331297
Energy: 1.2835206526566854
Energy: 1.5266434178109416
Energy: 1.2686354901525836
Energy: 1.3408443477805343
Energy: 1.2552933585272832
Energy: 1.3714882473776082
Energy: 1.3327386829508492
Energy: 1.2863711042119657
Energy: 1.3108049974706313
Energy: 1.3326784842702515
Energy: 1.1621294990404345
Energy: 1.3340106323495118
Energy: 1.1598210417638193
Energy: 1.2006510862490198
Energy: 1.408902988621408
Energy: 1.1596375232582068
Energy: 1.1616033230057317
Energy: 1.359228959367753
Energy: 1.1599980159906012
Energy: 1.160694770153217
Energy: 1.3159901594246013
Energy: 1.1598100248885965
Energy: 1.256013798807748
Energy: 1.367517490730312
Energy: 1.3536383926510636
Energy: 1.286332681217189
Energy: 1.3117909168113542
Energy: 1.3313611638178577
Energy: 1.2739629267089922
Energy: 1.206418100175322
Energy: 1.2673665807538923
Energy: 1.2740077136989385
Energy: 1.2256328434923092
Energy: 1.3670814681730248
Energy: 1.2729427262442994
Energy: 1.333039098388958
Energy: 1.3310856182542061
Energy: 1.2741129331448828
Energy: 1.3137559635646563
Energy: 1.2745029223717184
Energy: 1.2751748851560454
Energy: 1.3719047394642776
Energy: 1.3308188674557953
Energy: 1.27624253247153
Energy: 1.333400094671307
Energy: 1.3300893723041929
Energy: 1.2742750403801866
Energy: 1.3172664354184604
Energy: 1.3124858054451782
Energy: 1.4076691161674104
Energy: 1.2796559345011909
Energy: 1.3131700525903613
Energy: 1.6363118485031627
Energy: 1.5249946761416706
Energy: 1.2753425845333672
Energy: 1.2677392018453588
Energy: 1.5248987570891546
Energy: 1.3168135885796703
Energy: 1.2328168232458092
Energy: 1.2971113914288044
Energy: 1.2737052888072382
Energy: 1.2676081992458768
Energy: 1.2969361886946718
Energy: 1.3168751506070167
Energy: 1.276768541683149
Energy: 1.1601057787252245
Energy: 1.3319414600169823
Energy: 1.3075681672486856
Energy: 1.1597877355211443
Energy: 1.2555761859571175
Energy: 1.2820308387779218
Energy: 1.1613984591017927
Energy: 1.161149124388237
Energy: 1.2877051022421862
Energy: 1.1615230269293886
Energy: 1.1614830325243901
Energy: 1.3025722097768846
Energy: 1.400924843771746
Energy: 1.3283299837804763
Energy: 1.3037781872219925
Energy: 1.2945876083304855
Energy: 1.337981194034339
Energy: 1.2267343126122674
Energy: 1.4428873507324649
Energy: 1.2882348871481035
Energy: 1.226440125125399
Energy: 1.4063426006666015
Energy: 1.296578032689978
Energy: 1.2776545042263006
Energy: 1.2692904211879235
Energy: 1.2690931843432345
Energy: 1.2912003488016166
Energy: 1.2695736936958841
Energy: 1.270133491035356
Energy: 1.2783596460204032
Energy: 1.3384357243803358
Energy: 1.3369821075845911
Energy: 1.3577599349555685
Energy: 1.2709875920555176
Energy: 1.3382189290358995
Energy: 1.2778066630934422
Energy: 1.268446108663819
Energy: 1.2798774049603714
Energy: 1.2762597594247778
Energy: 1.3396937993514475
Energy: 1.2683154097903664
Energy: 1.277853624897577
Energy: 1.234910325782411
Energy: 1.3127984946928148
Energy: 1.276054855171544
Energy: 1.297395563413481
Energy: 1.2327483935954744
Energy: 1.5273175894702917
Energy: 1.2067160908234096
Energy: 1.2073214615502947
Energy: 1.4471179989835679
Energy: 1.2682922942462465
Energy: 1.447741252090424
Energy: 1.2704329212535566
Energy: 1.2371084087618203
Energy: 1.1885744232021893
Energy: 1.2634725910668934
Energy: 1.2555850926281324
Energy: 1.2309693775882786
Energy: 2.123447392531607
Energy: 1.2985962798592992
Energy: 1.2115163387392862
Energy: 1.1624188874440466
Energy: 1.3292874286438618
Energy: 1.2764152245055647

minimum gb energy = 1.1596375232582068 eV
minimum distance =  2.34486325953038 Angstroms
sigma value = 43


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

Energy: 2.153356354941324
Energy: 1.5691501647283415
Energy: 1.4200563083603834
Energy: 1.2891716732173353
Energy: 1.5845313089488748
Energy: 1.2890641330609225
Energy: 1.2099908244512105
Energy: 1.210177099035444
Energy: 1.392601376449371
Energy: 1.3126061831094122
Energy: 1.3151215340187032
Energy: 1.3728390014823169
Energy: 1.2235744853504
Energy: 1.2072512271072244
Energy: 1.2094421473129089
Energy: 1.2236716400618786
Energy: 1.2153286012265105
Energy: 1.2264324747880042
Energy: 1.226972509988155
Energy: 1.2160799351851024
Energy: 1.232240150764642
Energy: 1.2233247845018247
Energy: 1.3871698107976038
Energy: 1.2236462913742097
Energy: 1.2396168704011403
Energy: 1.2501813023508352
Energy: 1.298442959246341
Energy: 1.2398372731457985
Energy: 1.286682875662692
Energy: 1.2985044396156495
Energy: 1.2495548351822514
Energy: 1.2866677528758672
Energy: 1.2990252740369692
Energy: 1.2559877542794675
Energy: 1.223976731972461
Energy: 1.2980663897743432
Energy: 1.2404250871886666
Energy: 1.2386618975967818
Energy: 1.2417668643843391
Energy: 1.2404029646933654
Energy: 1.2424430458113174
Energy: 1.2319411844669805
Energy: 1.4058344148424424
Energy: 1.22416608690934
Energy: 1.2234190559031721
Energy: 1.3253036462932706
Energy: 1.224753539408051
Energy: 1.3227224371634065
Energy: 1.3155129087661508
Energy: 1.247587959930294
Energy: 1.2473178118814825
Energy: 1.3151635524182332
Energy: 1.248582459474933
Energy: 1.2479466427386126
Energy: 1.405531831657514
Energy: 1.3184376954631163
Energy: 1.3175636922867815
Energy: 1.405678299559945
Energy: 1.319070348854893
Energy: 1.3169736658034203
Energy: 1.2005265243659724
Energy: 1.2680707519346888
Energy: 1.3245508861461968
Energy: 1.2006837837066073
Energy: 1.3898290486340639
Energy: 1.3013436324228622
Energy: 1.4180802082319826
Energy: 1.24881730794578
Energy: 1.2475587214419521
Energy: 1.1973157521241888
Energy: 1.4223614359743129
Energy: 1.2477061433511967
Energy: 1.3387167937453073
Energy: 1.2315418596182628
Energy: 1.2468246093688489
Energy: 1.1998326615061172
Energy: 1.2979253408342049
Energy: 1.2467012159167625
Energy: 1.2003134318381719
Energy: 1.2335961428654623
Energy: 1.3715072204936845
Energy: 1.2005904231614242
Energy: 1.3359823488387355
Energy: 1.3018615529335953
Energy: 1.202310008207986
Energy: 1.22949918345341
Energy: 1.2268670565208968
Energy: 1.201397060598
Energy: 1.305240961484621
Energy: 1.2268602326852915
Energy: 1.2035600417027321
Energy: 1.2291640651046583
Energy: 1.2033901078430882
Energy: 1.2034303106529123
Energy: 1.3559548811666062
Energy: 1.2024190988411612
Energy: 1.2009737799214129
Energy: 1.2061759482257897
Energy: 1.207850383935427
Energy: 1.2011363524333858
Energy: 1.3690268108038661
Energy: 1.2037442506942089
Energy: 1.2007000694373526
Energy: 1.329325063818436
Energy: 1.2106814249692268
Energy: 1.200756052577163
Energy: 1.4086242580847632
Energy: 1.210652123674196
Energy: 1.3147625038397825
Energy: 1.2031176362346763
Energy: 1.2027834024230863
Energy: 1.4114608195618799
Energy: 1.305624710853016
Energy: 1.2419104120454374
Energy: 1.31374605805875
Energy: 1.205903191629348
Energy: 1.2028622463063716
Energy: 1.249796689383135
Energy: 1.2001605579048475
Energy: 1.225089812173588
Energy: 1.2006967795772951
Energy: 1.312237136773358
Energy: 1.3281228620948886
Energy: 1.2005940063321556
Energy: 1.4193173169696074
Energy: 1.3283180514462352
Energy: 1.4732640132396386
Energy: 1.2455014467759637
Energy: 1.337491362089703
Energy: 1.4734774660524794
Energy: 1.2149951639197285
Energy: 1.4176330492765605
Energy: 1.40668289164604
Energy: 1.2117951346150044
Energy: 1.3287310341251615
Energy: 1.4083152876282932
Energy: 1.3207357112090348
Energy: 1.3210238972506656
Energy: 1.3930729284141912
Energy: 1.4678120222361846
Energy: 1.203033957739656
Energy: 1.434877576199881
Energy: 1.2036234987354262
Energy: 1.2037189191412925
Energy: 1.4082416386617318
Energy: 1.1997023857564189
Energy: 1.207324559721427
Energy: 1.4086273911555929
Energy: 1.1997525513097214
Energy: 1.2030879207586664
Energy: 1.3372701257090835
Energy: 1.2003517434514879
Energy: 1.2266773960413886
Energy: 1.3729881748113448
Energy: 1.2007604893572816
Energy: 1.233265311511834
Energy: 1.3369883120399222
Energy: 1.2031603086419587
Energy: 1.2033430382315533
Energy: 1.3369291077685057
Energy: 1.201071292567871
Energy: 1.203167542936196
Energy: 1.2967144201825505
Energy: 1.3475980718187643
Energy: 1.232600002157908
Energy: 1.2966905501355874
Energy: 1.3140642703516128
Energy: 1.232822719994326
Energy: 1.3071360193276174
Energy: 1.2230321957868011
Energy: 1.2237811433161767
Energy: 1.305947311067212
Energy: 1.3187847615800887
Energy: 1.224673815263554
Energy: 1.2241898454675033
Energy: 1.2102712190223266
Energy: 1.3701586537664439
Energy: 1.31210734799877
Energy: 1.3148385627918586
Energy: 1.2471935467340882
Energy: 2.157283405633495
Energy: 1.4378815093643422
Energy: 1.4421966371352404
Energy: 1.2463426834622304
Energy: 1.4352056069727002
Energy: 1.3883856651702196

minimum gb energy = 1.1973157521241888 eV
minimum distance =  2.26558242570768 Angstroms
sigma value = 57


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

Energy: 1.7634086762168046
Energy: 1.427510608366012
Energy: 1.3857143408444077
Energy: 1.680625544495434
Energy: 1.271314589027681
Energy: 1.4941099974516503
Energy: 1.2591237948386504
Energy: 1.296645881977948
Energy: 1.2946220598671814
Energy: 1.218725121855687
Energy: 1.4001867585691055
Energy: 1.2945070674662154
Energy: 1.7261286242766352
Energy: 1.2186124871866648
Energy: 1.2182065341654233
Energy: 1.567389606960393
Energy: 1.2178306723423145
Energy: 1.2178017658250468
Energy: 1.3755324179716535
Energy: 1.2178083390141188
Energy: 1.2177754727224739
Energy: 1.3781491920104727
Energy: 1.2180144702991766
Energy: 1.2093393514455206
Energy: 1.374994501009131
Energy: 1.4413350267642582
Energy: 1.337956455770768
Energy: 1.3763334817946815
Energy: 1.3357823990813098
Energy: 1.370128938624842
Energy: 1.2175813916086005
Energy: 1.3266130992973975
Energy: 1.3637371872526607
Energy: 1.3767883043164824
Energy: 1.3755883594359155
Energy: 1.3711382427205538
Energy: 1.3954714068627732
Energy: 1.3736842227875583
Energy: 1.3731629964654817
Energy: 1.4344315768300986
Energy: 1.3759475606911802
Energy: 1.3744527313540786
Energy: 1.307218495835114
Energy: 1.47487173249456
Energy: 1.4448455610338937
Energy: 1.3070546223756958
Energy: 1.4269688237762825
Energy: 1.3854628736825314
Energy: 1.407698437806717
Energy: 1.3873591862457735
Energy: 1.3854781137096241
Energy: 1.4084193548948998
Energy: 1.385723104182896
Energy: 1.427471984795392
Energy: 1.6609987992267992
Energy: 1.308925784775476
Energy: 1.3081139487697484
Energy: 1.6620602689068698
Energy: 1.3087661061340214
Energy: 1.3081472142625554
Energy: 1.5085542854304095
Energy: 1.307408482256055
Energy: 1.349520083277088
Energy: 1.3564751268677206
Energy: 1.3565369285155735
Energy: 1.345872725780481
Energy: 1.148705771601446
Energy: 1.3799694888647291
Energy: 1.3800298676840288
Energy: 1.15114562632493
Energy: 1.5675745041866342
Energy: 1.330584594527591
Energy: 1.158092220705591
Energy: 1.381046379797223
Energy: 1.3313154641041718
Energy: 1.331884411613393
Energy: 1.3815150932067783
Energy: 1.3311370785085124
Energy: 1.5049715135849004
Energy: 1.4556939739355979
Energy: 1.448955336221022
Energy: 1.3578429669369851
Energy: 1.4311193877902766
Energy: 1.3499975307794834
Energy: 1.3739020307304146
Energy: 1.2187493384407293
Energy: 1.2766165373182552
Energy: 1.3736228390367708
Energy: 1.218269703963738
Energy: 1.2768643609165808
Energy: 1.3732914103713931
Energy: 1.3906054041152762
Energy: 1.3954397837496304
Energy: 1.3744079737387545
Energy: 1.5647164030834029
Energy: 1.4005374504080617
Energy: 1.3946815983214822
Energy: 1.3673535910347545
Energy: 1.36806991054626
Energy: 1.3929531163965312
Energy: 1.4044022527106337
Energy: 1.3669769140173484
Energy: 1.3946087341752937
Energy: 1.3751024649453352
Energy: 1.3808247607406017
Energy: 1.4362264939150977
Energy: 1.3746066939234571
Energy: 1.38169427017509
Energy: 1.433119558360103
Energy: 1.3749778498627883
Energy: 1.4061687994381038
Energy: 1.4198428262114453
Energy: 1.3747705214709431
Energy: 1.4057519902328295
Energy: 1.386603036963832
Energy: 1.3928476553539364
Energy: 1.3822438631263525
Energy: 1.3837950979339035
Energy: 1.5625694752243837
Energy: 1.4080445879610113
Energy: 1.3823446857859867
Energy: 1.4185065702508304
Energy: 1.4875571462609096
Energy: 1.388974692329516
Energy: 1.4387191897503284
Energy: 1.2085893461908963
Energy: 1.4830854136807636
Energy: 1.3083957634037584
Energy: 1.363568041549619
Energy: 1.4085179990072574
Energy: 1.3094001291378625
Energy: 1.3636736374762821
Energy: 1.56897180698944
Energy: 1.2963464607018171
Energy: 1.2964885769569319
Energy: 1.216021605994546
Energy: 1.3985097217919962
Energy: 1.2121035990132576
Energy: 1.2701485102108385
Energy: 1.302611062897105
Energy: 1.3312299883372638
Energy: 1.3327134603160702
Energy: 1.3028487202483696
Energy: 1.4390336729754318

minimum gb energy = 1.148705771601446 eV
minimum distance =  2.33395144247586 Angstroms
sigma value = 17


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

Energy: 1.8750450270364072
Energy: 1.4057295559022454
Energy: 1.4013865729166453
Energy: 1.177642842393995
Energy: 1.2916399816236133
Energy: 1.1773714453229314
Energy: 1.1218390599135044
Energy: 1.2372966978818825
Energy: 1.2371829739530977
Energy: 1.253288965349317
Energy: 1.238946384562986
Energy: 1.2205761586297217
Energy: 1.5313439699003326
Energy: 1.1725272868356305
Energy: 1.1225417278491936
Energy: 1.5336890961151295
Energy: 1.1725420021844197
Energy: 1.1231232073161015
Energy: 1.236609302545005
Energy: 1.1725787600927617
Energy: 1.1227151363735386
Energy: 1.2365357022805992
Energy: 1.065868404517333
Energy: 1.2366267971471814
Energy: 1.1123219435864984
Energy: 1.1956836608829438
Energy: 1.2162837452618442
Energy: 1.1128249769352956
Energy: 1.1949634742896014
Energy: 1.2160680937362438
Energy: 1.6322535433006702
Energy: 1.095632550712566
Energy: 1.1846229566993984
Energy: 1.2277026667242878
Energy: 1.095361165795526
Energy: 1.23008766424317
Energy: 1.1118812333204946
Energy: 1.0947103992695721
Energy: 1.0947933464208248
Energy: 1.1126281776808042
Energy: 1.0957460210124652
Energy: 1.1722865978342545
Energy: 1.3444502503662987
Energy: 1.2365873771038776
Energy: 1.2945091815855152
Energy: 1.2363020866577061
Energy: 1.2359814098102477
Energy: 1.2534815228390126
Energy: 1.0992900260250993
Energy: 1.2380933198161361
Energy: 1.2372192197607623
Energy: 1.096948046405216
Energy: 1.1874517422744166
Energy: 1.0954339956925199
Energy: 1.0948211694013998
Energy: 1.1847500783797935
Energy: 1.1849422862316144
Energy: 1.0949146830113137
Energy: 1.2094328747817038
Energy: 1.18489702763623
Energy: 1.2992899238210978
Energy: 1.216424598205764
Energy: 1.2161190960048083
Energy: 1.370535215455995
Energy: 1.2383935560565325
Energy: 1.194107986307883
Energy: 1.2566472204905021
Energy: 1.2366778843398376
Energy: 1.236335866072139
Energy: 1.2569728017027118
Energy: 1.2367660843170738
Energy: 1.2364040386300816
Energy: 1.2358160610823796
Energy: 1.3667466832409625
Energy: 1.2376378125555674
Energy: 1.2169845426324772
Energy: 1.371545007056925
Energy: 1.2631945063033143
Energy: 1.2535498025273695
Energy: 1.2379078968887842
Energy: 1.2378851282016012
Energy: 1.2532243469435633
Energy: 1.237456373633684
Energy: 1.2374880706320468
Energy: 1.6353332571310981
Energy: 1.237380987383745
Energy: 1.2363819025522187
Energy: 1.6346708450682512
Energy: 1.2364451045686515
Energy: 1.365799940030575
Energy: 1.5386442462210064
Energy: 1.281038289616317
Energy: 1.2204691933241605
Energy: 1.5331634353117478
Energy: 1.25492862032737
Energy: 1.23705862232244
Energy: 1.2332567441632953
Energy: 1.2371029596710965
Energy: 1.3496774980771005
Energy: 1.232742387294756
Energy: 1.3691883085184715
Energy: 1.349973014094463

minimum gb energy = 1.065868404517333 eV
minimum distance =  2.30961857770425 Angstroms
sigma value = 17


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

Energy: 1.9486304243122152
Energy: 1.3455223166219212
Energy: 1.1374535244483732
Energy: 1.1372091369026796
Energy: 1.2481267386789312
Energy: 1.1371845901101114
Energy: 1.2639809369298143
Energy: 1.2019733177629814
Energy: 1.2160325524518287
Energy: 1.2011446750201562
Energy: 1.2044067444912392
Energy: 1.1336576053499723
Energy: 1.4384695504762102
Energy: 1.1356156137803632
Energy: 1.1241690084469096
Energy: 1.4399082596782367
Energy: 1.136463200400954
Energy: 1.0971185007739785
Energy: 1.201487135597253
Energy: 1.1251734468888739
Energy: 1.0975158512689023
Energy: 1.202039304944661
Energy: 1.0109896257042679
Energy: 1.096799654378169
Energy: 1.0685897833064646
Energy: 1.1412535174588614
Energy: 1.1346351161374117
Energy: 1.0693030318060477
Energy: 1.1398314467185808
Energy: 1.1353032976850062
Energy: 1.7256847510009818
Energy: 1.052144418633796
Energy: 1.004554773277922
Energy: 1.1355374131349913
Energy: 1.0534424859333107
Energy: 1.0732941779365521
Energy: 1.4021132068867797
Energy: 1.0524480510222693
Energy: 1.0522878522531969
Energy: 1.4024621562629886
Energy: 1.0558827281604721
Energy: 1.1029877370414756
Energy: 1.1693706937806232
Energy: 1.1089529563796032
Energy: 1.1207063013682412
Energy: 1.0867700115760512
Energy: 1.1094488223562546
Energy: 1.1704195939219473
Energy: 0.9922948344059137
Energy: 1.120305587326974
Energy: 1.0643825951957318
Energy: 0.9938524808171914
Energy: 0.991489124013349
Energy: 0.9921984620744225
Energy: 0.9921852750492226
Energy: 1.1143792527268048
Energy: 1.1142553103594963
Energy: 0.9918541073166437
Energy: 1.114629875730392
Energy: 1.114930792243261
Energy: 0.9902974148424578
Energy: 0.991269504418632
Energy: 1.1142483900517317
Energy: 1.1144306137118667
Energy: 0.9918285629990571
Energy: 1.1143713657120267
Energy: 0.9961397714727669
Energy: 0.9921656429552944
Energy: 0.9923525249645899
Energy: 0.9977387668498066
Energy: 0.9918799803606837
Energy: 1.0643280625963538
Energy: 1.0520656805712918
Energy: 1.1097387587173024
Energy: 1.0688663141245223
Energy: 1.1241051296489268
Energy: 1.119495887554016
Energy: 1.124406341182767
Energy: 1.0531092240077558
Energy: 1.141005024081822
Energy: 1.1408898823905045
Energy: 1.053375744034387
Energy: 1.220875883517932
Energy: 1.0523716476586662
Energy: 1.0533190325392427
Energy: 1.0639280018069976
Energy: 1.064010248263649
Energy: 1.0530799349979802
Energy: 1.1232328493485
Energy: 1.1205769094342966
Energy: 1.3588224598319787
Energy: 1.202096507496636
Energy: 1.1335434517005067
Energy: 1.2816233307427003
Energy: 1.2014213266287674
Energy: 1.1213497680375868
Energy: 0.9927995918289984
Energy: 1.2017052203221956
Energy: 1.201740928255228
Energy: 0.993394001822873
Energy: 1.2014129638500277
Energy: 1.0511816896454775
Energy: 1.072048572619424
Energy: 1.3005781084810624
Energy: 1.202016677395438
Energy: 1.0716290230406869
Energy: 1.301955270390992
Energy: 1.1211144258118841
Energy: 1.3431016985497115
Energy: 1.2013483592245142
Energy: 1.1519021491737713
Energy: 1.3440811659757463
Energy: 1.0704071556209716
Energy: 1.1216077644735312
Energy: 1.6154535056745734
Energy: 1.051569224924932
Energy: 1.1499756827249183
Energy: 1.6155137195248528
Energy: 1.12768142446389
Energy: 1.2236499147784312
Energy: 1.4471662115440544
Energy: 1.2015936183409899
Energy: 1.2147660835531813
Energy: 1.3050305491849579
Energy: 1.2010252679819824
Energy: 1.2014473508368726
Energy: 1.0048262363020248
Energy: 1.3030722491268143
Energy: 1.3024131646867088
Energy: 1.1260681536301136
Energy: 1.3069791972761031
Energy: 1.0966039663037428
Energy: 1.0101856283223725
Energy: 1.2020368244254631
Energy: 1.2023752144307311
Energy: 1.0114801644168463
Energy: 1.2034253813241447
Energy: 1.3017767740778323
Energy: 1.4395117764277623
Energy: 1.1607731588537469
Energy: 1.2151671481653734
Energy: 1.4394684472808459
Energy: 1.0050665842183755
Energy: 1.2006017643486755
Energy: 1.2018590501654327
Energy: 1.1348561824156176
Energy: 1.11091740864832
Energy: 1.2020339614678741
Energy: 1.1359592060846537
Energy: 1.096617248777872
Energy: 1.206039659648842
Energy: 1.136201638189741
Energy: 1.1382720134884317
Energy: 1.2064723602492997
Energy: 1.1407011932080462
Energy: 1.1371785914928898
Energy: 1.0968549130823662
Energy: 1.0519636588782726
Energy: 1.0521048835471634
Energy: 1.1329946630444137
Energy: 1.1966930877726134
Energy: 1.0733947739219567
Energy: 0.9758825625384665
Energy: 1.0521627443543362
Energy: 1.052589530795606
Energy: 0.9757680517421154
Energy: 1.0537310406071398
Energy: 1.0525880991332628
Energy: 1.4099204730399901
Energy: 1.131131126229067
Energy: 1.1309137728007987
Energy: 1.0680082719903328
Energy: 1.0520902710090654
Energy: 1.1320659713949341
Energy: 0.992270307271459
Energy: 1.1088088903198783
Energy: 1.1204194348016083
Energy: 0.9924331942791997
Energy: 1.1092998244362642
Energy: 1.1291651967159488
Energy: 0.9986985229499002
Energy: 1.1192858706596462
Energy: 1.1184861786455729
Energy: 0.9925407512624289
Energy: 1.1157499508536295
Energy: 1.063187458362303
Energy: 1.4967680814238031
Energy: 1.1149440469340666
Energy: 1.1206474626065333
Energy: 1.1618649753754569
Energy: 1.1241811897560414
Energy: 1.1205152437407362
Energy: 1.0073012470722058
Energy: 0.992209650634148
Energy: 0.9919189609343972
Energy: 1.007734894153757
Energy: 0.9930763030529504
Energy: 0.9921240363467293
Energy: 1.6413067839452153
Energy: 1.0649486235791037
Energy: 1.1222392275442323
Energy: 1.1231917281402213
Energy: 0.9913409002697585
Energy: 1.1422449474028413
Energy: 1.0524349199427987
Energy: 1.1497810133002622
Energy: 1.1486809153753026
Energy: 1.0522787212360536
Energy: 1.1529302896688594
Energy: 1.1430797121217615
Energy: 1.0527513329288487
Energy: 1.1246086027573845
Energy: 1.1201094209022504
Energy: 1.0527041253008533
Energy: 1.123776417419461
Energy: 1.0523504039333282
Energy: 1.3773221479363058
Energy: 1.1325971482142798
Energy: 1.133223497159403
Energy: 1.1974357843915118
Energy: 1.0717661039601964
Energy: 1.1199566646152472
Energy: 0.9949330599365116
Energy: 1.201576184237027
Energy: 1.2014223291056312
Energy: 1.051342660869826
Energy: 1.2025986972920264
Energy: 1.2013982931812046
Energy: 1.2051632127799683
Energy: 1.2997462741833832
Energy: 1.0501573510962625
Energy: 1.1370260517354984
Energy: 1.436851664814427
Energy: 1.0506197563177786
Energy: 1.3401918162882775
Energy: 1.2020140267052564
Energy: 1.2017797788923565
Energy: 1.202838393012776
Energy: 1.2026542884029894
Energy: 1.1608223871784744
Energy: 1.3452453577492105
Energy: 1.121193149880913
Energy: 1.2162532330610003
Energy: 1.3419450712498162
Energy: 1.1207341219930198
Energy: 1.1999734084907143
Energy: 1.4390124936219146
Energy: 1.1486603672058175
Energy: 1.2142416652893022
Energy: 1.4406744227705357
Energy: 1.0839540591656904
Energy: 1.201207333077659
Energy: 1.2303270923839476
Energy: 1.2020350737256007
Energy: 1.2158323802975717
Energy: 1.2312293887197094
Energy: 1.3028905965028703
Energy: 1.3013729488024868

minimum gb energy = 0.9757680517421154 eV
minimum distance =  2.29275936559154 Angstroms
sigma value = 57


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

Energy: 1.7654288889102943
Energy: 1.2745224189272248
Energy: 1.1005884599504814
Energy: 1.1035279076157734
Energy: 1.6725279716906334
Energy: 1.0979671842474614
Energy: 1.2931591445301378
Energy: 1.1636764942149012
Energy: 1.1703792046018167
Energy: 1.1517103129951485
Energy: 1.1583182474527252
Energy: 1.0714918843925658
Energy: 1.3490973574634635
Energy: 1.067372410660202
Energy: 1.0717697928393721
Energy: 1.3511712246841183
Energy: 1.064325755466112
Energy: 1.0747512169290414
Energy: 1.1584825066632807
Energy: 1.0651769315491115
Energy: 1.0696230802732154
Energy: 1.1581771491882205
Energy: 1.2782655394858118
Energy: 1.059790867513097
Energy: 1.1855322936521544
Energy: 1.0667890379899767
Energy: 1.072170014071945
Energy: 1.1716514671497071
Energy: 1.089044271714512
Energy: 1.0623774421835905
Energy: 1.6056389548943717
Energy: 1.0153170592085803
Energy: 0.9659180661481287
Energy: 1.0290281091979616
Energy: 1.0153146521730327
Energy: 1.0657520992416707
Energy: 1.3119226234812802
Energy: 1.0204858160293027
Energy: 1.0147929262542459
Energy: 1.3135931125697335
Energy: 1.0213283402713382
Energy: 1.061623123915327
Energy: 1.245457759452162
Energy: 1.0248427765623267
Energy: 1.0419180984656333
Energy: 1.2459555972170517
Energy: 1.0247906118403292
Energy: 1.0602611882772919
Energy: 0.9448282316520298
Energy: 1.0454039753551956
Energy: 0.9420795319388937
Energy: 0.9467530348215598
Energy: 1.0836885997336936
Energy: 0.942306208655533
Energy: 0.942645175080667
Energy: 1.073166940802929
Energy: 1.0448685908904458
Energy: 0.9425178990581993
Energy: 1.1046438346791887
Energy: 1.041361439033616
Energy: 0.9153870390453194
Energy: 0.9095746815764736
Energy: 1.0353555090252857
Energy: 1.0124091210490966
Energy: 0.9089453450255272
Energy: 1.037848721216299
Energy: 0.9481526616068315
Energy: 0.9087787897933813
Energy: 0.908814702764539
Energy: 0.9492199470965349
Energy: 0.9147258509730031
Energy: 1.0197968025454065
Energy: 0.9154544648501175
Energy: 1.0908845624619932
Energy: 1.0520435714556917
Energy: 0.9157849725706227
Energy: 1.0544818099799118
Energy: 1.051680792145
Energy: 0.9097271230296623
Energy: 1.0208486707601403
Energy: 0.908598342023472
Energy: 0.9123955153521853
Energy: 1.249170590707016
Energy: 0.9085580577508103
Energy: 0.9101155157360469
Energy: 1.0499490140398662
Energy: 1.0198384136260732
Energy: 0.9101479183006551
Energy: 1.020176344016655
Energy: 1.0197736565880942
Energy: 1.0983433474587743
Energy: 0.9424060648627424
Energy: 1.0415090041654749
Energy: 1.0438146883438297
Energy: 0.9427090607010805
Energy: 1.03984470423756
Energy: 0.9632178291660036
Energy: 0.9424620963895673
Energy: 0.9423764237569547
Energy: 0.9640517318970774
Energy: 0.9507880175334247
Energy: 1.0019214938842482
Energy: 0.9116446587429058
Energy: 1.0079231507778883
Energy: 1.050442709973106
Energy: 0.9131471373970537
Energy: 1.0414078592239788
Energy: 1.055204885981186
Energy: 1.014883291176886
Energy: 1.0756625210605184
Energy: 1.0145976706822708
Energy: 1.0161786753491406
Energy: 1.319115666144639
Energy: 1.0147052528082603
Energy: 1.2811917407418767
Energy: 1.048790374614276
Energy: 1.1058590514156588
Energy: 1.2817785144658862
Energy: 1.0483389765036115
Energy: 1.0755903297591596
Energy: 1.3241062385395517
Energy: 1.2013726727781815
Energy: 1.06899000581143
Energy: 1.088875358561482
Energy: 1.2070699754415517
Energy: 1.0702546918253029
Energy: 1.0040153765033601
Energy: 1.1518369386065022
Energy: 1.0147313634146147
Energy: 1.0494311135341776
Energy: 1.15140077458236
Energy: 1.066787300559246
Energy: 1.1334037119498859
Energy: 1.1521308161022268
Energy: 1.1643129179427831
Energy: 1.133238336032735
Energy: 1.2371105891677214
Energy: 1.1622840285352571
Energy: 1.2718943486873844
Energy: 1.0659383198046317
Energy: 1.0716177642649716
Energy: 1.2735942910285496
Energy: 1.1568845730141248
Energy: 1.0711632608803594
Energy: 1.3543194304928787
Energy: 1.0728267177986097
Energy: 1.0144987053106183
Energy: 1.3549455386757079
Energy: 1.0787899709051432
Energy: 1.1516470348448824
Energy: 1.3488714462408293
Energy: 1.1521435867984573
Energy: 1.1602937177297878
Energy: 1.1598427275619199
Energy: 1.1592302710082272
Energy: 1.1518322107771526
Energy: 1.0618910257886864
Energy: 1.2333991984091834
Energy: 1.0609529363283345
Energy: 1.0685359924605033
Energy: 1.355781338899227
Energy: 1.0605612782146294

minimum gb energy = 0.9085580577508103 eV
minimum distance =  2.29172128400648 Angstroms
sigma value = 43


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

Energy: 1.6472413065886398
Energy: 1.1326808187839832
Energy: 0.9939377419002895
Energy: 0.8738569536979318
Energy: 1.0643733885797289
Energy: 1.0063629384396438
Energy: 1.1213929220858896
Energy: 0.938593298714758
Energy: 0.9350061739489192
Energy: 1.0164198179239325
Energy: 1.020331359244541
Energy: 0.9138256088059932
Energy: 1.1703400955504386
Energy: 0.8969023626144498
Energy: 0.9321456686624935
Energy: 1.172598325626544
Energy: 0.8957856616569233
Energy: 0.9260530567611486
Energy: 1.0197743389159502
Energy: 0.9222893758280707
Energy: 0.8989439143855077
Energy: 1.0198066118833837
Energy: 0.9782430204682712
Energy: 0.9471027305970116
Energy: 1.0279368423309607
Energy: 0.9089216584066395
Energy: 0.9354804887215324
Energy: 1.0276804896593403
Energy: 0.9127618539143518
Energy: 0.9154579208805436
Energy: 0.8206272399390505
Energy: 0.908269645859252
Energy: 0.8962084485064598
Energy: 0.8737524679947515
Energy: 0.9083202507858111
Energy: 0.8553401672708122
Energy: 1.136131988175502
Energy: 0.9085922379200819
Energy: 0.9086648296357763
Energy: 1.0133088050945938
Energy: 0.9089064205122294
Energy: 1.0822470039643513
Energy: 1.0799768577427948
Energy: 0.8614195336567597
Energy: 0.8822842027199647
Energy: 1.0827506658764718
Energy: 0.861568041588661
Energy: 0.8817101921650972
Energy: 0.8463276793138933
Energy: 0.8812302767194562
Energy: 0.8437486582039149
Energy: 0.8485076716570754
Energy: 1.0768826405633665
Energy: 0.8440682011351783
Energy: 0.8440556328081777
Energy: 0.9036878407589884
Energy: 0.8992865900711033
Energy: 0.8440972498317282
Energy: 0.9002668774836284
Energy: 0.8993292548775107
Energy: 0.7858090532847551
Energy: 0.8023178222074231
Energy: 0.8705396682263474
Energy: 0.8580679645913651
Energy: 0.8025473224874773
Energy: 0.8599015589779722
Energy: 1.069245506113572
Energy: 0.8024484707762136
Energy: 0.8023668214185398
Energy: 1.071538162209176
Energy: 0.802336704827148
Energy: 0.8821517257969342
Energy: 1.0475222250372804
Energy: 0.8496508603459788
Energy: 0.8778488952211776
Energy: 1.050015040380906
Energy: 0.8497389706234647
Energy: 0.855718338731446
Energy: 0.7776690686794978
Energy: 1.0571280872623319
Energy: 0.7776406170160781
Energy: 0.7798421988563633
Energy: 1.0579913711143696
Energy: 0.7775685385389763
Energy: 0.7775554872143909
Energy: 0.8518035465118572
Energy: 0.8623494749585101
Energy: 0.7774695622991946
Energy: 0.8502724352932302
Energy: 0.8580430161513884
Energy: 0.9085554008545761
Energy: 0.7661750553904961
Energy: 0.7655898898158018
Energy: 0.849381873080455
Energy: 0.7662465287666291
Energy: 0.8515845087107135
Energy: 0.91714125061193
Energy: 0.7660162185368344
Energy: 0.7664311604800847
Energy: 1.0520461465842716
Energy: 0.7661068874054152
Energy: 0.8574723194055592
Energy: 1.0397810715003943
Energy: 0.8770319882938687
Energy: 0.87657494857652
Energy: 1.0346951326706288
Energy: 0.8958263092553834
Energy: 0.8761220892388351
Energy: 0.7660082997265089
Energy: 1.0510484165238068
Energy: 0.7659796886310403
Energy: 0.7680778939298291
Energy: 1.0558701110616202
Energy: 0.7660372106627551
Energy: 1.0395856757978994
Energy: 0.9087405149349818
Energy: 0.9079756374511073
Energy: 1.0421172344036258
Energy: 0.9090430531346347
Energy: 0.9074352458727983
Energy: 1.0620504706762524
Energy: 0.7776417612117035
Energy: 0.777541798296822
Energy: 1.0577051514296676
Energy: 0.7775174343101517
Energy: 0.8664563293255517
Energy: 0.7683645843654976
Energy: 0.7777748566992272
Energy: 0.7774373116475282
Energy: 0.856736933550927
Energy: 0.7780676008092573
Energy: 0.8551464628865069
Energy: 0.8021123269718927
Energy: 0.855691027102045
Energy: 0.8559152239993357
Energy: 0.8021904032689177
Energy: 0.8562796014443614
Energy: 0.8561210184168957
Energy: 0.802388112986804
Energy: 1.069277111186679
Energy: 0.8023712087330876
Energy: 0.8047956415614816
Energy: 1.0696903462549017
Energy: 0.8025688618722358
Energy: 1.0596819813251341
Energy: 0.8557038250846859
Energy: 0.8712307081754697
Energy: 1.062214448033766
Energy: 0.8557542099942828
Energy: 0.8711857782427389
Energy: 1.0923318379768763
Energy: 0.8439531955044052
Energy: 0.8439047664380082
Energy: 1.094858402964629
Energy: 0.8440662659896355
Energy: 0.9010717405063338
Energy: 0.8030979805489062
Energy: 0.8436403682347952
Energy: 0.8800034197663129
Energy: 0.8649653817166777
Energy: 0.843463960563466
Energy: 0.8717318937049598
Energy: 0.9621559934508079
Energy: 0.879196194264542
Energy: 0.9163279472887846
Energy: 0.9884350833537958
Energy: 0.9136099121419556
Energy: 0.9160319561190239
Energy: 0.9112792100948348
Energy: 0.901907736911067
Energy: 0.9084177922466988
Energy: 0.9132293583179936
Energy: 1.0923998311242087
Energy: 0.9087372115397003
Energy: 1.1153087759607108
Energy: 0.8840633879316151
Energy: 0.901768708328305
Energy: 1.1180479468647913
Energy: 0.8832690805348242
Energy: 0.901169203104661
Energy: 1.1380981833576334
Energy: 0.9386170474886556
Energy: 0.9356824780701452
Energy: 0.9352307985025516
Energy: 1.055105782562854
Energy: 1.1414215858118872
Energy: 0.8477617081068574
Energy: 1.0163129858423257
Energy: 0.9086076188108954
Energy: 0.8895266903570935
Energy: 1.0159779950465422
Energy: 0.882004397310274
Energy: 1.0503332840013948
Energy: 1.0167507920163397
Energy: 1.0160097092444522
Energy: 1.0504208384344844
Energy: 1.0764512237650308
Energy: 1.0008710212583758
Energy: 1.1417556292082585
Energy: 0.9334839778580885
Energy: 0.9014784236059935
Energy: 1.1085584533491495
Energy: 1.0271265065260837
Energy: 1.0163380788163536
Energy: 1.165784310600054
Energy: 0.919573131150505
Energy: 0.9439775890645834
Energy: 1.1679638986046323
Energy: 0.9148933743182797
Energy: 0.9439481443306694
Energy: 1.1630636900209446
Energy: 1.0167105097364473
Energy: 1.016330523594494
Energy: 1.0162363441815507
Energy: 1.0752936703895397
Energy: 1.0007256564872993

minimum gb energy = 0.7655898898158018 eV
minimum distance =  2.28153269425752 Angstroms
sigma value = 81


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

Energy: 0.3452225694542835
Energy: 0.13845421130172275
Energy: 0.08219260552560777
Energy: 0.08436969078696889
Energy: 0.6618121589897465
Energy: 0.34588168372269734
Energy: 0.4032745961984996
Energy: 0.6058179084711114
Energy: 0.6057728156062439
Energy: 0.851788654051268
Energy: 0.6060934643770393
Energy: 0.7374625478462867
Energy: 0.6591411611162344
Energy: 0.08217183925152814
Energy: 0.0822519444986487
Energy: 0.6863184405175753
Energy: 0.08200635463164799
Energy: 0.08180951519472951
Energy: 0.6233210332922787
Energy: 0.0821977412791446
Energy: 0.08236495257590544
Energy: 0.6156283527853891
Energy: 0.0822276653740095
Energy: 0.1396702231636262
Energy: 0.13871649260743601
Energy: 0.6684024308346599
Energy: 0.6677668231371454
Energy: 0.1404704407590727
Energy: 0.6677138842062326
Energy: 0.6594212013565106
Energy: 0.08306431950379205
Energy: 0.6054174181091637
Energy: 0.08229782995967412
Energy: 0.08176522778468338
Energy: 0.6052027321252548
Energy: 0.08212675980293078
Energy: 0.6150450054461912
Energy: 0.6132730319868467
Energy: 0.6132593244958614
Energy: 0.6689858736208919
Energy: 0.6131269275465704
Energy: 0.7184920241609465
Energy: 0.6778851670076317
Energy: 0.08207503701748771
Energy: 0.08219722996632121
Energy: 0.6709438309631747
Energy: 0.08203693984521565
Energy: 0.08218018165130156
Energy: 0.6066725518483712
Energy: 0.08223092944881132
Energy: 0.13849597120692977
Energy: 0.6357163963678373
Energy: 0.08226965093918956
Energy: 0.13800352004909228
Energy: 0.34588444954853004
Energy: 0.6602244023215968
Energy: 0.6614447166090074
Energy: 0.08205996299702324
Energy: 0.661218541223239
Energy: 0.6602869818098168

minimum gb energy = 0.08176522778468338 eV
minimum distance =  2.44226381596091 Angstroms
sigma value = 3


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

Energy: 1.0343062106414396
Energy: 1.0438809459039877
Energy: 1.060566547385827
Energy: 1.0348419823714916
Energy: 1.0109161921388157
Energy: 1.0359548853631075
Energy: 1.0242976370526222
Energy: 1.0217477642429296
Energy: 1.0204418103237773
Energy: 1.0562004819619004
Energy: 1.025976824376281
Energy: 1.0199316535064642
Energy: 1.016879691248931
Energy: 0.9885678953960825
Energy: 0.9885207272400434
Energy: 1.0166221852663235
Energy: 0.9887969200907978
Energy: 1.0136016793129794
Energy: 0.9530060412776611
Energy: 0.9885305063391896
Energy: 0.9882388029695903
Energy: 0.953229740042075
Energy: 0.8611427671057471
Energy: 1.0136852862603596
Energy: 0.8788073157587966
Energy: 1.0142646327554419
Energy: 1.0205456561007484
Energy: 0.8787744298198031
Energy: 1.025855262561023
Energy: 1.019999243314542
Energy: 1.0003145503012967
Energy: 1.019750492308007
Energy: 1.0181555341290394
Energy: 0.9722861744650206
Energy: 1.020021632482384
Energy: 0.9717664381302795
Energy: 0.9893583715987561
Energy: 0.8856987524895948
Energy: 0.9649712602815277
Energy: 0.9895268844371456
Energy: 0.889707643785942
Energy: 0.9619959333755609
Energy: 0.9613737987768728
Energy: 0.9781178289065008
Energy: 0.9778142980588257
Energy: 0.9621506836017454
Energy: 0.9452466487297372
Energy: 0.9200176385749107
Energy: 0.9827281366926349
Energy: 0.9782629557778137
Energy: 0.9994526544645593
Energy: 1.0038533379048786
Energy: 0.8269386620362281
Energy: 0.9994528796317225
Energy: 0.8309935962366622
Energy: 0.8873248636235253
Energy: 0.8870229141527496
Energy: 0.8310825658257869
Energy: 0.8907494627667878
Energy: 0.8862244354225746
Energy: 0.9777258029930822
Energy: 0.985313457302668
Energy: 0.9853834055309757
Energy: 0.9508221767280755
Energy: 0.9561807717932207
Energy: 0.9499224203348418
Energy: 0.8330550217871315
Energy: 0.9883541192122253
Energy: 0.98586625334112
Energy: 0.8307980040039661
Energy: 0.9707103084918324
Energy: 0.8301687031460991
Energy: 0.825707123917233
Energy: 0.9321696605109828
Energy: 0.9529760619410852
Energy: 0.8261245853888994
Energy: 0.9319985199636163
Energy: 0.8263033456723217
Energy: 0.9440630685890791
Energy: 0.7981197783622984
Energy: 0.9555587592555076
Energy: 0.9598931888150339
Energy: 0.7966797735747657
Energy: 0.9588722134904457
Energy: 0.9677033383784762
Energy: 0.7888356876958423
Energy: 0.7892404995629171
Energy: 0.9683510060227428
Energy: 0.7887367932492804
Energy: 0.7890975542832405
Energy: 0.9660739245124691
Energy: 0.9354317498064103
Energy: 0.9395026008337545
Energy: 0.9339059137863909
Energy: 0.9439084741160012
Energy: 0.9347842593814182
Energy: 0.7832983334920091
Energy: 0.93523582259164
Energy: 0.9352705440861717
Energy: 0.7797227683981405
Energy: 0.9351382973860971
Energy: 0.7778291552136477
Energy: 0.7828131120164613
Energy: 0.9304978456848161
Energy: 0.9292308570929957
Energy: 0.7827915789741974
Energy: 0.9311468496224813
Energy: 0.7705304983234381
Energy: 0.9652664295449289
Energy: 0.9357863106031975
Energy: 0.945654862376201
Energy: 0.9314211173997543
Energy: 0.9559295571094176
Energy: 0.9454426182004988
Energy: 0.957051825571104
Energy: 0.7740964698696879
Energy: 0.7736935529528765
Energy: 0.9494844127124303
Energy: 0.781536735539694
Energy: 0.7743394043675305
Energy: 0.9400940438746611
Energy: 0.9347215576537372
Energy: 0.9367226099231197
Energy: 0.9419163827593016
Energy: 0.9664330437540205
Energy: 0.9359042384195012
Energy: 0.8056353381614096
Energy: 0.9341105367527496
Energy: 0.8620878097896392
Energy: 0.8062633069382446
Energy: 0.962455987102686
Energy: 0.7888826036935437
Energy: 0.7969287175201286
Energy: 0.9595693443365623
Energy: 0.9605118167746757
Energy: 0.7969085944111372
Energy: 0.9565085885270378
Energy: 0.9574733404866481
Energy: 0.9772659435484377
Energy: 0.8269262014270617
Energy: 0.8263238781493968
Energy: 0.9399718530343926
Energy: 0.8266713401934922
Energy: 0.9379847975367839
Energy: 0.8778619423103232
Energy: 0.8305784165026924
Energy: 0.8304294452924473
Energy: 0.8782719662277203
Energy: 0.8335461356262536
Energy: 0.8305029937696127
Energy: 0.9554022899834607
Energy: 0.9635959394159451
Energy: 0.9632403119219957
Energy: 0.9554143379898682
Energy: 0.935328481663729
Energy: 0.9848101571302562
Energy: 0.8897447563536766
Energy: 0.9631699935551278
Energy: 0.9632814368485421
Energy: 0.889380118540384
Energy: 0.8877587755798215
Energy: 0.8889063670856613
Energy: 0.8502451347765669
Energy: 1.0019508037632616
Energy: 0.9994247811297942
Energy: 0.8502473301366376
Energy: 1.0076969457576552
Energy: 0.9987797601755332
Energy: 0.9606946296612282
Energy: 0.9539020257697463
Energy: 0.9599946466086661
Energy: 0.9596123187252941
Energy: 0.9509738056338256
Energy: 0.9593090151386822
Energy: 0.887522510955142
Energy: 0.9585674451259437
Energy: 0.9579993914542382
Energy: 0.8849332066712503
Energy: 0.9640415803478869
Energy: 1.035575445339177
Energy: 0.9608423379195955
Energy: 0.9904642206589059
Energy: 0.990170684161399
Energy: 0.9610982510342582
Energy: 0.9513187482917872
Energy: 0.9900558334676063
Energy: 1.0538356601766095
Energy: 0.9904539447666181
Energy: 0.9960638288043243
Energy: 1.0227199866263132
Energy: 0.8450475280019228
Energy: 1.0192467440140935
Energy: 0.9047158516806918
Energy: 0.9504780231750559
Energy: 0.9501841326770885
Energy: 0.9050063552940139
Energy: 0.9513478216125071
Energy: 0.9759865045754974

minimum gb energy = 0.7705304983234381 eV
minimum distance =  2.2953053097846 Angstroms
sigma value = 67


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

Energy: 1.279011002281692
Energy: 1.263075635890726
Energy: 1.2775466006460692
Energy: 1.2027284440490669
Energy: 1.254382606714256
Energy: 1.2877094276555205
Energy: 1.1655039402567322
Energy: 1.1997526882421896
Energy: 1.1985144762603253
Energy: 1.2451521211711376
Energy: 1.2032950241325968
Energy: 1.2261889513985682
Energy: 1.280855398928834
Energy: 1.170093977459891
Energy: 1.1936996362192962
Energy: 1.1985684690339105
Energy: 1.1711507627081603
Energy: 1.1941879906534956
Energy: 1.1560013594192922
Energy: 1.192845907718302
Energy: 1.192657978150273
Energy: 1.1569499984668885
Energy: 1.1002756150760495
Energy: 1.1932076514497783
Energy: 1.1097258778663024
Energy: 1.199170440911922
Energy: 1.2265912149467861
Energy: 1.10966480621364
Energy: 1.202974324950047
Energy: 1.2248762382414327
Energy: 1.237058643116493
Energy: 1.1985757794942304
Energy: 1.1740928354035975
Energy: 1.1723722139893082
Energy: 1.1986419387514688
Energy: 1.172620591558621
Energy: 1.1111319517441252
Energy: 1.14441098892999
Energy: 1.1116695015226603
Energy: 1.1111940302452659
Energy: 1.1165055177737928
Energy: 1.1369986296251453
Energy: 1.15967336227768
Energy: 1.1643399434469517
Energy: 1.169432301741611
Energy: 1.1604793218488447
Energy: 1.1640217525010605
Energy: 1.1093641752248318
Energy: 1.153831961488455
Energy: 1.197310277788868
Energy: 1.1960377293006879
Energy: 1.1992179812736603
Energy: 1.0148486469430482
Energy: 1.2040047886364635
Energy: 0.9705053278874526
Energy: 1.0235291435423879
Energy: 1.0224564942712828
Energy: 0.9708147560913557
Energy: 1.0234503330037277
Energy: 1.015687363495957
Energy: 1.0828493224424893
Energy: 1.1583441254632483
Energy: 1.1800972280244457
Energy: 1.1666664504095916
Energy: 1.1463397810391096
Energy: 1.1706288531293123
Energy: 0.9716161824839392
Energy: 1.1578996436814566
Energy: 1.1551564618270673
Energy: 0.9711287449514339
Energy: 1.1575473102400489
Energy: 0.9709814957597728
Energy: 0.9780284815162392
Energy: 1.152558446589659
Energy: 1.1504229611540207
Energy: 0.9769075082394811
Energy: 1.1501364253077944
Energy: 0.9755979361906462
Energy: 1.1528515417746819
Energy: 1.0886367722430934
Energy: 1.1503825434189006
Energy: 1.148941957652459
Energy: 1.1708408172454283
Energy: 1.1497275529684154
Energy: 1.1556168788203058
Energy: 0.9830188240989414
Energy: 0.9773772192164621
Energy: 1.1569283353264075
Energy: 0.9795232330919533
Energy: 0.9731601196181543
Energy: 1.13718343382353
Energy: 1.1553850460018675
Energy: 1.1618408009181738
Energy: 1.1623891330607026
Energy: 1.0807641714688512
Energy: 1.1581744284454403
Energy: 1.037448906015576
Energy: 1.1581423713304024
Energy: 1.1538413510294954
Energy: 1.0387247717689472
Energy: 1.150765076001584
Energy: 1.0213651618366524
Energy: 1.015962863051662
Energy: 1.1960313357349015
Energy: 1.1983437227333102
Energy: 1.0160032172488642
Energy: 1.1690287748482195
Energy: 1.1227322031171716
Energy: 1.1950117759691454
Energy: 1.157335453756907
Energy: 1.164942352004956
Energy: 1.177359256225944
Energy: 1.1558917608819852
Energy: 1.1738202850419868
Energy: 1.01466178908776
Energy: 1.118928489696445
Energy: 1.1383245384263565
Energy: 1.1150065607731516
Energy: 1.114074422899934
Energy: 1.137382070025517
Energy: 1.1182563653565194
Energy: 1.2229167380444477
Energy: 1.221997300757042
Energy: 1.1183206027714137
Energy: 0.9816693585196419
Energy: 1.1672846690506682
Energy: 1.2809408565868345
Energy: 1.1669752545753287
Energy: 1.1686048905675537
Energy: 1.1979017071876883
Energy: 1.1699854628819029
Energy: 1.1713373868164718
Energy: 1.1657410945582798
Energy: 1.1165745799277391
Energy: 1.1988732692188078
Energy: 1.165731473504777
Energy: 1.1152163564950297
Energy: 1.225748687183702

minimum gb energy = 0.9705053278874526 eV
minimum distance =  2.28923653990041 Angstroms
sigma value = 33


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

Energy: 1.8690307751720496
Energy: 1.4012847500838481
Energy: 1.3997200189508854
Energy: 1.3943602119121539
Energy: 1.4938061866586858
Energy: 1.3973390818641556
Energy: 1.2641354862433452
Energy: 1.3093670173832166
Energy: 1.309227407674908
Energy: 1.3751371636769107
Energy: 1.3141441098762028
Energy: 1.3439511658955816
Energy: 1.392818558689567
Energy: 1.3394553247435381
Energy: 1.3392608787220324
Energy: 1.3932913344563433
Energy: 1.3405382204732152
Energy: 1.339371965024307
Energy: 1.2117102911008473
Energy: 1.3403944712469054
Energy: 1.3405353176294805
Energy: 1.2116757957611046
Energy: 1.1936913825713618
Energy: 1.3389698970175508
Energy: 1.1967780264116268
Energy: 1.3093362031973466
Energy: 1.346962440904931
Energy: 1.1967734142657565
Energy: 1.31268048537958
Energy: 1.343954695140044
Energy: 1.2103568486506593
Energy: 1.3719787366746161
Energy: 1.3441566888252963
Energy: 1.3252045862427835
Energy: 1.3726763121633876
Energy: 1.323806300446449
Energy: 1.1972781093283607
Energy: 1.3488245742354883
Energy: 1.3475345102753673
Energy: 1.1970971396954349
Energy: 1.3466146051533499
Energy: 1.2318901775998752
Energy: 1.2112300792074393
Energy: 1.310248883854484
Energy: 1.3100240501568015
Energy: 1.2113757344932155
Energy: 1.3111800559478042
Energy: 1.2442726582166728
Energy: 1.2773705513377376
Energy: 1.31130103114514
Energy: 1.31291832550406
Energy: 1.3045011017819255
Energy: 1.0994452748290315
Energy: 1.3078283321019546
Energy: 1.2854565534707525
Energy: 1.0995546792594133
Energy: 1.0994306450567926
Energy: 1.286866400806864
Energy: 1.1010368552911438
Energy: 1.099027955972352
Energy: 1.1976988795754933
Energy: 1.214418011957682
Energy: 1.2818210703149309
Energy: 1.2809554889670942
Energy: 1.1911672940070481
Energy: 1.2835739380599165
Energy: 1.0986647199994244
Energy: 1.284638770486457
Energy: 1.2845742999202467
Energy: 1.0976568881210125
Energy: 1.2707240551496222
Energy: 1.098334064993725
Energy: 1.097374749577156
Energy: 1.3042322239190844
Energy: 1.3056497706427188
Energy: 1.0973472253843652
Energy: 1.2806812462683983
Energy: 1.097808080957156
Energy: 1.0763467158853584
Energy: 1.320190160790271
Energy: 1.302980638669839
Energy: 1.2879223338446344
Energy: 1.3374393936845965
Energy: 1.2914512713387047
Energy: 1.1808394515165985
Energy: 1.196954182403426
Energy: 1.2357076737571235
Energy: 1.1808948771978447
Energy: 1.1998215746552015
Energy: 1.2326430542649855
Energy: 1.2047208398244287
Energy: 1.3318468034007058
Energy: 1.3316230034311913
Energy: 1.232059769754452
Energy: 1.124494012788763
Energy: 1.234778994404998
Energy: 1.3928911244235096
Energy: 1.3308433297479128
Energy: 1.3308766025752286
Energy: 1.3261805356386906
Energy: 1.3526535318336628
Energy: 1.3303939388173343
Energy: 1.3753001912275062
Energy: 1.3094925208415211
Energy: 1.3090812967935423
Energy: 1.3752250664500405
Energy: 1.311154356434257
Energy: 1.326199296043795
Energy: 1.3436240885503223
Energy: 1.3277637337170851
Energy: 1.3484743829212689
Energy: 1.3548172965872638
Energy: 1.3274663255330115
Energy: 1.315762031649357
Energy: 1.2641276274480227
Energy: 1.3092143362185615
Energy: 1.3091709146207444
Energy: 1.2642408707592336
Energy: 1.3136382927218764
Energy: 1.3094596013341302
Energy: 1.3929049207717716
Energy: 1.3407576743863017
Energy: 1.34035587035526
Energy: 1.3942035247350224
Energy: 1.3210453959408295
Energy: 1.340835415087677
Energy: 1.3290575792236123
Energy: 1.3394056244112158
Energy: 1.3395609528452141
Energy: 1.327682520655167
Energy: 1.3405249615835235
Energy: 1.3397950344717768
Energy: 1.19706780368319
Energy: 1.3095471545390531
Energy: 1.347272294723226
Energy: 1.1971633993867181
Energy: 1.3140480540686548
Energy: 1.344167307900126
Energy: 1.098758807637306
Energy: 1.3726630741308272
Energy: 1.3449703517644525
Energy: 1.3250324349150244
Energy: 1.3714323971658045
Energy: 1.297314895205949
Energy: 1.1971707975382335
Energy: 1.3490266603235475
Energy: 1.3473254161655528
Energy: 1.1972098080032296
Energy: 1.3464400298519899
Energy: 1.3479088167892137
Energy: 1.2118120202586022
Energy: 1.3104619768184538
Energy: 1.3107449281335088
Energy: 1.2135716504001086
Energy: 1.3107808929125966
Energy: 1.2332145496112388
Energy: 1.2828901262689865
Energy: 1.310225083147705
Energy: 1.3102906744218732
Energy: 1.2854302538148328
Energy: 1.0992913487022504
Energy: 1.320901693233235
Energy: 1.2826656098911433
Energy: 1.0995279299000063
Energy: 1.0994315884868424
Energy: 1.2846462096938458
Energy: 1.1019551652425619
Energy: 1.0986418330854038
Energy: 1.1961541212284823
Energy: 1.1908766331767904
Energy: 1.2831235076527663
Energy: 1.2834352392114365
Energy: 1.191366922988695
Energy: 1.2840850534980406
Energy: 1.0972390225341724
Energy: 1.2821689512619798
Energy: 1.282271373602566
Energy: 1.097228828754801
Energy: 1.2722353498334071
Energy: 1.0983853616508241
Energy: 1.0995140005743527
Energy: 1.3033233816216627
Energy: 1.215096663452525
Energy: 1.0980106195852821
Energy: 1.281014657364551
Energy: 1.098272474573335
Energy: 1.0697226486007843
Energy: 1.3102214415594975
Energy: 1.3219496031846534
Energy: 1.2838136106031781
Energy: 1.3382011533917948
Energy: 1.2901968184906585
Energy: 1.0706840011124903
Energy: 1.1981848566165647
Energy: 1.2323757261446608
Energy: 1.0706892714802596
Energy: 1.2136988176557988
Energy: 1.2328531989798948
Energy: 1.2110638943208163
Energy: 1.2473453671816361
Energy: 1.2318420245573738
Energy: 1.2324934941689254
Energy: 1.124354477679176
Energy: 1.2355876246447892
Energy: 1.3854327346614645
Energy: 1.3531915853014391
Energy: 1.3522124584040258
Energy: 1.3879271871186267
Energy: 1.2865140478547037
Energy: 1.317295260964277
Energy: 1.3753893476784145
Energy: 1.309218299861047
Energy: 1.3120985524719357
Energy: 1.3755431332215498
Energy: 1.310125816456248
Energy: 1.3439229743657095
Energy: 1.3431004175773378
Energy: 1.3267576680106425
Energy: 1.3457670040632288
Energy: 1.3541971279940974
Energy: 1.3276995401100264
Energy: 1.3157912156694687

minimum gb energy = 1.0697226486007843 eV
minimum distance =  2.29202816457176 Angstroms
sigma value = 41


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

Energy: 1.7365445594476872
Energy: 1.5667849832203824
Energy: 1.560482797667006
Energy: 1.7389422852278287
Energy: 1.9959956419868599
Energy: 1.5601460603011124
Energy: 1.338221337523861
Energy: 1.4217584507112009
Energy: 1.420711611748157
Energy: 1.4847712855632436
Energy: 1.5347689667605928
Energy: 1.4207754518694626
Energy: 1.5309289577098368
Energy: 1.4709907704822496
Energy: 1.4709038302496462
Energy: 1.4232602449542637
Energy: 1.4710583387389677
Energy: 1.4169927059426608
Energy: 1.4282064040855857
Energy: 1.4704256586631386
Energy: 1.470548403871698
Energy: 1.4287463628937576
Energy: 1.2765749648680274
Energy: 1.4213417123890897
Energy: 1.278839033895524
Energy: 1.4226644134321258
Energy: 1.4213303001432207
Energy: 1.2788140668654118
Energy: 1.424030817233916
Energy: 1.4770514121711147
Energy: 1.464950078350074
Energy: 1.4783610083877254
Energy: 1.4763142623371273
Energy: 1.4657461970311665
Energy: 1.4870183073987406
Energy: 1.4769548103666599
Energy: 1.2777806895866506
Energy: 1.4783522181269764
Energy: 1.4747646363126476
Energy: 1.2778147839457838
Energy: 1.4771118911604137
Energy: 1.2798945804664887
Energy: 1.2815260100910455
Energy: 1.4530776957242575
Energy: 1.338642093891561
Energy: 1.2825535735084872
Energy: 1.4505604551207594
Energy: 1.2790848069732248
Energy: 1.444662761774865
Energy: 1.4587105373769464
Energy: 1.4523192847955708
Energy: 1.4520385467287813
Energy: 1.3372738523430179
Energy: 1.4509945338954116
Energy: 1.361238792864526
Energy: 1.2798615595665468
Energy: 1.2791540845727234
Energy: 1.3546191321388146
Energy: 1.2810485462274759
Energy: 1.337695667928836
Energy: 1.4687119440071943
Energy: 1.2792921185035002
Energy: 1.476284091924356
Energy: 1.4746425141673987
Energy: 1.2145167213228656
Energy: 1.4775010371273245
Energy: 1.4588903423547859
Energy: 1.4471642987103392
Energy: 1.4470148133525
Energy: 1.4594967831953232
Energy: 1.446889022926949
Energy: 1.398639959451404
Energy: 1.4861326292491275
Energy: 1.4197453554293098
Energy: 1.420958918582519
Energy: 1.4813162608728645
Energy: 1.420810460233041
Energy: 1.4226904896385764
Energy: 1.4772447343215542
Energy: 1.4218303670304222
Energy: 1.4845075210543852
Energy: 1.4772803520356892
Energy: 1.4222389336222583
Energy: 1.4818882296179305

minimum gb energy = 1.2145167213228656 eV
minimum distance =  2.31997046532926 Angstroms
sigma value = 11


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

Energy: 2.1432240592569136
Energy: 1.6468962511277145
Energy: 1.7330445647936483
Energy: 1.6355844237578467
Energy: 1.6489854622246292
Energy: 1.7859280287535046
Energy: 1.6321519835650051
Energy: 1.4074094714434688
Energy: 1.4074587976704764
Energy: 1.7118011169109593
Energy: 1.441418318347177
Energy: 1.4083459417388955
Energy: 1.7029588684599908
Energy: 1.552272899465551
Energy: 1.5011116103919613
Energy: 1.7028898045217455
Energy: 1.5175556626986941
Energy: 1.5047346528809376
Energy: 1.548121054061327
Energy: 1.5572695175548812
Energy: 1.5656597418618456
Energy: 1.5490277979067222
Energy: 1.378945664797076
Energy: 1.5664190910052675
Energy: 1.5031546041643822
Energy: 1.406758758786076
Energy: 1.406547314902176
Energy: 1.5034564768958818
Energy: 1.4067438455184673
Energy: 1.4071274432215977
Energy: 1.6775235914729798
Energy: 1.4391931570319063
Energy: 1.5262752377987185
Energy: 1.5069540121561738
Energy: 1.4392979152546
Energy: 1.5709542220347275
Energy: 1.439253925070902
Energy: 1.5498653929247839
Energy: 1.5235968344068516
Energy: 1.439318301888065
Energy: 1.5294167429385506
Energy: 1.5227461480174478
Energy: 1.4413961298050688
Energy: 1.5279894722356935
Energy: 1.408602826884791
Energy: 1.4416066804655248
Energy: 1.5041996093376668
Energy: 1.4063107131188952
Energy: 1.416172905701217
Energy: 1.505242339111309
Energy: 1.504383989702203
Energy: 1.3969667225271676
Energy: 1.6309502277564298
Energy: 1.5464145669440452
Energy: 1.4157848027472495
Energy: 1.5051880150382122
Energy: 1.5047497201066673
Energy: 1.4161685043898193
Energy: 1.5044155825036392
Energy: 1.536370321215905
Energy: 1.4415691097426806
Energy: 1.5259040903409284
Energy: 1.4586048584264966
Energy: 1.4413995376244764
Energy: 1.4421732381430392
Energy: 1.4081726279150948
Energy: 1.420554033853399
Energy: 1.521983817940096
Energy: 1.5023764246317155
Energy: 1.4217303365123828
Energy: 1.5171975521057763
Energy: 1.502794703779213
Energy: 1.4062317508430353
Energy: 1.5036107603257904
Energy: 1.5043075858015926
Energy: 1.406325608741677
Energy: 1.6653608686561676
Energy: 1.458787536805402
Energy: 1.4682475590813078
Energy: 1.5045821837640363
Energy: 1.5046642855976202
Energy: 1.5115546437489908
Energy: 1.7635484051250654
Energy: 1.5044442328712826
Energy: 1.3827190404465801
Energy: 1.5249921834135622
Energy: 1.5251982711945218
Energy: 1.3827577785726828
Energy: 1.5055694577812018
Energy: 1.5475108248072214
Energy: 1.383676159724501
Energy: 1.5301996241189828
Energy: 1.381550188522352
Energy: 1.3850307480259767
Energy: 1.547724408118133
Energy: 1.38124809680123
Energy: 1.3811796748384313
Energy: 1.559715898324473
Energy: 1.5624671191328834
Energy: 1.381193771775149
Energy: 1.545594871191613
Energy: 1.571926161289914
Energy: 1.7428016354185079
Energy: 1.566352099618254
Energy: 1.53775133546643
Energy: 1.6035703550297875
Energy: 1.567522049614049
Energy: 1.482903257488821
Energy: 1.443770898955002
Energy: 1.4449938329854328
Energy: 1.4445951700798647
Energy: 1.4438643911381768
Energy: 1.567264124222996
Energy: 1.492533569112189
Energy: 1.5247877590019279
Energy: 1.5879415732087954
Energy: 1.5334789600853906
Energy: 1.5264378645097634
Energy: 1.557802757343744
Energy: 1.4699109000951271
Energy: 1.5695811141282539
Energy: 1.595645666263401
Energy: 1.4652762943620254
Energy: 1.571566435402332
Energy: 1.3812194198153573
Energy: 1.5059920591124134
Energy: 1.4396609649522947
Energy: 1.445331851048158
Energy: 1.4450576165412874
Energy: 1.405018724979422
Energy: 1.4890052087542436
Energy: 1.4458552841667187
Energy: 1.4966944207934798
Energy: 1.5348377475877242
Energy: 1.5000637805511887
Energy: 1.5494917021475143
Energy: 1.5270279804746134
Energy: 1.5003516288784333
Energy: 1.5667804160704608
Energy: 1.4447464269293582
Energy: 1.520302763743998
Energy: 1.5666632919753603
Energy: 1.4442449697696957
Energy: 1.4627057643668449
Energy: 1.5673471978498126
Energy: 1.549263379195922
Energy: 1.5280242128630446
Energy: 1.5689571164367502
Energy: 1.654354046483573
Energy: 1.5284952862770116
Energy: 1.5733541503123414
Energy: 1.3805922345946777
Energy: 1.561750884125658
Energy: 1.5425936734621624
Energy: 1.3815391835370308
Energy: 1.5800976093907741
Energy: 1.550315966219168
Energy: 1.3819588751731824
Energy: 1.3812240426724711
Energy: 1.5496136720116767
Energy: 1.3823842186819137
Energy: 1.3812486772315802
Energy: 1.5475361491181476
Energy: 1.3816742888386382
Energy: 1.5488676971674098
Energy: 1.5246565131601426
Energy: 1.383338291232594
Energy: 1.5482270466676713
Energy: 1.7703728877238278
Energy: 1.5130672620588332
Energy: 1.4927560490855283
Energy: 1.7114685597636938
Energy: 1.5138296191969933
Energy: 1.4931377778639088
Energy: 1.7113283026687716
Energy: 1.4061452409020008
Energy: 1.4592080257734916
Energy: 1.7129546787891343
Energy: 1.406031255237993
Energy: 1.544892901877841
Energy: 2.1471052807180233
Energy: 1.4312632909621728
Energy: 1.4700846151957043
Energy: 1.5632950437164825
Energy: 1.4226139952619417
Energy: 1.4705556917245406

minimum gb energy = 1.378945664797076 eV
minimum distance =  2.30905855051735 Angstroms
sigma value = 57


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

Energy: 1.935781439118321
Energy: 1.6639452445421568
Energy: 1.6952173778269164
Energy: 1.9392800498871918
Energy: 2.130865069020187
Energy: 1.698982436128675
Energy: 1.3456259225361207
Energy: 1.415351919145848
Energy: 1.3856259416226164
Energy: 1.5476949970055622
Energy: 1.551649471315827
Energy: 1.4036461384310477
Energy: 1.5128936839848235
Energy: 1.3995129221899725
Energy: 1.377289637323191
Energy: 1.512660639178615
Energy: 1.4085357746733542
Energy: 1.384706504639044
Energy: 1.5118177543415579
Energy: 1.4038977689471415
Energy: 1.3800825185414398
Energy: 1.5137460665350302
Energy: 1.4065474120206867
Energy: 1.3811599025056995
Energy: 1.4127956203020315
Energy: 1.381064954853398
Energy: 1.381724814111834
Energy: 1.4129917667589091
Energy: 1.3796599580949247
Energy: 1.3793976805590924
Energy: 1.4612704456614936
Energy: 1.4016850881959824
Energy: 1.4012850866175723
Energy: 1.4156018934695067
Energy: 1.512182246033168
Energy: 1.4143941453907085
Energy: 1.513080308353788
Energy: 1.4463857055309977
Energy: 1.4469755116951648
Energy: 1.5150134110970261
Energy: 1.4501876140033758
Energy: 1.4009606558005816
Energy: 1.5475675775599387
Energy: 1.4047407477664549
Energy: 1.383394794965705
Energy: 1.5495394474092536
Energy: 1.4138001081903915
Energy: 1.381828343288472
Energy: 1.3461010882582813
Energy: 1.3792144094482217
Energy: 1.3479272158647277
Energy: 1.352099321802569
Energy: 1.5136649222281087
Energy: 1.3471166798104426
Energy: 1.3461465523386575
Energy: 1.3791528893980622
Energy: 1.34777156222244
Energy: 1.427711897709252
Energy: 1.5191045074025071
Energy: 1.3468692570637772
Energy: 1.5476163035982695
Energy: 1.4037734222006613
Energy: 1.4045417239300813
Energy: 1.549553491612788
Energy: 1.4136457084167644
Energy: 1.3824255700030943
Energy: 1.5066617972679706
Energy: 1.5767497069732825
Energy: 1.5779801428967792
Energy: 1.5077943602877637
Energy: 1.6930321353690023
Energy: 1.3795229111724714
Energy: 1.4128067170490666
Energy: 1.4149154112215232
Energy: 1.415021526965134
Energy: 1.4147321900175267
Energy: 1.4163519019446296
Energy: 1.532582040607219
Energy: 1.6990988341284654
Energy: 1.38110113606002
Energy: 1.3793956439024462
Energy: 1.415492787631384
Energy: 1.5163626657213258
Energy: 1.3796597477561952
Energy: 1.5120519641819374
Energy: 1.4472360307031504
Energy: 1.383055804630775
Energy: 1.512196371866962
Energy: 1.448167155964589
Energy: 1.3811748021153252
Energy: 1.5218401679039788
Energy: 1.4471690278412679
Energy: 1.4273722009417207
Energy: 1.5220915033501818
Energy: 1.4474837599124117
Energy: 1.3849818206982634
Energy: 1.3455959818761538
Energy: 1.4137917966430362
Energy: 1.4146714661582995
Energy: 1.3457112406162528
Energy: 1.4158542869942334
Energy: 1.414366237436972

minimum gb energy = 1.3455959818761538 eV
minimum distance =  2.31503117785738 Angstroms
sigma value = 9


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

Energy: 2.261088305778577
Energy: 1.6148105803749009
Energy: 1.6224968066285579
Energy: 1.5355694626561494
Energy: 1.5466921859707234
Energy: 1.5310525334939602
Energy: 1.6112330407080617
Energy: 1.520395543208188
Energy: 1.4882299575854228
Energy: 1.5768560004694667
Energy: 1.5370346743231633
Energy: 1.4997138531482244
Energy: 1.5428211509709444
Energy: 1.6317486470842586
Energy: 1.501513291767877
Energy: 1.5442440372012158
Energy: 1.525376702398656
Energy: 1.6055512557845422
Energy: 1.4847209417598886
Energy: 1.50783395274831
Energy: 1.4863137850058303
Energy: 1.4844637056956387
Energy: 1.499373551246747
Energy: 1.505996793975259
Energy: 1.5394190481638388
Energy: 1.45855588545854
Energy: 1.4984438270911937
Energy: 1.539416935744017
Energy: 1.5198133327898078
Energy: 1.5103907508962837
Energy: 1.4786944454702207
Energy: 1.4718396964145228
Energy: 1.467272872409663
Energy: 1.4805958530031786
Energy: 1.5169896067370736
Energy: 1.466676698673032
Energy: 1.4934615311585502
Energy: 1.5769413117463238
Energy: 1.5308440314990002
Energy: 1.4942955219161944
Energy: 1.504688794291199
Energy: 1.5263430491629006
Energy: 1.571766405297489
Energy: 1.4630595297386895
Energy: 1.4723429081229027
Energy: 1.5732246173999698
Energy: 1.4650588035618217
Energy: 1.4741844520705998
Energy: 1.6803057216845259
Energy: 1.5440247668891605
Energy: 1.514653851524643
Energy: 1.5282764579538277
Energy: 1.560098515542823
Energy: 1.5109710774041314
Energy: 1.5940526802561186
Energy: 1.5130522497098586
Energy: 1.5146990982617747
Energy: 1.5522741999964942
Energy: 1.4948173439731836
Energy: 1.4984633068387845
Energy: 1.572159319041965
Energy: 1.4676999366232961
Energy: 1.4677648036685615
Energy: 1.573982131248256
Energy: 1.4667606245709952
Energy: 1.4779904581710097
Energy: 1.5350983057969274
Energy: 1.4883680876629868
Energy: 1.5025162935976752
Energy: 1.5366175557396617
Energy: 1.5159852884284368
Energy: 1.5099656365767715
Energy: 1.7530297147205276
Energy: 1.5648456509931774
Energy: 1.6041762955935344
Energy: 1.481656070868348
Energy: 1.5686344422088754
Energy: 1.6839504798089295
Energy: 1.603545867615051
Energy: 1.5066189443734757
Energy: 1.5068709324691372
Energy: 1.6039494517400608
Energy: 1.5546371845117635
Energy: 1.4856424239616888
Energy: 1.5343893048819868
Energy: 1.463790490737017
Energy: 1.4638524918194604
Energy: 1.5349401672079521
Energy: 1.5259132606824566
Energy: 1.5185384077554054
Energy: 1.5150083951718298
Energy: 1.4921118102332624
Energy: 1.510807162313903
Energy: 1.514509820222025
Energy: 1.5626542764983935
Energy: 1.513958792679329
Energy: 1.5049584730706664
Energy: 1.5018897143493584
Energy: 1.486031167229574
Energy: 1.50557120193269
Energy: 1.534346439057051
Energy: 1.486075377320168
Energy: 1.649551193364038
Energy: 1.5972440657868956
Energy: 1.6128414281356416
Energy: 1.6514442698481548
Energy: 1.589121518421655
Energy: 1.6145375776417965
Energy: 1.5090777825067228
Energy: 1.488010055164501
Energy: 1.5011853744404413
Energy: 1.5091325073779356
Energy: 1.5696879880098744
Energy: 1.498159676672594
Energy: 1.5052148686226017
Energy: 1.4879060951370573
Energy: 1.4870132323515577
Energy: 1.5053284846376043
Energy: 1.5245506742881407
Energy: 1.5031534631082781
Energy: 1.5278763455074953
Energy: 1.5223661171802623
Energy: 1.5187724554721127
Energy: 1.4690788277850138
Energy: 1.5194398079544542
Energy: 1.506011035339414

minimum gb energy = 1.45855588545854 eV
minimum distance =  2.28145550373173 Angstroms
sigma value = 27


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

Energy: 1.9237092991035336
Energy: 1.569178753191379
Energy: 1.740653320395019
Energy: 1.7366575485533238
Energy: 2.007056133341577
Energy: 1.5674355176783763
Energy: 1.5655366020209256
Energy: 1.5829840287852204
Energy: 1.600864297084756
Energy: 1.6143353544851302
Energy: 1.577961994385456
Energy: 1.5302249281007474
Energy: 1.6560840947421287
Energy: 1.665207693525438
Energy: 1.5219591527802383
Energy: 1.4744248162454399
Energy: 1.483632365083628
Energy: 1.649894725315783
Energy: 1.706398588043774
Energy: 1.6484735084783977
Energy: 1.6220451510640852
Energy: 1.5843343114930801
Energy: 1.4641966844531493
Energy: 1.6368815811424409
Energy: 1.493482448327082
Energy: 1.5788653905757175
Energy: 1.6194986536877463
Energy: 1.4872163978077153
Energy: 1.6748148190739516
Energy: 1.5648823509235967
Energy: 1.6752493826906585
Energy: 1.5794386490179309
Energy: 1.576971287521392
Energy: 1.654029690240821
Energy: 1.6428915227494407
Energy: 1.5758875917173039
Energy: 1.6881372255657945
Energy: 1.5681011405886887
Energy: 1.5669613527723898
Energy: 1.4990491327991027
Energy: 1.6651916461444454
Energy: 1.566556795376669
Energy: 1.654762849338359
Energy: 1.5819891204720073
Energy: 1.5744090659556604
Energy: 1.6418525327165896
Energy: 1.556772823614
Energy: 1.6732274974746166
Energy: 1.7403608393478132
Energy: 1.6468791994767853
Energy: 1.590961176722532
Energy: 1.574497609163522
Energy: 1.6476165384610488
Energy: 1.5965172804170888
Energy: 1.740539522181318
Energy: 1.555527962789032
Energy: 1.5595622363724075
Energy: 1.5750865258063371
Energy: 1.5543636261747453
Energy: 1.556739655949749
Energy: 1.685579126012462
Energy: 1.5923764374802885
Energy: 1.7040706666364305
Energy: 1.6645453936360268
Energy: 1.4835841734526714
Energy: 1.6166329521201774
Energy: 1.576011489936194
Energy: 1.5215473626341391
Energy: 1.5324986878828841
Energy: 1.5761650289568565
Energy: 1.4969759717731883
Energy: 1.5324839570656954
Energy: 1.6089662987004252
Energy: 1.6059922198993648
Energy: 1.6133069225768224
Energy: 1.6107316626662482
Energy: 1.6027855932325668
Energy: 1.6129059822610539
Energy: 1.671014083186323
Energy: 1.6086112393439915
Energy: 1.621990860985766
Energy: 1.6001349352638647
Energy: 1.6026045756166707
Energy: 1.5924284992958464
Energy: 1.5753033361364268
Energy: 1.5215455140757668
Energy: 1.5324751913688817
Energy: 1.5773581247869444
Energy: 1.5225843809317792
Energy: 1.540406927261493
Energy: 1.6282226336772463
Energy: 1.561669696324531
Energy: 1.574171952540805
Energy: 1.5836682599251348
Energy: 1.5501047102208663
Energy: 1.5732734670431092
Energy: 1.5051075966354461
Energy: 1.5935423092581966
Energy: 1.5928020628970516
Energy: 1.4956735267568448
Energy: 1.6197418515212039
Energy: 1.5902250657141104
Energy: 1.6107421733089426
Energy: 1.6108451057549809
Energy: 1.5826686010123867
Energy: 1.5849618428516956
Energy: 1.6447121564304765
Energy: 1.5773909806335542
Energy: 1.6411583454810135
Energy: 1.5449753194754556
Energy: 1.5453334783334018
Energy: 1.627589200083477
Energy: 1.5553693077284911
Energy: 1.5420341706079173
Energy: 1.7013317865882163
Energy: 1.5680641251289282
Energy: 1.5421820903200714
Energy: 1.5020610893890503
Energy: 1.555469128397578
Energy: 1.5419898996920844
Energy: 1.8239709559435204
Energy: 1.6284393084512658
Energy: 1.6574870124499368
Energy: 1.6637448593797073
Energy: 1.6540393991023872
Energy: 1.6414286926061314
Energy: 1.4880283679011275
Energy: 1.6053652841314185
Energy: 1.5954171570476121
Energy: 1.482382223069026
Energy: 1.6060977854799863
Energy: 1.5472991582557456
Energy: 1.8433873589278489
Energy: 1.6497250262914882
Energy: 1.6273881629867417
Energy: 1.6938227621646011
Energy: 1.6295041106555634
Energy: 1.6504131059366784
Energy: 1.6562981837633615
Energy: 1.6319559818838774
Energy: 1.507252138127782
Energy: 1.4746458645573763
Energy: 1.6063050507769978
Energy: 1.647503120656078
Energy: 1.6076597567175641
Energy: 1.628408008260457
Energy: 1.6073074993594276
Energy: 1.5250359555029571
Energy: 1.6203675000072497
Energy: 1.5537915684084056

minimum gb energy = 1.4641966844531493 eV
minimum distance =  2.24755022946065 Angstroms
sigma value = 19


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

Energy: 2.1800077411431387
Energy: 1.5816752763189226
Energy: 1.5898734575939983
Energy: 1.5066593035086282
Energy: 1.562297956326996
Energy: 1.545200843271067
Energy: 1.641181138164338
Energy: 1.5281916547847252
Energy: 1.5226576362844115
Energy: 1.735883832393074
Energy: 1.5212397267876445
Energy: 1.5237493876467907
Energy: 1.5286963832594682
Energy: 1.4176500660802598
Energy: 1.4880785025360557
Energy: 1.5281654661906043
Energy: 1.4182489609449342
Energy: 1.494891467608671
Energy: 1.5220255469754822
Energy: 1.5276397488319482
Energy: 1.5280903069419134
Energy: 1.520779942234566
Energy: 1.525306678896263
Energy: 1.526132892353933
Energy: 1.4346280648955345
Energy: 1.5219351152756417
Energy: 1.5192897650937693
Energy: 1.4363834271376528
Energy: 1.5294107151473373
Energy: 1.4941989533162487
Energy: 1.5676579228081542
Energy: 1.5277694027184217
Energy: 1.5285669147779282
Energy: 1.5612964837506391
Energy: 1.617303907997234
Energy: 1.5270130540431421
Energy: 1.511242364571229
Energy: 1.530571825848683
Energy: 1.5333989866210935
Energy: 1.5264709640806646
Energy: 1.521680055037686
Energy: 1.5028871302343263
Energy: 1.5207016898630614
Energy: 1.4957648924095477
Energy: 1.5222529522188004
Energy: 1.5269494492277247
Energy: 1.5377707906423983
Energy: 1.519698750942504
Energy: 1.4182045900242533
Energy: 1.501536706344454
Energy: 1.4909405676436407
Energy: 1.417137438492712
Energy: 1.528801093527202
Energy: 1.4948541435522256
Energy: 1.4165097585879518
Energy: 1.5073270358624133
Energy: 1.5057400492202286
Energy: 1.4175520355103577
Energy: 1.4920114132273448
Energy: 1.5063676654943314
Energy: 1.5211804862979192
Energy: 1.3944364159789995
Energy: 1.3995604839749296
Energy: 1.521320639278037
Energy: 1.3944264228072571
Energy: 1.3971647683847568
Energy: 1.5991577457868202
Energy: 1.5082859324677782
Energy: 1.5106181798858218
Energy: 1.6009347434606194
Energy: 1.5124045984915988
Energy: 1.5087387162937766
Energy: 1.4896995134361666
Energy: 1.4997661824584512
Energy: 1.5084568054245182
Energy: 1.4486912384059705
Energy: 1.52455975620885
Energy: 1.5022914035884791
Energy: 1.5744778602643317
Energy: 1.5068110694183943
Energy: 1.508056635612445
Energy: 1.475625820876788
Energy: 1.5115056032585568
Energy: 1.4973659445434118
Energy: 1.5034399682320245
Energy: 1.3955013848730558
Energy: 1.4890436063788892
Energy: 1.502993482308946
Energy: 1.3928546718005934
Energy: 1.489422128133582
Energy: 1.5431137030949476
Energy: 1.4881717650922015
Energy: 1.4887309379565095
Energy: 1.5390429466949718
Energy: 1.3936518851301967
Energy: 1.4874237948767268
Energy: 1.4610464909578498
Energy: 1.4861710710035543
Energy: 1.528757125671885
Energy: 1.3919645776947174
Energy: 1.4856703160377938
Energy: 1.5110128251150214
Energy: 1.539169782475252
Energy: 1.4960243102995745
Energy: 1.495518505722928
Energy: 1.4804099663577461
Energy: 1.5449850852664915
Energy: 1.4868337214954939
Energy: 1.5308055876349358
Energy: 1.4608105491925478
Energy: 1.5274519046115587
Energy: 1.5324405662872207
Energy: 1.466081729656457
Energy: 1.5071070945006895
Energy: 1.5151944916106372
Energy: 1.5447163137551425
Energy: 1.5276093683798577
Energy: 1.517131312944239
Energy: 1.3899668763964212
Energy: 1.5072170514620329
Energy: 1.3976813150697938
Energy: 1.49541829833166
Energy: 1.4933775099774769
Energy: 1.398008975681157
Energy: 1.503369849301781
Energy: 1.4913329765680643
Energy: 1.4406649885808454
Energy: 1.5130831056265774
Energy: 1.5074171882096876
Energy: 1.4397023809274054
Energy: 1.5442009434078388
Energy: 1.4982917183488833
Energy: 1.497464046715497
Energy: 1.5079783311924004
Energy: 1.528928483774814
Energy: 1.49743046287263
Energy: 1.5022058741498594
Energy: 1.4884952863976002
Energy: 1.5196741192576204
Energy: 1.4900477023173806
Energy: 1.4832144775890774
Energy: 1.5200452850402941
Energy: 1.3841035117123544
Energy: 1.4908917852293275
Energy: 1.4953016955562164
Energy: 1.5050543570252681
Energy: 1.5106026280341678
Energy: 1.458963570705625
Energy: 1.5033075711814934
Energy: 1.5116872034095876
Energy: 1.4497075218659488
Energy: 1.520837311784317
Energy: 1.5285146030312542
Energy: 1.4142703338054425
Energy: 1.5198856213293281
Energy: 1.5179364927842776
Energy: 1.5117737777175135
Energy: 1.5047017045516173
Energy: 1.4985127625370733
Energy: 1.5117338456313565
Energy: 1.418969777431521
Energy: 1.497090211363575
Energy: 1.527532038110939
Energy: 1.5047462429826275
Energy: 1.511208471001981
Energy: 1.5281335530322655
Energy: 1.4176480306005714
Energy: 1.5126313442378092
Energy: 1.514103130991752
Energy: 1.557368968709129
Energy: 1.558450134044218
Energy: 1.382330420275279
Energy: 1.528725755045043
Energy: 1.4799125551655639

minimum gb energy = 1.382330420275279 eV
minimum distance =  2.2822174358758 Angstroms
sigma value = 101


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

Energy: 1.9909178370915155
Energy: 1.5199394853491959
Energy: 1.4937568934952323
Energy: 1.8682680329690164
Energy: 1.516581519972234
Energy: 1.870657958472441
Energy: 1.5333016352562563
Energy: 1.4892303267507228
Energy: 1.4733705707257754
Energy: 1.5932367192197132
Energy: 1.4928576368979778
Energy: 1.472987003416889
Energy: 1.5201633810006456
Energy: 1.3510167387306193
Energy: 1.3479074760553456
Energy: 1.5205241237341287
Energy: 1.3504048818768721
Energy: 1.3472289464750882
Energy: 1.4916305740767053
Energy: 1.4749466633309676
Energy: 1.4706045428941077
Energy: 1.4927070725255112
Energy: 1.4709827693061264
Energy: 1.469666625441101
Energy: 1.3677762401939684
Energy: 1.501700603288829
Energy: 1.4683657627850786
Energy: 1.3709481975664632
Energy: 1.5220713145161808
Energy: 1.3674471466363245
Energy: 1.47234323675659
Energy: 1.4706221852550774
Energy: 1.4722162533860477
Energy: 1.4740759363590823
Energy: 1.5166611771347396
Energy: 1.4712784101151943
Energy: 1.4601074452058593
Energy: 1.4014997711754298
Energy: 1.4031611706962444
Energy: 1.4617760310964898
Energy: 1.3987180927445568
Energy: 1.4122104427285727
Energy: 1.5237327897969384
Energy: 1.4717290595955448
Energy: 1.474065386596521
Energy: 1.4942293522115653
Energy: 1.4669572379028106
Energy: 1.473050224049479
Energy: 1.3498107615075026
Energy: 1.4534067238436794
Energy: 1.348957231273442
Energy: 1.3499247799532113
Energy: 1.5188937424256659
Energy: 1.3491030982545051
Energy: 1.346376236226725
Energy: 1.474070026346892
Energy: 1.4707103640630892
Energy: 1.3470783044437764
Energy: 1.5167981353806392
Energy: 1.4705428796253455
Energy: 1.4997164350800312
Energy: 1.318781321001998
Energy: 1.3182335152331273
Energy: 1.4997712184594896
Energy: 1.3176052915022984
Energy: 1.318298526170025
Energy: 1.4994124793814891
Energy: 1.4700198087691614
Energy: 1.4719235256362748
Energy: 1.4991195531841914
Energy: 1.4765221703293228
Energy: 1.4699113989434163
Energy: 1.4008195085180675
Energy: 1.4794535151771857
Energy: 1.4342365666565302
Energy: 1.3458197925355986
Energy: 1.5201907390782397
Energy: 1.4072520043933645
Energy: 1.4001165926317343
Energy: 1.478796967423134
Energy: 1.4768570157003083
Energy: 1.4528854669987963
Energy: 1.5054764643707912
Energy: 1.471818104809118
Energy: 1.518385417345334
Energy: 1.3479381334963731
Energy: 1.3475479550164238
Energy: 1.5203722199840353
Energy: 1.3518272713409496
Energy: 1.3495214819993817
Energy: 1.5894612521824285
Energy: 1.4534562187227316
Energy: 1.4718353109722064
Energy: 1.5348043451373727
Energy: 1.349666476886668
Energy: 1.4704002000550063
Energy: 1.9910442395419503
Energy: 1.427424671731173
Energy: 1.4718409025967163
Energy: 1.3164527799603842
Energy: 1.4273990497164766
Energy: 1.3176744667035325
Energy: 1.5345670019596584
Energy: 1.503415078627884
Energy: 1.4893031012292959
Energy: 1.5366020269669916
Energy: 1.5038776759932224
Energy: 1.4678951706525338
Energy: 1.518505335631214
Energy: 1.4020592563331515
Energy: 1.4751483990014302
Energy: 1.518687659562315
Energy: 1.347504492217473
Energy: 1.4737103169514065
Energy: 1.5026305852564565
Energy: 1.4713937230345753
Energy: 1.4734273783508949
Energy: 1.503980986042877
Energy: 1.349355951456037
Energy: 1.4720727530601916
Energy: 1.3722612403035512
Energy: 1.4984314896199378
Energy: 1.406243059541749
Energy: 1.3698133251882594
Energy: 1.501627567519881
Energy: 1.3679264905742383
Energy: 1.446112531166912
Energy: 1.4748173044918
Energy: 1.4723432607975824
Energy: 1.4482407322871567
Energy: 1.5356881308601682
Energy: 1.4720273491894276
Energy: 1.4160162279022896
Energy: 1.402811736171028
Energy: 1.4471772942266297
Energy: 1.4161001043262462
Energy: 1.3986095173409365
Energy: 1.401950089880721
Energy: 1.4529808569334823
Energy: 1.4674014398899973
Energy: 1.4709129816168678
Energy: 1.4523776837505316
Energy: 1.4088458956358463
Energy: 1.4713003660212465
Energy: 1.3636278405492726
Energy: 1.4756554490590084
Energy: 1.472704183880443
Energy: 1.3641971267599975
Energy: 1.4998185003179871
Energy: 1.4463822723109279
Energy: 1.3491565597830908
Energy: 1.4772723416720503
Energy: 1.4705482383526396
Energy: 1.3509929496473545
Energy: 1.5163561534662962
Energy: 1.4711645653849044
Energy: 1.5145881593793282
Energy: 1.319375538536823
Energy: 1.4733460896406692
Energy: 1.499342355413982
Energy: 1.318326218967767
Energy: 1.4688274105283057
Energy: 1.5158889833319389
Energy: 1.4603961813816526
Energy: 1.473051318138011
Energy: 1.5172608523903868
Energy: 1.318803365590149
Energy: 1.4776771469171774
Energy: 1.4006804590879087
Energy: 1.492404922777693
Energy: 1.4761458797142202
Energy: 1.3437094995436494
Energy: 1.5188170394106042
Energy: 1.475734053550119
Energy: 1.4014441877763317
Energy: 1.4869292298641605
Energy: 1.4058096938023765
Energy: 1.3437524806616994
Energy: 1.4993874092892585
Energy: 1.4493636140699413
Energy: 1.5161840884031095
Energy: 1.349716027583232
Energy: 1.4535212722873152
Energy: 1.5174211785687182
Energy: 1.3476655681584495
Energy: 1.4550794084780743
Energy: 1.5182995587743022
Energy: 1.401705574798259
Energy: 1.449823340512874
Energy: 1.51910265845498
Energy: 1.399152541903509
Energy: 1.406604293513493
Energy: 1.4264130489593285
Energy: 1.3496226576258077
Energy: 1.4100647978432936
Energy: 1.3159259582490328
Energy: 1.4277076949956156
Energy: 1.4101454457509888

minimum gb energy = 1.3159259582490328 eV
minimum distance =  2.28557654790725 Angstroms
sigma value = 33


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

Energy: 0.02046603102360445
Energy: 0.02165604438630758
Energy: 0.02125750457973417
Energy: 0.023114937000306767
Energy: 1.1174056988156897
Energy: 0.021085598228792052
Energy: 0.021639824452090017
Energy: 0.17753377992985242
Energy: 0.17488462472883023
Energy: 0.17527489142189961
Energy: 0.17507087457549025
Energy: 0.17455627876559263
Energy: 1.701633903040294
Energy: 1.1183088194670336
Energy: 1.1158278910747161
Energy: 1.112577496391893
Energy: 1.1166319340989008
Energy: 1.115804557529496
Energy: 0.759424779512675
Energy: 0.17753377992896954
Energy: 0.1748846247283628
Energy: 0.17527489142236705
Energy: 0.17507087457549025
Energy: 0.17455627876606003

minimum gb energy = 0.02046603102360445 eV
minimum distance =  2.45865481206087 Angstroms
sigma value = 1