Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_486450342170_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315641880036
cohesive_energy=3.5402784385503736
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.91030724425088e-19, 2.5288755991056e-19, 2.99259358228422e-19, 3.36904100420886e-19, 3.6864161736379197e-19, 3.9597955726973396e-19, 4.19835967349994e-19, 4.4082287907876e-19, 4.593760845004799e-19, 4.758192232952219e-19, 4.90397428487988e-19, 5.033077678047599e-19, 5.1471045890893795e-19, 5.24735278107876e-19, 5.33491173412686e-19, 5.410710710681399e-19, 5.475550799059379e-19, 5.53012093521342e-19, 5.57504596803078e-19, 5.610854615800679e-19, 5.638011509746979e-19, 5.65694923756086e-19, 5.66806834340082e-19, 5.67170528436e-19, 5.6677799516067e-19, 5.655042647366399e-19, 5.63182710793974e-19, 5.59617867783324e-19, 5.54571011386224e-19, 5.47753749808554e-19, 5.388184107207359e-19, 5.273404173147599e-19, 5.12797460007942e-19, 4.945454637934139e-19, 4.717801360009079e-19, 4.4349851405754e-19, 4.0842846971591395e-19, 3.6495180457568995e-19, 3.1097928030613195e-19, 2.43793605335976e-19, 1.5981119118795419e-19, 5.42423308147236e-20, -7.94106031229028e-20, -2.50130213923446e-19, -4.70544857816094e-19, -7.588629518109299e-19, -1.1419770307096438e-18, -1.6608483423370797e-18, -2.38014554217138e-18, -3.40648387214544e-18, -4.925090972915999e-18, -7.279890080737499e-18, -1.1166866725419539e-17, -1.81677217235796e-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: 0.013667490379002665
Energy: 0.014170405208942064
Energy: 0.6977503455302599
Energy: 0.10380357833122933
Energy: 0.014170405208942064
Energy: 0.7108851999098115
Energy: 0.10380357833122933
Energy: 0.7108851999098115
Energy: 0.6977503455198315
Energy: 0.10380357833122933
Energy: 0.013667490379002665
Energy: 0.014170405208942064
Energy: 0.10380357833182226
Energy: 0.7108851999098115
Energy: 0.014170405208942064
Energy: 0.7108851999085558

minimum gb energy = 0.013667490379002665 eV
minimum distance =  2.48460741719362 Angstroms
sigma value = 1


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

Energy: 1.264138723645695
Energy: 0.8151521649838817
Energy: 0.9109376885571399
Energy: 0.9095427366553973
Energy: 0.935445227866646
Energy: 0.8966673871310689
Energy: 0.8784042147137354
Energy: 0.8966673871310689
Energy: 0.9095743352912196
Energy: 0.9096325804770652
Energy: 1.3760347946016986
Energy: 0.9096325804770652
Energy: 0.8737835992271138
Energy: 1.0427597268597069
Energy: 0.8779840755056822
Energy: 1.0427597268589457
Energy: 1.173519695672638
Energy: 0.8566252736011057
Energy: 0.8242625981655647
Energy: 0.8566252736003444
Energy: 0.9187068769379985
Energy: 1.1785311916974504
Energy: 0.8459860751486521
Energy: 1.178531191696689
Energy: 0.8863015434578121
Energy: 0.9465652415922484
Energy: 1.1744282527448238
Energy: 0.9465652415914871
Energy: 0.879783494094509
Energy: 1.2027905009721145
Energy: 0.8964721107993239
Energy: 1.202790500972841
Energy: 1.007651863105096
Energy: 0.9905382260226054
Energy: 1.0111381489892912
Energy: 0.9905382260218439
Energy: 0.8942231701238206
Energy: 1.241043282251977
Energy: 0.8799100428309994
Energy: 1.241043282251977
Energy: 1.0830237390478978
Energy: 0.9906902381513336
Energy: 1.0096576579795116
Energy: 0.9906902381505723
Energy: 0.8768311738373181
Energy: 1.0790995209229968
Energy: 0.899580489374972
Energy: 1.0790995209237582
Energy: 0.8827239546400616
Energy: 0.9467527115331347
Energy: 1.2668921518661824
Energy: 0.9467527115323734
Energy: 0.9186155141728904
Energy: 1.179117413701552
Energy: 0.8826376046407332
Energy: 1.1791174137007907
Energy: 1.2654372086244854
Energy: 0.8562218722233648
Energy: 0.8210787934565674
Energy: 0.8562218722226035
Energy: 0.855428752826463
Energy: 1.042205798079893
Energy: 0.8777879005344777
Energy: 1.042205798079893
Energy: 0.9100729499869651
Energy: 0.9065499475074686
Energy: 1.485774470577542
Energy: 0.9065499475074686
Energy: 0.8779408477942683
Energy: 0.8749939757365418
Energy: 0.9356795363633809
Energy: 0.8749939757388259
Energy: 1.3769031073694864
Energy: 0.9075323865155548
Energy: 0.9090279355751042
Energy: 0.9075323865155548
Energy: 0.9182007103234004
Energy: 1.0427125253868212
Energy: 0.8732724354833494
Energy: 1.0427125253868212
Energy: 0.8212331182621276
Energy: 0.8565714671169816
Energy: 1.1743092119405896
Energy: 0.8565714671162203
Energy: 0.8699095609173996
Energy: 1.2772309858075888
Energy: 0.9184291457124748
Energy: 1.2772309858075888
Energy: 1.1738170857593448
Energy: 0.9500984773759251
Energy: 0.882571874902762
Energy: 0.9500984773766865
Energy: 0.8968355191705174
Energy: 1.2027946381673653
Energy: 0.8777393103466499
Energy: 1.202794638166604
Energy: 1.0090531665043112
Energy: 0.9921425048979556
Energy: 1.0085053872795002
Energy: 0.9921425048971942
Energy: 0.8815776938496467
Energy: 0.991645004990383
Energy: 0.8962180493195249
Energy: 0.9916450049911444
Energy: 1.0083365441430459
Energy: 0.9925147411312943
Energy: 1.0863588163769966
Energy: 0.9925147411312943
Energy: 0.8972333570878575
Energy: 1.0211260765449908
Energy: 0.8876437310343744
Energy: 1.0211260765449908
Energy: 1.270712659014338
Energy: 0.9469095765205406
Energy: 0.8821794395378771
Energy: 0.9469095765205406
Energy: 0.8827736299640029
Energy: 1.004833362654048
Energy: 0.9184084347775261
Energy: 1.0048333626532866
Energy: 0.8206708085958289
Energy: 0.8554970550803613
Energy: 1.2691248100493515
Energy: 0.8554970550795999
Energy: 0.8781144857602938
Energy: 1.0421465620968098
Energy: 0.8552766435086744
Energy: 1.0421465620968098
Energy: 1.4886079326413424
Energy: 0.8717708488449006
Energy: 0.910077242937057
Energy: 0.8717708488456619

minimum gb energy = 0.8151521649838817 eV
minimum distance =  2.28660382709086 Angstroms
sigma value = 1


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

Energy: 1.4330390062039715
Energy: 0.85081955229681
Energy: 0.9577758237679084
Energy: 0.9587091346236063
Energy: 0.9884519925432851
Energy: 0.9394631358422862
Energy: 0.9224807031614024
Energy: 0.9394631358422862
Energy: 0.9597279109983775
Energy: 0.9594954187203918
Energy: 1.3148619718458578
Energy: 0.9594954187186555
Energy: 0.9202648406552304
Energy: 1.0654256735305312
Energy: 0.9230223349585407
Energy: 1.0654256735305312
Energy: 1.3146696433540648
Energy: 0.8996386929515712
Energy: 0.8608847635660148
Energy: 0.8996386929498349
Energy: 0.9702677472120866
Energy: 1.2876385239330912
Energy: 0.8889488593389779
Energy: 1.2876385239330912
Energy: 0.9401348652904424
Energy: 1.004070277523797
Energy: 1.100680482627665
Energy: 1.004070277523797
Energy: 0.9223243386277514
Energy: 1.21899687712819
Energy: 0.9460665488027947
Energy: 1.218996877129926
Energy: 1.1005933213209003
Energy: 1.0476837823841563
Energy: 1.0076450707358044
Energy: 1.0476837823849847
Energy: 0.9470112412839816
Energy: 1.0684043230373792
Energy: 0.9227606754067404
Energy: 1.068404324668686
Energy: 1.196655741026436
Energy: 1.003710709642496
Energy: 0.9414501664436824
Energy: 1.0037107096398918
Energy: 0.9317640541303869
Energy: 1.177924572788227
Energy: 0.9697772248408627
Energy: 1.1779245727396126
Energy: 0.8617806697066214
Energy: 0.9007510792348437
Energy: 1.1961373453000526
Energy: 0.9007510792357117
Energy: 0.922545874796743
Energy: 1.0654030968275676
Energy: 0.8973922619197968
Energy: 1.0654030968128492
Energy: 1.4347431212674624
Energy: 0.9592372490588904
Energy: 0.9584378654251661
Energy: 0.9592372490580222
Energy: 0.9884930809439916
Energy: 0.9188142186686689
Energy: 0.9225827912793426
Energy: 0.9188142186678008
Energy: 0.9577107288269161
Energy: 0.9589477048081904
Energy: 1.3156090959637485
Energy: 0.9589477048081904
Energy: 0.9177555922572476
Energy: 1.0653633856814981
Energy: 0.9692711435390329
Energy: 1.0653633856615317
Energy: 1.3152191959197566
Energy: 0.8998080917237977
Energy: 0.8615580159207437
Energy: 0.8998080917237977
Energy: 0.9702616669383747
Energy: 1.2880263051312408
Energy: 0.8895637994762503
Energy: 1.2880263051312408
Energy: 0.941549210906493
Energy: 1.0040901654410286
Energy: 1.1006585211685644
Energy: 1.0040901654392924
Energy: 0.9223414307239605
Energy: 1.1379869937050962
Energy: 0.9468011085143868
Energy: 1.1379869937068323
Energy: 1.101433816036064
Energy: 1.0481772353860133
Energy: 1.0120419132979555
Energy: 1.0481772353860133
Energy: 0.9472871682702083
Energy: 1.0434379244257599
Energy: 0.9357693011773611
Energy: 1.0434379244274963
Energy: 1.194889434670579
Energy: 1.0029896833535605
Energy: 0.9398711479504205
Energy: 1.0029896833526921
Energy: 0.9319858833846616
Energy: 1.057470010025514
Energy: 0.969172839834668
Energy: 1.057470010026382
Energy: 0.8612732396976891
Energy: 0.8615198168719108
Energy: 1.1992215610209662
Energy: 0.8615198168719108
Energy: 0.9225918478844684
Energy: 0.8621410594989617
Energy: 0.8976076910308417
Energy: 0.8621410594998297
Energy: 1.4388673154840055
Energy: 0.9190279172488284
Energy: 0.9576138630513387
Energy: 0.9190279172488284

minimum gb energy = 0.85081955229681 eV
minimum distance =  2.29017555353377 Angstroms
sigma value = 25


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

Energy: 1.3583458313108498
Energy: 0.8884515524677838
Energy: 1.0126430700738855
Energy: 1.0124475433873512
Energy: 1.048330004622236
Energy: 0.9844875756127845
Energy: 0.9724119072774329
Energy: 0.9844875756117755
Energy: 1.0121806692759303
Energy: 1.0128008536325364
Energy: 1.2302854613913154
Energy: 1.0128008536325364
Energy: 0.96579088505544
Energy: 1.0867758952272653
Energy: 0.9727940730528845
Energy: 1.0867758952272653
Energy: 1.2322824521658908
Energy: 0.9049370092244352
Energy: 0.9048363917961371
Energy: 0.9049370092173712
Energy: 1.0271970343005628
Energy: 1.30280994194217
Energy: 0.9361391220463399
Energy: 1.30280994194217
Energy: 1.0156455722106554
Energy: 1.070594393081833
Energy: 1.0146936148856478
Energy: 1.070594393081833
Energy: 0.9724342404439382
Energy: 1.3360271429255026
Energy: 1.0034900351828873
Energy: 1.3360271429265118
Energy: 1.0154720786341367
Energy: 1.0688603101065792
Energy: 1.1072147443596765
Energy: 1.06886031010557
Energy: 1.0274657320675968
Energy: 1.1687171886161223
Energy: 0.9903474530307088
Energy: 1.1687171886161223
Energy: 1.3627861724766401
Energy: 0.9469710690202687
Energy: 0.903614983390612
Energy: 0.9469710690212779
Energy: 0.9444743735428255
Energy: 1.0869208327247848
Energy: 0.9724085786326789
Energy: 1.086920832725794
Energy: 1.0119229510924452
Energy: 1.0122097559533376
Energy: 1.360525611472408
Energy: 1.0122097559543466
Energy: 0.9726200595944936
Energy: 0.9661107750900784
Energy: 1.04724659836928
Energy: 0.9661107750900784
Energy: 1.2310661889904422
Energy: 1.0124809329682283
Energy: 1.0137008271920969
Energy: 1.0124809329682283
Energy: 1.0727445966842015
Energy: 0.9853900667867607
Energy: 0.9656206485068785
Energy: 0.9853900667867607
Energy: 0.9050633460677298
Energy: 0.904921355461603
Energy: 1.2327626324844472
Energy: 0.9049213554605938
Energy: 0.9359157208940074
Energy: 1.3032817090902413
Energy: 1.0275972761639687
Energy: 1.3032817090892321
Energy: 1.014771126370635
Energy: 1.1121456263274114
Energy: 1.0165255532703092
Energy: 1.1121456263274114
Energy: 1.0045608263524508
Energy: 1.0709574961316652
Energy: 0.9739736942674301
Energy: 1.0709574961316652
Energy: 1.1027856009637065
Energy: 1.06791822328983
Energy: 1.0146293926894905
Energy: 1.06791822328983
Energy: 0.9874836813459953
Energy: 1.0831631289897312
Energy: 1.0265796233342845
Energy: 1.0831631289897312
Energy: 0.9049780236536545
Energy: 0.9477015405718345
Energy: 1.3613451716768006
Energy: 0.9477015405708253
Energy: 0.9725445723824524
Energy: 0.9490453823008597
Energy: 0.9440362023800113
Energy: 0.9490453823008597
Energy: 1.3587814219547434
Energy: 0.9649855261093107
Energy: 1.0124650209257953
Energy: 0.9649855261093107

minimum gb energy = 0.8884515524677838 eV
minimum distance =  2.29346248742932 Angstroms
sigma value = 9


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

Energy: 1.247417043019271
Energy: 0.9221144907704526
Energy: 1.070086149893907
Energy: 1.0695976429898069
Energy: 1.111602082156146
Energy: 1.0253973912779601
Energy: 1.024732010946807
Energy: 1.0253973912779601
Energy: 1.0700913494816477
Energy: 1.0695909560385772
Energy: 1.468787549287278
Energy: 1.0695909560397812
Energy: 1.0122759584668037
Energy: 1.105072304226473
Energy: 1.0248487118883558
Energy: 1.1050723042252693
Energy: 1.1187136434471816
Energy: 0.9525374238921172
Energy: 0.9532002916451677
Energy: 0.9525374238957013
Energy: 1.0921628890631379
Energy: 1.2943863196402015
Energy: 0.9844782539934984
Energy: 1.2943863196402015
Energy: 0.990213332602057
Energy: 1.1750705836157853
Energy: 1.121081660758146
Energy: 1.1750705836169892
Energy: 1.0527269930225345
Energy: 1.291122427670151
Energy: 1.091481781008521
Energy: 1.2911224276689468
Energy: 0.9516775560148605
Energy: 0.9532175780218985
Energy: 1.2509674412429308
Energy: 0.9532175780231025
Energy: 1.024532524150919
Energy: 1.1046389548257325
Energy: 0.9904532758689596
Energy: 1.104638954826936
Energy: 1.2502456870947838
Energy: 1.0695165710428485
Energy: 1.0766233643812106
Energy: 1.0695165710428485
Energy: 1.1112646079427637
Energy: 1.0126191183076068
Energy: 1.0247967766117438
Energy: 1.0126191183076068
Energy: 1.07072184323344
Energy: 1.0697697630435503
Energy: 1.469946187543308
Energy: 1.0697697630435503
Energy: 1.0126789363718482
Energy: 1.0248716218659335
Energy: 1.1487370168146376
Energy: 1.0248716218647298
Energy: 1.1188407669616254
Energy: 0.9534339844596632
Energy: 0.9526674456152912
Energy: 0.9534339844632748
Energy: 1.0916405174165351
Energy: 0.9980943286636502
Energy: 0.952058099586492
Energy: 0.9980943286636502
Energy: 0.9900958690691181
Energy: 1.1763835266623492
Energy: 1.1205071619118683
Energy: 1.1763835266623492
Energy: 0.9901490593243394
Energy: 1.1404278015409273
Energy: 1.091147465367257
Energy: 1.1404278015409273
Energy: 0.9509931457821428
Energy: 0.9529157166268236
Energy: 1.2514985895934212
Energy: 0.9529157166268236
Energy: 1.024660025793294
Energy: 0.9997736386415358
Energy: 0.990237246911751
Energy: 0.9997736386427396
Energy: 1.2475548211063914
Energy: 1.012186011846116
Energy: 1.0700276568081177
Energy: 1.012186011844912

minimum gb energy = 0.9221144907704526 eV
minimum distance =  2.29592770925241 Angstroms
sigma value = 25


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

Energy: 1.0871566396350383
Energy: 0.9435695511882083
Energy: 1.1382034569778885
Energy: 1.1280999896363104
Energy: 1.1839386616248775
Energy: 1.0167734881278763
Energy: 1.073601742861604
Energy: 1.0167734881278763
Energy: 1.1282559234104879
Energy: 1.1283650763445425
Energy: 1.3364878117291397
Energy: 1.1283650763460316
Energy: 1.0609673466129395
Energy: 1.0177259253087703
Energy: 1.073641422228009
Energy: 1.0177259253087703
Energy: 1.0092134824084869
Energy: 1.1324653146630923
Energy: 1.01366106488445
Energy: 1.1324653146616037
Energy: 1.1884345974927797
Energy: 1.0534358618208606
Energy: 0.9621759252672987
Energy: 1.0534358618208606
Energy: 1.0896592567858339
Energy: 1.1060123140195735
Energy: 1.0114575563764052
Energy: 1.1060123140195735
Energy: 1.0749372848191874
Energy: 1.091620819601856
Energy: 1.0735936208482273
Energy: 1.091620819601856
Energy: 1.1376499909585778
Energy: 1.1792917332992678
Energy: 1.5932800061535155
Energy: 1.1792917332992678
Energy: 1.0735827475655948
Energy: 1.0178859795476982
Energy: 1.1841760101729322
Energy: 1.0178859795462094
Energy: 1.3376568471726706
Energy: 1.128341596385768
Energy: 1.1299248661787291
Energy: 1.128341596385768
Energy: 1.1876044260530503
Energy: 1.0180285745234265
Energy: 1.129810645117758
Energy: 1.0180285745234265
Energy: 1.0801377623337465
Energy: 1.106949592834597
Energy: 1.0096687625056695
Energy: 1.1069495965743066
Energy: 1.0134683718877333
Energy: 1.1059335061248623
Energy: 1.1898492951051902
Energy: 1.1059335061248623
Energy: 1.010328843324947
Energy: 1.0910426652774132
Energy: 1.1516488466704144
Energy: 1.0910426652759244
Energy: 1.0736242092437602
Energy: 1.0917930497303678
Energy: 1.090845108580012
Energy: 1.0917930497303678
Energy: 1.1851268144041565
Energy: 1.1796371671464414
Energy: 1.137985681073745
Energy: 1.1796371671464414

minimum gb energy = 0.9435695511882083 eV
minimum distance =  2.29547429707663 Angstroms
sigma value = 17


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

Energy: 1.5222190685218977
Energy: 1.176935861451069
Energy: 1.2775093927562033
Energy: 1.2797013115957359
Energy: 1.0378691219891327
Energy: 1.0166744667587813
Energy: 1.2153608219885461
Energy: 1.016674447068118
Energy: 1.0579166084430471
Energy: 1.063570746847958
Energy: 1.380193281953689
Energy: 1.063570746847958
Energy: 1.0146832230317802
Energy: 1.083450730997561
Energy: 1.2158640318129932
Energy: 1.083450730998404
Energy: 1.1399730126598966
Energy: 1.248970436530333
Energy: 1.037467799431944
Energy: 1.248970436530333
Energy: 1.216035684264944
Energy: 1.142629204335844
Energy: 1.099591761409928
Energy: 1.142629204335844
Energy: 1.2405142970758052
Energy: 1.0652799228717256
Energy: 1.0650456568858553
Energy: 1.0652799228717256
Energy: 1.2681205033549359
Energy: 1.06470027483393
Energy: 1.0627382488325063
Energy: 1.06470027483393
Energy: 1.2794502124918128
Energy: 1.2789503260511292
Energy: 1.3818657075160297
Energy: 1.2789503260511292
Energy: 1.2052810135482028
Energy: 1.1367324194811907
Energy: 1.2138668035828342
Energy: 1.136732419482877
Energy: 1.138515672940572
Energy: 1.1658961219241823
Energy: 1.0541057591097887
Energy: 1.1658961219241823
Energy: 1.270158578686254
Energy: 1.1341368103461407
Energy: 0.9967146047577086
Energy: 1.1341368103174723
Energy: 1.076141782076136
Energy: 1.1338381609977122
Energy: 0.9957258804252987
Energy: 1.1338381609977122
Energy: 1.2375971599761586
Energy: 1.040842083723374
Energy: 1.0535967444432466
Energy: 1.040842083723374
Energy: 1.2739419908861753
Energy: 1.2672793614896578
Energy: 1.3138573069809754
Energy: 1.267279361490501
Energy: 1.2802509951177417
Energy: 1.2241836845374445
Energy: 1.5508030830510453
Energy: 1.2241836845366014
Energy: 1.4387055268039446
Energy: 1.0648079182421222
Energy: 1.0644139129595667
Energy: 1.0648079182395929
Energy: 1.3685874209070303
Energy: 1.0645164479755198
Energy: 1.0574591290750397
Energy: 1.064516447976363
Energy: 1.2138864158976501
Energy: 1.1218793549342208
Energy: 1.1392919931256014
Energy: 1.1218793549418098
Energy: 1.0370570994525699
Energy: 1.3218008553531704
Energy: 1.1266870590152396
Energy: 1.3218008553531704
Energy: 1.0153504229384156
Energy: 1.0172445541036796
Energy: 1.2689772810068198
Energy: 1.0172445541028363
Energy: 1.0634119131436477
Energy: 1.0708989399118185
Energy: 1.2357827607517808
Energy: 1.0708989399118185
Energy: 1.21537455338777
Energy: 1.1500426264546986
Energy: 1.2315887820693103
Energy: 1.1500426264555417
Energy: 1.3811381461570356
Energy: 1.2792264112985803
Energy: 1.2802814048195255
Energy: 1.2792264112985803
Energy: 0.9970653405719657
Energy: 1.1501588979563688
Energy: 1.174107620395894
Energy: 1.1501588980566315
Energy: 0.995696137974881
Energy: 0.996940826478973
Energy: 1.1403054577038028
Energy: 0.996940826478973
Energy: 1.0330156752764228
Energy: 0.9959386486178078
Energy: 1.2698002897022898
Energy: 0.9959386486186509
Energy: 0.9954117866199383
Energy: 0.996969626452177
Energy: 1.2382917526546677
Energy: 0.9969696264732566
Energy: 1.0556618020177715
Energy: 1.0143176123332616
Energy: 1.1728374761383038
Energy: 1.014317612335791
Energy: 1.5232699789468573
Energy: 1.2801720657401237
Energy: 1.2748945418958695
Energy: 1.2801720657401237

minimum gb energy = 0.9954117866199383 eV
minimum distance =  2.28640163070197 Angstroms
sigma value = 53


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

Energy: 1.3594578481243782
Energy: 0.9167257541306804
Energy: 1.1730033446010815
Energy: 1.1723697748144932
Energy: 1.294571139835355
Energy: 1.1435678420466875
Energy: 1.1189123564631192
Energy: 1.143567842042805
Energy: 1.1681401288552655
Energy: 1.4373522091746171
Energy: 1.126965016868961
Energy: 1.4373522091765585
Energy: 1.0992150336485678
Energy: 1.143944302782028
Energy: 1.1189860072642148
Energy: 1.1439443029896441
Energy: 1.132483946986173
Energy: 0.9729723288873103
Energy: 0.8966145155287105
Energy: 0.9729723288873103
Energy: 1.096574428202654
Energy: 1.4589645627762857
Energy: 0.8968151285546664
Energy: 1.4589645627743442
Energy: 1.3640796879212977
Energy: 1.1952933311985692
Energy: 1.1711226727870052
Energy: 1.1952933311985692
Energy: 1.2908832791216025
Energy: 1.3844540363025242
Energy: 1.2145800686332209
Energy: 1.3844540363044655
Energy: 1.1690236050563574
Energy: 1.4374561905133934
Energy: 1.1287688820977981
Energy: 1.4374561905114522
Energy: 1.0970054675658019
Energy: 1.1447560386604037
Energy: 1.1188191308843782
Energy: 1.1447560386604037
Energy: 1.1315045917607471
Energy: 1.1834367447165675
Energy: 0.8968758428156886
Energy: 1.1834367447165675
Energy: 1.1177851340935587
Energy: 1.1833695622485965
Energy: 0.8992672072526093
Energy: 1.1833695622485965
Energy: 1.2908300029938569
Energy: 1.1435927582684262
Energy: 1.1935737289658128
Energy: 1.1435927582703673

minimum gb energy = 0.8966145155287105 eV
minimum distance =  2.27167233994956 Angstroms
sigma value = 9


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

Energy: 1.3169410482620287
Energy: 1.2859405837849767
Energy: 1.3809288959501407
Energy: 1.3802545698925666
Energy: 1.2270116718666562
Energy: 1.2532795605287241
Energy: 1.4100555319735866
Energy: 1.2532795605287241
Energy: 1.0086349463751032
Energy: 1.011421953168471
Energy: 1.2268038611485244
Energy: 1.0114219531670339
Energy: 1.0119692982082276
Energy: 1.0399483839608523
Energy: 1.4027164687342655
Energy: 1.0399483839608523
Energy: 1.0103773023510432
Energy: 1.0084914267963938
Energy: 1.3759067196397285
Energy: 1.0084914267963938
Energy: 1.1132840807424058
Energy: 1.2523143440229434
Energy: 1.3749943282505641
Energy: 1.2523143440215065
Energy: 1.4948276484876302
Energy: 1.339143619861609
Energy: 1.381625321104025
Energy: 1.3391436198608904
Energy: 1.4942934260784209
Energy: 1.3041374579405132
Energy: 1.347795745846967
Energy: 1.3041374579412317
Energy: 1.096762544939617
Energy: 1.3495845570651381
Energy: 1.0565783045898063
Energy: 1.3495845570658564
Energy: 0.976778677780761
Energy: 1.0578918991396038
Energy: 1.2881901844401915
Energy: 1.0578918798920685
Energy: 1.136930493694038
Energy: 1.1385969413979657
Energy: 1.3577001241238043
Energy: 1.1385969413979657
Energy: 1.164728018142112
Energy: 1.2198405654557316
Energy: 1.3215926955182205
Energy: 1.2198405654557316
Energy: 1.49553730383994
Energy: 1.1328833609152626
Energy: 1.2893942090344168
Energy: 1.1328833609159812
Energy: 1.4800799652507612
Energy: 1.1380456000572088
Energy: 1.1621691133748933
Energy: 1.138045600057927
Energy: 1.2881440092725853
Energy: 1.1515725629464884
Energy: 1.060462834965042
Energy: 1.1515725629472067
Energy: 1.1356798827614039
Energy: 1.3353819067500052
Energy: 1.0939408759619056
Energy: 1.3353819067507238
Energy: 1.2990992794948053
Energy: 1.293523719774399
Energy: 1.1936597977026493
Energy: 1.2935237197794283
Energy: 1.379728481944123
Energy: 1.379492232700183
Energy: 1.3177147932202944
Energy: 1.3794922327016201
Energy: 1.3675842326791305
Energy: 1.3054546564384713
Energy: 1.219844634684977
Energy: 1.305454656437753
Energy: 1.22634879309191
Energy: 1.0111766404671465
Energy: 1.008590424807744
Energy: 1.0111766404657097
Energy: 1.40288845302139
Energy: 1.0088077984576858
Energy: 1.011794090378622
Energy: 1.0088077985029484
Energy: 1.3775845364571588
Energy: 1.0083621394444966
Energy: 1.008282010435364
Energy: 1.0083621394444966
Energy: 1.3761935489994637
Energy: 1.2514272651446092
Energy: 1.0666300492450644
Energy: 1.251427265146046
Energy: 1.3781207061414078
Energy: 1.3182846789247977
Energy: 1.4974848113159003
Energy: 1.318284678924079
Energy: 1.3492232730465528
Energy: 1.3038797664369448
Energy: 1.5009395782249157
Energy: 1.303879766432634
Energy: 1.0585634795009462
Energy: 1.3522546378423728
Energy: 1.106007101147833
Energy: 1.3522546378423728
Energy: 1.2869780869749812
Energy: 1.1229674013781448
Energy: 0.9766853668235195
Energy: 1.1229674013774262
Energy: 1.474062723563446
Energy: 1.1327012801352858
Energy: 1.1377591705992744
Energy: 1.1327012801352858
Energy: 1.3191778222459871
Energy: 1.2299277261824626
Energy: 1.1648818486152315
Energy: 1.2299277261824626
Energy: 1.2683259658343158
Energy: 1.132036613799496
Energy: 1.4119557349792424
Energy: 1.132036613799496
Energy: 1.1623470423726652
Energy: 1.1390144819967871
Energy: 1.229004753424093
Energy: 1.1390144819960688
Energy: 1.1062744509471132
Energy: 1.1250472989375766
Energy: 1.2873062505702324
Energy: 1.1250472989375766
Energy: 1.06199766327424
Energy: 1.171097417686487
Energy: 1.1384119362626641
Energy: 1.1710974176872053
Energy: 1.1878393314405475
Energy: 1.3417767687374431
Energy: 1.2170301589213897
Energy: 1.3417767687374431
Energy: 1.3198233420404346
Energy: 1.3800360119134483
Energy: 1.379438655784013
Energy: 1.3800360119141666

minimum gb energy = 0.9766853668235195 eV
minimum distance =  2.28329841156834 Angstroms
sigma value = 73


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

Energy: 1.3815479451379233
Energy: 1.205506924819479
Energy: 1.2954374905945785
Energy: 1.2951346587089883
Energy: 1.3798015752729802
Energy: 1.33924233435601
Energy: 1.4555088962143563
Energy: 1.33924233435487
Energy: 1.0433931146087891
Energy: 1.2474435539038253
Energy: 1.182037955294547
Energy: 1.2474435539038253
Energy: 1.0736266577444438
Energy: 1.0817144662007814
Energy: 1.4205729827742208
Energy: 1.0817144662019214
Energy: 1.0703531623909885
Energy: 1.0513396788511493
Energy: 1.4234924791139558
Energy: 1.0513396788511493
Energy: 1.1426392764035553
Energy: 1.255216237100286
Energy: 1.4155074580461138
Energy: 1.255216237101426
Energy: 1.6637444954455143
Energy: 1.4798870420736951
Energy: 1.3505080974039738
Energy: 1.4798870420748351
Energy: 1.5996251608115855
Energy: 1.2418310853417043
Energy: 1.3082047237325927
Energy: 1.241831085342844
Energy: 1.1754921456651921
Energy: 1.2977208515444851
Energy: 1.2044054879212065
Energy: 1.2977208515444851
Energy: 1.0462044735970197
Energy: 1.2164422333784006
Energy: 1.284264182123409
Energy: 1.2164422333784006
Energy: 1.187350504687146
Energy: 1.0730831109595218
Energy: 1.284930840178697
Energy: 1.0730831109606618
Energy: 1.1434126005589236
Energy: 1.0748854967971648
Energy: 1.2495979111327304
Energy: 1.0748854967971648
Energy: 1.227369873040713
Energy: 1.1742384461732644
Energy: 1.1653703392650083
Energy: 1.1742384461732644
Energy: 1.181905767285389
Energy: 1.2301222759817527
Energy: 1.1157703640204553
Energy: 1.2301222759828927
Energy: 1.2831563349970458
Energy: 1.2032953909993431
Energy: 1.0756413631754693
Energy: 1.2032953909982034
Energy: 1.389600359404
Energy: 1.3144464547294936
Energy: 1.111590040060413
Energy: 1.3144464547294936
Energy: 1.3703096184509032
Energy: 1.2136328860063288
Energy: 1.1579703161752302
Energy: 1.2136328860063288
Energy: 1.3165615583109977
Energy: 1.353689259899995
Energy: 1.6601470826513776
Energy: 1.353689259898855
Energy: 1.2245813001580694
Energy: 1.2109099092618698
Energy: 1.4744533350322082
Energy: 1.2109099092630098
Energy: 1.128699068151372
Energy: 1.2213799405344634
Energy: 1.163882961991408
Energy: 1.2213799405344634
Energy: 1.1723516146340487
Energy: 1.2137608512255413
Energy: 1.0469080679866964
Energy: 1.2137608512266813
Energy: 1.3827217673882872
Energy: 1.2456996744483755
Energy: 1.279033303829434
Energy: 1.2456996744483755

minimum gb energy = 1.0433931146087891 eV
minimum distance =  2.2756513642643 Angstroms
sigma value = 7


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

Energy: 1.576005454009599
Energy: 1.1985040843120849
Energy: 1.371793582151042
Energy: 1.3375582078366117
Energy: 1.3317060305064246
Energy: 1.1924518998636284
Energy: 1.3921288864642274
Energy: 1.1924518998628226
Energy: 1.026187964160817
Energy: 1.2294327809583574
Energy: 1.0951303863072515
Energy: 1.2294327809559396
Energy: 1.0487868693595368
Energy: 1.0906725004369555
Energy: 1.365262397097311
Energy: 1.0906725004377615
Energy: 1.1103651985854102
Energy: 1.108803241078441
Energy: 1.1949509797583406
Energy: 1.108803241082471
Energy: 1.2800631590507405
Energy: 1.2025194859010186
Energy: 1.1895183728740713
Energy: 1.2025194859002126
Energy: 1.3887865233435948
Energy: 1.3373494778701034
Energy: 1.1614286338834041
Energy: 1.3373494778684916
Energy: 1.3612282138922132
Energy: 1.0979123955853172
Energy: 1.1355515120240804
Energy: 1.0979123955861232
Energy: 1.3505326439285954
Energy: 1.0257938864579947
Energy: 1.0255006782519243
Energy: 1.0257938864596068
Energy: 1.1909641751157074
Energy: 1.230174076730997
Energy: 1.0262534165423063
Energy: 1.2301740767334153
Energy: 1.4686096744764885
Energy: 1.2088364796221913
Energy: 1.2627629823066917
Energy: 1.2088364796229973
Energy: 1.346184478616143
Energy: 1.2791914360620993
Energy: 1.3839797693539362
Energy: 1.2791914360604875
Energy: 1.134625524097544
Energy: 1.121634730372022
Energy: 1.2558371352685593
Energy: 1.1216347303744403
Energy: 1.098403884506561
Energy: 1.0599679777903417
Energy: 1.0016894258440157
Energy: 1.0599679777911477
Energy: 1.2281005735673216
Energy: 1.236277684713967
Energy: 1.000392968141926
Energy: 1.2362776847123547
Energy: 1.5791855899796894
Energy: 1.2782001334014823
Energy: 1.3465512035931884
Energy: 1.2782001334022886
Energy: 1.495400176614784
Energy: 1.1941885867389104
Energy: 1.4731570570435635
Energy: 1.1941885867405226
Energy: 1.026254629751761
Energy: 1.3931122890116268
Energy: 1.0936462005945615
Energy: 1.3931122890116268
Energy: 1.0237003568358933
Energy: 1.0256964952998804
Energy: 1.3509181329670625
Energy: 1.0256964952974623
Energy: 1.1079460610505314
Energy: 1.107983242862319
Energy: 1.4442743606628894
Energy: 1.107983242863125
Energy: 1.1244677350385863
Energy: 1.3371278109777431
Energy: 1.1935850083426822
Energy: 1.337127810979355
Energy: 1.3941950413423743
Energy: 1.0981008264717995
Energy: 1.2819392421044935
Energy: 1.0981008264750234
Energy: 1.3938834030318503
Energy: 1.1089029168492248
Energy: 1.131594685955961
Energy: 1.1089029168484188
Energy: 1.3505070741573062
Energy: 1.090407360142337
Energy: 1.0280749964313247
Energy: 1.090407360140725
Energy: 1.192765821031996
Energy: 1.2289813841593382
Energy: 1.0260605467849826
Energy: 1.2289813841601445
Energy: 1.2616400427938002
Energy: 1.1927368712392448
Energy: 1.3901465688304777
Energy: 1.192736871145819
Energy: 1.368310155734673
Energy: 1.3288112490831403
Energy: 1.3807650143774972
Energy: 1.3288112490807222
Energy: 1.2032393731476627
Energy: 1.1965309450506114
Energy: 1.2550326946410637
Energy: 1.1965309450530293
Energy: 1.0959898059240212
Energy: 1.1870740181230865
Energy: 1.1337888063310533
Energy: 1.1870740181222805
Energy: 1.1875073161924465
Energy: 1.164859979678654
Energy: 1.0014356160641036
Energy: 1.1648599820940535
Energy: 1.5313570386457644
Energy: 1.2097192364210188
Energy: 1.2787645012110007
Energy: 1.2097192364210188

minimum gb energy = 1.000392968141926 eV
minimum distance =  2.24802700926707 Angstroms
sigma value = 29


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

Energy: 0.9049501031943529
Energy: 0.9065328778877686
Energy: 1.173350456641015
Energy: 1.2386805658101485
Energy: 0.9088481047989644
Energy: 1.0165695141384934
Energy: 1.1321660245606415
Energy: 1.016569514136029
Energy: 1.3359821265743441
Energy: 1.2406214688479185
Energy: 1.0910180416887651
Energy: 1.2406214688481993
Energy: 1.0990029180442409
Energy: 0.9247768948369848
Energy: 1.1317946074184644
Energy: 0.9247768948369848
Energy: 1.0999266356441786
Energy: 1.0982704932299776
Energy: 0.908974588179261
Energy: 1.0982704932302585
Energy: 1.1316882119687723
Energy: 1.1781507196140113
Energy: 0.9089135502708144
Energy: 1.1781507196142922
Energy: 0.911743186249338
Energy: 0.9901630497436764
Energy: 1.336818098980693
Energy: 0.9901630497439571
Energy: 1.1315903762277801
Energy: 0.9259722839704391
Energy: 0.9385793334292747
Energy: 0.9259722839704391
Energy: 0.9089351874616797
Energy: 0.9285724419220241
Energy: 1.0946797123406706
Energy: 0.9285724419225545

minimum gb energy = 0.9049501031943529 eV
minimum distance =  2.32209282912546 Angstroms
sigma value = 5


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

Energy: 1.2224649630542628
Energy: 0.9272147508216604
Energy: 1.2493276367230812
Energy: 1.207207313682996
Energy: 1.3012634975589978
Energy: 0.9360175098673003
Energy: 1.1015903645917018
Energy: 0.9360175098688231
Energy: 1.1035998070766693
Energy: 1.0045253077954042
Energy: 1.0887483839466323
Energy: 1.0045253077954042
Energy: 0.9462427880828779
Energy: 0.9338913938725022
Energy: 1.2669089992305518
Energy: 0.9338913938732635
Energy: 1.1223222287048567
Energy: 0.9736192569314908
Energy: 1.402350498277727
Energy: 0.9736192569307295
Energy: 0.976853725949634
Energy: 0.9792761209431017
Energy: 1.3499967306639562
Energy: 0.9792761209431017
Energy: 0.9333321364624365
Energy: 0.93440234391666
Energy: 1.2737468448894214
Energy: 0.9344023439174214
Energy: 0.9809286319956924
Energy: 0.9364640560333031
Energy: 1.22790906386788
Energy: 0.9364640560333031
Energy: 1.274340873531729
Energy: 0.9822055140979304
Energy: 1.2804448092245364
Energy: 0.9822055140964076
Energy: 1.0826624985279614
Energy: 0.9240834184004362
Energy: 1.1429645823070393
Energy: 0.9240834184019591
Energy: 1.2588726819330598
Energy: 0.9233299193631022
Energy: 0.9242395572455444
Energy: 0.9233299193631022
Energy: 1.2437530228409732
Energy: 0.9631682119244575
Energy: 0.9682640181891438
Energy: 0.9631682119236961
Energy: 1.2630374212783433
Energy: 1.1870402094475003
Energy: 1.1086460525811626
Energy: 1.1870402094475003
Energy: 1.2532582320665406
Energy: 1.1852130940232808
Energy: 1.0979550097804547
Energy: 1.1852130940232808
Energy: 0.9395550899939922
Energy: 0.9354831437260179
Energy: 1.1008042516024183
Energy: 0.9354831437260179
Energy: 0.9380869671270342
Energy: 0.934835420966247
Energy: 1.3007709853293166
Energy: 0.9348354209670084
Energy: 1.242823834873686
Energy: 1.2065148568842834
Energy: 1.5999627136503272
Energy: 1.2065148568842834
Energy: 1.1386214007975985
Energy: 0.9369224996285189
Energy: 1.3046911231230467
Energy: 0.9369224996277575
Energy: 1.086888330366619
Energy: 1.006600426890287
Energy: 1.1393607939591555
Energy: 1.006600426889526
Energy: 1.1025806941398402
Energy: 0.9341256669301834
Energy: 0.943744906039393
Energy: 0.9341256669309448
Energy: 1.3502019187374974
Energy: 0.978975982881474
Energy: 1.121864239120486
Energy: 0.9789759828799858
Energy: 1.4253040657114715
Energy: 0.9957895636232236
Energy: 1.1108725619193918
Energy: 0.9957895636224622
Energy: 1.275442234501512
Energy: 0.934602935286265
Energy: 0.9346667011851079
Energy: 0.934602935286265
Energy: 1.2466546871446913
Energy: 0.9354161503378038
Energy: 0.939816711439124
Energy: 0.9354161503378038
Energy: 1.2460397503316198
Energy: 0.981946004640127
Energy: 1.2750966028364024
Energy: 0.981946004640127
Energy: 1.145062293673756
Energy: 0.9250517089482435
Energy: 1.0824975119694695
Energy: 0.9250517089474821
Energy: 0.9253336279095679
Energy: 0.9603074289265517
Energy: 1.2585543301000794
Energy: 0.9603074289265517
Energy: 0.9650127021758003
Energy: 0.9621234318450406
Energy: 1.2165498301024114
Energy: 0.9621234318450406
Energy: 1.10862801233436
Energy: 0.9232467979917307
Energy: 1.2258293015954271
Energy: 0.9232467980092426
Energy: 1.0988677879085889
Energy: 1.1855104758730566
Energy: 1.2186216397049423
Energy: 1.1855104758722954
Energy: 1.097446011911628
Energy: 0.9364831515039728
Energy: 0.936314587694601
Energy: 0.9364831515032114
Energy: 1.261600191908508
Energy: 0.9352880816129383
Energy: 0.9357719829945041
Energy: 0.9352880816159838
Energy: 1.6022989048870178
Energy: 0.9343351178665203
Energy: 1.1005378584874934
Energy: 0.9343351178672817

minimum gb energy = 0.9232467979917307 eV
minimum distance =  2.29033371341391 Angstroms
sigma value = 1


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

Energy: 1.4245421684122639
Energy: 0.9373400592593946
Energy: 0.9435311631314439
Energy: 0.9447702112747964
Energy: 1.257667936352434
Energy: 0.907877699818713
Energy: 1.1254894406938416
Energy: 0.9078776998197657
Energy: 1.1170875042628092
Energy: 1.0005205735333014
Energy: 1.1241704160690702
Energy: 1.0005205735333014
Energy: 1.0051771617365883
Energy: 1.1204742803174477
Energy: 1.1775801314838648
Energy: 1.1204742803174477
Energy: 1.1690522812051565
Energy: 0.9860641908464042
Energy: 1.4666713433708785
Energy: 0.9860641908474569
Energy: 0.9848451009723419
Energy: 0.9392307763486097
Energy: 1.4670758249837588
Energy: 0.9392307763486097
Energy: 0.9099928489184306
Energy: 0.9105795219276354
Energy: 1.3759304999211663
Energy: 0.9105795219276354
Energy: 0.9222274486263754
Energy: 0.9140443387434903
Energy: 1.4304963764156335
Energy: 0.9140443387424375
Energy: 1.1657668693731458
Energy: 0.9771984873307266
Energy: 1.370051305579345
Energy: 0.9771984873317793
Energy: 1.198657036593201
Energy: 1.0854177152677362
Energy: 0.9879473588451093
Energy: 1.0854177152666833
Energy: 1.172260617792679
Energy: 0.8884541031224572
Energy: 0.9872076834336393
Energy: 0.8884541031235099
Energy: 1.3041804633130865
Energy: 0.8822696654837359
Energy: 0.9884558224709957
Energy: 0.8822696654837359
Energy: 1.2993500430887293
Energy: 0.8903826396075235
Energy: 1.0160865134625001
Energy: 0.8903826396064709
Energy: 1.2299632350487497
Energy: 0.877533077508928
Energy: 1.2024146839716507
Energy: 0.8775330775078752
Energy: 1.008810877062523
Energy: 1.0965478600590037
Energy: 1.200405310236306
Energy: 1.0965478600600567
Energy: 1.019247811906331
Energy: 0.911736948140956
Energy: 1.4088892543128684
Energy: 0.911736948140956
Energy: 1.39865652836588
Energy: 0.992555301765386
Energy: 1.6891822802940804
Energy: 0.992555301765386
Energy: 0.9774735049219417
Energy: 0.9133711748231408
Energy: 1.4690288369840947
Energy: 0.9133711748241935
Energy: 0.9371083856253057
Energy: 0.9116792350508639
Energy: 1.3697255980688983
Energy: 0.9116792350519165
Energy: 1.0996747485305398
Energy: 0.9121543176734332
Energy: 1.4299725827595429
Energy: 0.9121543176744861
Energy: 1.2167756136624812
Energy: 0.9787433800220452
Energy: 1.3807513194222778
Energy: 0.9787433800220452
Energy: 1.2360681629075887
Energy: 0.9071960295042057
Energy: 0.9073034404173514
Energy: 0.9071960295031531
Energy: 1.287763991150301
Energy: 0.9063156075346713
Energy: 0.9063379626340493
Energy: 0.9063156075336186
Energy: 1.4279235319984454
Energy: 0.942168634148875
Energy: 0.9443771603462627
Energy: 0.9421686341436112

minimum gb energy = 0.8775330775078752 eV
minimum distance =  2.28850051924244 Angstroms
sigma value = 17


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

Energy: 1.377580447524235
Energy: 0.8840976392424087
Energy: 1.2139733382225621
Energy: 0.9303941041392059
Energy: 1.4444007861083565
Energy: 0.8868931430829933
Energy: 1.0318836415754447
Energy: 0.8868931430829933
Energy: 1.157827000161045
Energy: 0.8851440720063479
Energy: 1.0329842218620056
Energy: 0.8851440720069986
Energy: 1.1312788133739842
Energy: 0.8763513860752166
Energy: 1.1181351647100668
Energy: 0.8763513860745659
Energy: 1.0281306351472106
Energy: 0.8761738709834852
Energy: 1.2727500572343269
Energy: 0.876173870979581
Energy: 0.8982243315465824
Energy: 0.8950703220197656
Energy: 1.4213800877227623
Energy: 0.895070322019115
Energy: 0.8767345878332058
Energy: 0.8756282682112296
Energy: 1.2846486500668146
Energy: 0.875628268210579
Energy: 0.8807400081227078
Energy: 0.8780534204071477
Energy: 1.381039177545032
Energy: 0.8780534204077984
Energy: 1.2496463134805316
Energy: 0.8784458678779625
Energy: 1.2896758000724418
Energy: 0.8784458678779625
Energy: 1.009871238701833
Energy: 0.8890947876067722
Energy: 1.036559260535496
Energy: 0.8890947876074229
Energy: 1.32519992675148
Energy: 0.9393411444982726
Energy: 0.891535657575013
Energy: 0.9393411445008754
Energy: 1.4317143324063724
Energy: 0.9066945861619095
Energy: 1.0675834206109116
Energy: 0.9066945861612588
Energy: 1.5508667858544276
Energy: 0.9258010764088974
Energy: 0.949473636802293
Energy: 0.9258010764108495
Energy: 1.3460887846198757
Energy: 0.8853845969313635
Energy: 0.8871608004996243
Energy: 0.8853845969307128
Energy: 1.1658038561609616
Energy: 0.8877682412469463
Energy: 0.8901151260910417
Energy: 0.887768241245645
Energy: 1.3552268361067945
Energy: 0.9265779326768775
Energy: 1.2919771806776337
Energy: 0.9265779326768775
Energy: 0.8882654471456026
Energy: 0.8901310794772623
Energy: 1.2542118083169846
Energy: 0.8901310794785637
Energy: 0.8886223500414793
Energy: 0.886392910028679
Energy: 1.3223338815781525
Energy: 0.8863929100267269
Energy: 0.8947546550816213
Energy: 0.8879129949493507
Energy: 1.4769357173762296
Energy: 0.8879129949499421
Energy: 0.9603911903126773
Energy: 0.9372286601062508
Energy: 1.3781863785261144
Energy: 0.9372286601088535
Energy: 1.030071075122704
Energy: 0.8869247730620192
Energy: 1.4293573757027669
Energy: 0.8869247730620192
Energy: 1.0285263492313836
Energy: 1.1275294671549407
Energy: 1.1559634896870579
Energy: 1.127529467152989
Energy: 1.1764391832433678
Energy: 0.8756310920898267
Energy: 1.1550877593352722
Energy: 0.875631092089176
Energy: 1.2713963227315384
Energy: 0.8766469001313482
Energy: 1.0289330226974847
Energy: 0.8766469001313482
Energy: 1.4176878994518949
Energy: 0.8795964783668953
Energy: 0.8950045998916131
Energy: 0.8795964783655938
Energy: 1.2870330835720045
Energy: 0.877196593166278
Energy: 0.8791625304496443
Energy: 0.8771965931675794
Energy: 1.3796133850718786
Energy: 0.8786299737333094
Energy: 0.8837557561511333
Energy: 0.8786299737313573
Energy: 1.2856759499848327
Energy: 0.8772024068538159
Energy: 1.2492461375087078
Energy: 0.8772024068589622
Energy: 1.0331239949138422
Energy: 1.1266054720727565
Energy: 1.0120940883316065
Energy: 1.126605472074058
Energy: 0.8928659014939995
Energy: 0.8847449906497075
Energy: 1.3278918471833248
Energy: 0.8847449906614197
Energy: 1.0667384555999677
Energy: 0.9249779165409794
Energy: 1.5086003210940981
Energy: 0.9249779165416301
Energy: 0.9516471321621429
Energy: 0.9255384867497014
Energy: 1.4811666798707568
Energy: 0.9255384867503521
Energy: 0.8851406705331415
Energy: 0.885233216922844
Energy: 1.3217935638016165
Energy: 0.8852332169221933
Energy: 0.893476767980687
Energy: 0.887212144402034
Energy: 1.1318865744433104
Energy: 0.8872121444007326
Energy: 1.2923637805924917
Energy: 0.9254455541025342
Energy: 1.353119671309329
Energy: 0.9254455541018834
Energy: 1.253639341249628
Energy: 0.8892242161134847
Energy: 0.8867809084155074
Energy: 0.8892242161134847
Energy: 1.321264147721873
Energy: 0.8852534544499658
Energy: 0.8858036992649058
Energy: 0.8852534544512672
Energy: 1.4792431589567043
Energy: 0.8888464222322247
Energy: 0.9329719458649561
Energy: 0.8888464222322247

minimum gb energy = 0.875628268210579 eV
minimum distance =  2.29692702623925 Angstroms
sigma value = 89


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

Energy: 1.4478409840687083
Energy: 0.8400279198745635
Energy: 0.8112938016367321
Energy: 0.8097501527077695
Energy: 1.3461456212915561
Energy: 1.1566798730376535
Energy: 1.0801434491561892
Energy: 1.1566798730376535
Energy: 0.8008914795320285
Energy: 0.8928810898925248
Energy: 1.0872600182914525
Energy: 0.8928810898925248
Energy: 0.8016646666350632
Energy: 1.084039458163016
Energy: 1.0893383804859769
Energy: 1.084039458163016
Energy: 0.8657135338938026
Energy: 0.8082247118760196
Energy: 1.120844078971279
Energy: 0.8082247118760196
Energy: 0.8102292402295294
Energy: 0.8118090347034941
Energy: 1.1235881886648764
Energy: 0.8118090347034941
Energy: 0.8060165499798855
Energy: 0.8065264798186695
Energy: 1.0894980637851617
Energy: 0.8065264798169669
Energy: 0.8101915760338402
Energy: 0.8107574412803125
Energy: 1.4507641242338951
Energy: 0.8107574412803125
Energy: 1.0786275130383172
Energy: 1.1583006678832721
Energy: 1.3481002239553825
Energy: 1.1583006678832721
Energy: 1.1338546188608019
Energy: 0.8946322848898182
Energy: 1.08987023163603
Energy: 0.8946322848898182
Energy: 1.0893503061090932
Energy: 0.8965877763682946
Energy: 0.7994203887585469
Energy: 0.8965877763682946
Energy: 1.1244226865444735
Energy: 1.0859195799178334
Energy: 0.8688295996885158
Energy: 1.0859195799178334
Energy: 1.1240017925221912
Energy: 0.8092046531087221
Energy: 0.8098321958622872
Energy: 0.8092046531087221
Energy: 1.3525988228281438
Energy: 0.8064739082116285
Energy: 0.8049735606474494
Energy: 0.8064739082116285
Energy: 1.3458585348596994
Energy: 0.8087837090581048
Energy: 0.8093683450472221
Energy: 0.8087837090598073

minimum gb energy = 0.7994203887585469 eV
minimum distance =  2.31748456970828 Angstroms
sigma value = 13


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

Energy: 1.2816956357724245
Energy: 0.7863875618331356
Energy: 1.1324741788449244
Energy: 0.7764245153639279
Energy: 1.3930688400681144
Energy: 0.775550574700546
Energy: 0.925886677968165
Energy: 0.7755505746991187
Energy: 1.2830594340325387
Energy: 0.7716752281935335
Energy: 0.9202890569692403
Energy: 0.7716752281899656
Energy: 1.0121731852124793
Energy: 0.8335944116885614
Energy: 1.1037672681599286
Energy: 0.8335944116899237
Energy: 1.1828421955568886
Energy: 0.8313876931557371
Energy: 1.1805859714479965
Energy: 0.8313876931571641
Energy: 0.9237858814513226
Energy: 1.0515105305443517
Energy: 1.1746336808363507
Energy: 1.0515105305443517
Energy: 0.9228219570862208
Energy: 0.7739369281671102
Energy: 1.4210590558669893
Energy: 0.7739369281678239
Energy: 0.9352962183084801
Energy: 0.9278616181745977
Energy: 1.4426899002736815
Energy: 0.9278616181731705
Energy: 0.782464603783718
Energy: 0.7751027010136633
Energy: 1.4145257582179758
Energy: 0.775102701012236
Energy: 0.7746988993734877
Energy: 0.7729749305754651
Energy: 1.4135292716983985
Energy: 0.772974930574038
Energy: 0.7724843622594222
Energy: 0.7788105470957482
Energy: 1.2822109580384793
Energy: 0.778810547094321
Energy: 1.1744997097688217
Energy: 1.0858987166055762
Energy: 1.4140348427744363
Energy: 1.0858987166034355
Energy: 1.1776341828792012
Energy: 1.0495857775521906
Energy: 1.1692188918574489
Energy: 1.0495857775543314
Energy: 1.2398385368014735
Energy: 0.7717878518706152
Energy: 1.0133632000492088
Energy: 0.7717878518720422
Energy: 1.3823299966719331
Energy: 0.7744767042256826
Energy: 1.1519381981562817
Energy: 0.7744767042249691
Energy: 1.380516863403587
Energy: 0.7750589976517005
Energy: 0.7823849517235512
Energy: 0.7750589976495597
Energy: 1.3181269197455152
Energy: 0.773493164274815
Energy: 0.7750744962267051
Energy: 0.7734931642733879
Energy: 1.283305717104642
Energy: 0.7972968857540037
Energy: 0.7926245642390791
Energy: 0.7972968857497221
Energy: 1.4346560238627828
Energy: 0.774582791061807
Energy: 0.9431209793499149
Energy: 0.7745827910632341
Energy: 1.360064765239694
Energy: 0.771412286310687
Energy: 0.8940181898943313
Energy: 0.771412286331381
Energy: 1.0102492067810167
Energy: 0.7775634153601275
Energy: 0.9375773453400077
Energy: 0.777563415359414
Energy: 1.2681505272476494
Energy: 1.0993686013712949
Energy: 1.173001084081368
Energy: 1.099368601374863
Energy: 0.9258193203124085
Energy: 1.0509849479780542
Energy: 1.1807022697404193
Energy: 1.050984947976627
Energy: 0.7742133210522422
Energy: 0.7716185514966281
Energy: 1.41700013126588
Energy: 0.7716185514987687
Energy: 0.9280666134426929
Energy: 0.794660875668955
Energy: 1.3828253054568218
Energy: 0.794660875668955
Energy: 0.7886218881905521
Energy: 0.7936510170559853
Energy: 1.379361541578397
Energy: 0.7936510170531309
Energy: 0.7724182615356677
Energy: 0.7725753220176594
Energy: 1.4104604449191511
Energy: 0.7725753220162324
Energy: 0.7722699077653415
Energy: 0.7763076318338815
Energy: 1.2845741365102832
Energy: 0.7763076318338815
Energy: 1.1686673121260176
Energy: 1.0861767653743475
Energy: 1.4347304895859183
Energy: 1.0861767653757743
Energy: 0.8928693552579849
Energy: 1.0497018474706574
Energy: 1.1713405839885132
Energy: 1.0497018474756525
Energy: 1.233123016712695
Energy: 0.8304551719251294
Energy: 1.0113191903559435
Energy: 0.8304551719272701
Energy: 1.3796020814377223
Energy: 0.7749304253686258
Energy: 1.1725161044415824
Energy: 0.7749304253693395
Energy: 1.3824592464754288
Energy: 0.7744120675297154
Energy: 0.772449618488802
Energy: 0.7744120675318561
Energy: 1.4114708491553902
Energy: 0.7718866393021562
Energy: 0.7726286205447074
Energy: 0.7718866393007291
Energy: 1.4762956149103381
Energy: 0.7735362721102774
Energy: 0.8066811845704401
Energy: 0.7735362721109911

minimum gb energy = 0.771412286310687 eV
minimum distance =  2.30666352647062 Angstroms
sigma value = 37


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

Energy: 1.2515201490188743
Energy: 0.764171588506139
Energy: 0.7359111115721473
Energy: 0.7357428445827613
Energy: 1.524113367293505
Energy: 0.7227211635515608
Energy: 0.9553411228853012
Energy: 0.7227211635515608
Energy: 1.239783776564293
Energy: 1.0234467708836377
Energy: 0.9589734666495778
Energy: 1.0234467708836377
Energy: 1.2577656356190285
Energy: 0.8138347511469795
Energy: 1.12739325815576
Energy: 0.8138347511690501
Energy: 1.177285538136106
Energy: 0.8133791412338733
Energy: 1.0129486535894645
Energy: 0.8133791412338733
Energy: 0.9364660948553529
Energy: 0.9334093496990363
Energy: 1.1868206810497912
Energy: 0.933409349700264
Energy: 0.8105051595351078
Energy: 0.9320528438510995
Energy: 1.3700814081667607
Energy: 0.9320528438510995
Energy: 0.9788328004120745
Energy: 0.7163790797584427
Energy: 1.5287432913038872
Energy: 0.7163790797584427
Energy: 0.8107608366335303
Energy: 0.7174247947220134
Energy: 1.3756534209176723
Energy: 0.7174247947220134
Energy: 0.8169568425391311
Energy: 0.701061084477826
Energy: 1.4424929656921572
Energy: 0.701061084477826
Energy: 0.8889988061409161
Energy: 0.8901012520454772
Energy: 1.1154493121132518
Energy: 0.8901012520454772
Energy: 1.0435364904089004
Energy: 0.7009548723479376
Energy: 1.4426618598462153
Energy: 0.7009548723479376
Energy: 1.0518834865289455
Energy: 1.0176618923128737
Energy: 1.2393923285104504
Energy: 1.0176618923128737
Energy: 1.2234200718988038
Energy: 0.8076744826033347
Energy: 1.2581960427234917
Energy: 0.8076744826033347
Energy: 1.0129486535894645
Energy: 0.963515177052745
Energy: 1.226974004872427
Energy: 0.963515177052745
Energy: 1.1868206810497912
Energy: 0.9679354912471669
Energy: 0.9498264821853043
Energy: 0.9679354912459394
Energy: 1.3043207383851865
Energy: 0.7224529230403933
Energy: 0.805661592779487
Energy: 0.7224529230403933
Energy: 1.5287432913038872
Energy: 0.7236782389892452
Energy: 0.8981713156291619
Energy: 0.7236782389757405
Energy: 1.3756534209164448
Energy: 0.7258188781136958
Energy: 0.7235795360836199
Energy: 0.7258188781149236
Energy: 1.5201317852652405
Energy: 0.7237837608799075
Energy: 0.7233117281029598
Energy: 0.7237837608799075

minimum gb energy = 0.7009548723479376 eV
minimum distance =  2.29942663231831 Angstroms
sigma value = 25


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

Energy: 1.4415744346580586
Energy: 0.6755927808880727
Energy: 0.6464472086209156
Energy: 0.6464770297399539
Energy: 1.4389492343823744
Energy: 0.6391141264873537
Energy: 0.8266000909755032
Energy: 0.6391141264863951
Energy: 1.3112148061801303
Energy: 0.6396541635555825
Energy: 0.824754694987453
Energy: 0.6396541635555825
Energy: 1.0378352604884449
Energy: 0.6390397878862123
Energy: 1.131176960628485
Energy: 0.6390397878852537
Energy: 1.2714166229373125
Energy: 0.9298828970118171
Energy: 1.131996597746969
Energy: 0.9298828970118171
Energy: 1.0650328596580605
Energy: 1.1183112772617867
Energy: 1.129768479887216
Energy: 1.1183112772608284
Energy: 1.0762878234470623
Energy: 0.916323805111134
Energy: 1.2115171925939618
Energy: 0.9163238051092166
Energy: 1.1014578216325461
Energy: 0.806471849358276
Energy: 1.2361298037927986
Energy: 0.806471849358276
Energy: 0.8076559106393724
Energy: 0.8059537674535416
Energy: 1.3791644295842895
Energy: 0.8059537674535416
Energy: 0.8085117674243361
Energy: 0.8060159724731136
Energy: 1.246859523880038
Energy: 0.8060159724731136
Energy: 0.7095227010121933
Energy: 0.6404836726770865
Energy: 1.2325070272632217
Energy: 0.6404836726790041
Energy: 0.7142702714288901
Energy: 0.6381972372611443
Energy: 1.2467432159018355
Energy: 0.6381972372611443
Energy: 0.7256613568580851
Energy: 0.6295044284998509
Energy: 1.4985471568513289
Energy: 0.6295044285008096
Energy: 0.9143597380516332
Energy: 0.6373945351073258
Energy: 1.3345508724211272
Energy: 0.6373945351082845
Energy: 0.9057658537148248
Energy: 0.6278793687827556
Energy: 1.3238297385936546
Energy: 0.6278793687837144
Energy: 0.9007951659598733
Energy: 0.6365716464240259
Energy: 1.3148596793180198
Energy: 0.6365716464230672
Energy: 1.119848896461532
Energy: 0.8054407691482028
Energy: 1.3190513498521053
Energy: 0.8054407691491616
Energy: 0.8614141238359905
Energy: 1.0800989505800769
Energy: 1.3166517530525848
Energy: 1.0800989505800769
Energy: 1.1155721653886668
Energy: 1.0498899872073004
Energy: 1.0747709393148188
Energy: 1.0498899872073004
Energy: 1.386313137579679
Energy: 0.8515477528852453
Energy: 1.0655040875701791
Energy: 0.8515477528852453
Energy: 1.2342700395887845
Energy: 0.6386062404550111
Energy: 0.8298471053378494
Energy: 0.6386062393856116
Energy: 1.389088599630694
Energy: 0.6387395770176454
Energy: 0.7079959340707691
Energy: 0.6387337404026705
Energy: 1.4378086066906621
Energy: 0.6401569064382545
Energy: 0.8314222505940908
Energy: 0.6401569064392132
Energy: 1.2355990863170978
Energy: 0.6453700955278173
Energy: 0.638549626977721
Energy: 0.645370095528776
Energy: 1.5164715711942809
Energy: 0.6385322229807399
Energy: 0.6401115307307998
Energy: 0.6385322229816985
Energy: 1.312987550385861
Energy: 0.6485450181843634
Energy: 0.6383369636684748
Energy: 0.6485450181853222

minimum gb energy = 0.6278793687827556 eV
minimum distance =  2.30197976329164 Angstroms
sigma value = 41


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

Energy: 1.4686686773461748
Energy: 0.604114814947384
Energy: 0.5805828529209627
Energy: 0.5796585213314699
Energy: 1.5385344758010524
Energy: 0.5728899130965055
Energy: 0.7303703418429011
Energy: 0.5728899130972916
Energy: 1.3124275946692006
Energy: 0.5745010351455127
Energy: 0.701571573536046
Energy: 0.5745010351470846
Energy: 1.1332938160825106
Energy: 0.5748228275699548
Energy: 1.0088546302123524
Energy: 0.5748228275715268
Energy: 1.3185360276449545
Energy: 0.8241430897670038
Energy: 0.99088635660315
Energy: 0.8241430897670038
Energy: 1.0963451593180276
Energy: 0.8289300894552951
Energy: 0.989713491831045
Energy: 0.8289300894529373
Energy: 1.101404021488366
Energy: 1.0251915570545822
Energy: 1.209059357263889
Energy: 1.0251915570545822
Energy: 1.1074890017593841
Energy: 1.0272305712592478
Energy: 0.9772940175809356
Energy: 1.0272305712592478
Energy: 0.8259020948934839
Energy: 1.0178762818755538
Energy: 1.2048442588537849
Energy: 1.0178762818755538
Energy: 0.8762496172357933
Energy: 0.8240233800112449
Energy: 1.4196802980321
Energy: 0.8240233800128168
Energy: 0.7006829466228754
Energy: 0.5735425827557317
Energy: 1.3010136488896316
Energy: 0.5735425825074772
Energy: 0.6970519785362853
Energy: 0.5738561440049621
Energy: 1.4206682686596772
Energy: 0.5738561440049621
Energy: 0.7425521512701073
Energy: 0.5748861176789662
Energy: 1.4215255111232326
Energy: 0.5748861176875761
Energy: 0.5726291030110773
Energy: 0.5791169514651245
Energy: 1.3011920246386417
Energy: 0.5791169514659105
Energy: 0.5742751864584454
Energy: 0.5731619468656711
Energy: 1.319789774803597
Energy: 0.5731619468672432
Energy: 0.5720490630603527
Energy: 0.5763626288433631
Energy: 1.3146653060291895
Energy: 0.5763626288425772
Energy: 0.7373057610112349
Energy: 0.5762398453773236
Energy: 1.3191356867724733
Energy: 0.5762398453773236
Energy: 0.696116153117569
Energy: 0.5724120863256662
Energy: 1.3173594752462652
Energy: 0.5724120863256662
Energy: 0.7340859782171948
Energy: 0.5780129529239967
Energy: 1.1256578638513
Energy: 0.5780129529224247
Energy: 1.0018285544765881
Energy: 0.8267048588445884
Energy: 1.124670814073724
Energy: 0.8267048588461604
Energy: 0.9770285441138853
Energy: 0.830951719566334
Energy: 1.2091544107867003
Energy: 0.8309517198876465
Energy: 0.9930894637130425
Energy: 0.8298344427957123
Energy: 1.117726210776576
Energy: 0.8298344427941403
Energy: 1.2052509238665712
Energy: 1.0641100246533923
Energy: 1.09589962993953
Energy: 1.0641100246533923
Energy: 0.9774288082616235
Energy: 0.8305929690121291
Energy: 0.9940543975936648
Energy: 0.8305929690129151
Energy: 1.2109686138033926
Energy: 1.022074195211093
Energy: 0.8192842205739541
Energy: 1.022074195211093
Energy: 1.2063941369169262
Energy: 0.5754139982492114
Energy: 0.9906494436937413
Energy: 0.5754139982547131
Energy: 1.209044888214033
Energy: 0.5768962063515473
Energy: 0.743754657866758
Energy: 0.5768962063531191
Energy: 1.4248885585561144
Energy: 0.5736780145832985
Energy: 0.6952334456596192
Energy: 0.5736780145825126
Energy: 1.222839058152639
Energy: 0.578697641101267
Energy: 0.7519827711210806
Energy: 0.5786976411059828
Energy: 1.219947988411714
Energy: 0.5770062767865733
Energy: 0.5719118399992837
Energy: 0.5770062767873593
Energy: 1.4214294615704708
Energy: 0.5724148893430074
Energy: 0.5735966458157352
Energy: 0.5724148893422214
Energy: 1.3983505946784947
Energy: 0.5785885878141843
Energy: 0.5721519753373343
Energy: 0.5785885878141843

minimum gb energy = 0.5719118399992837 eV
minimum distance =  2.31578203362945 Angstroms
sigma value = 15


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

Energy: 1.2696572688209262
Energy: 0.5542854025919626
Energy: 0.5362770389315396
Energy: 0.5348268054329937
Energy: 1.46295852837796
Energy: 0.5284035912480227
Energy: 0.6374597016266399
Energy: 0.5284035912480227
Energy: 1.359485130654827
Energy: 0.5296873324161068
Energy: 0.637906715096405
Energy: 0.5296873324194358
Energy: 1.27132258502588
Energy: 0.5317791221367465
Energy: 0.8960471680444954
Energy: 0.5317791221068455
Energy: 1.3656031174717822
Energy: 0.748290040631453
Energy: 0.8694444364800792
Energy: 0.748290040631453
Energy: 1.1692285767825024
Energy: 0.7562862473025079
Energy: 0.8858236154889713
Energy: 0.7562862473031737
Energy: 0.9996510198664852
Energy: 0.7554509360249935
Energy: 1.0822883525447933
Energy: 0.7554509360256593
Energy: 1.1803379065358761
Energy: 0.9741571153855765
Energy: 0.8644551612293117
Energy: 0.9741571153862423
Energy: 0.9813904174011351
Energy: 0.9661830575570362
Energy: 1.0756748169965125
Energy: 0.9661830575570362
Energy: 0.9806266072712627
Energy: 0.9719939767445823
Energy: 1.2644087929189554
Energy: 0.9719939767452481
Energy: 0.8766240490280027
Energy: 0.7556139897724568
Energy: 1.1318483056539193
Energy: 0.75561398977512
Energy: 0.7362672036947737
Energy: 0.9256613128069251
Energy: 1.2642486609568289
Energy: 0.9256613128069251
Energy: 0.8871862932820396
Energy: 0.7500115382861827
Energy: 1.2635688502138536
Energy: 0.7500115382861827
Energy: 0.6673667476327998
Energy: 0.5312519090671624
Energy: 1.132858141011724
Energy: 0.5312519090718231
Energy: 0.6319264446452941
Energy: 0.5304016842497442
Energy: 1.4525319786103628
Energy: 0.530401684225109
Energy: 0.6777444393791588
Energy: 0.5313126469672751
Energy: 1.2661615939373283
Energy: 0.5313126469692726
Energy: 0.5450012041129623
Energy: 0.5335518357117854
Energy: 1.2716099678631112
Energy: 0.5335518357117854
Energy: 0.5270648953068173
Energy: 0.5280261960446644
Energy: 1.4563953028324224
Energy: 0.5280261960459959
Energy: 0.5426639325926742
Energy: 0.5312262407511227
Energy: 1.2103733699362924
Energy: 0.5312262407511227
Energy: 0.6488073699926555
Energy: 0.5318598403211514
Energy: 1.364477665253046
Energy: 0.531859840322483
Energy: 0.6295147542010143
Energy: 0.5291656025695951
Energy: 1.366385905255875
Energy: 0.5291656025742557
Energy: 0.6521395081302059
Energy: 0.5347649571806458
Energy: 1.177276572255279
Energy: 0.534764957179314
Energy: 0.8970345089727357
Energy: 0.7489130757569249
Energy: 1.168105437070364
Energy: 0.7489130757575907
Energy: 0.8655785545870958
Energy: 0.7509740985035835
Energy: 1.2672519936452173
Energy: 0.7509740985029176
Energy: 0.904226987327662
Energy: 0.7535904648096364
Energy: 0.9936183575501061
Energy: 0.7535904648063075
Energy: 1.0756554980292237
Energy: 0.9696114154788685
Energy: 1.2662254961864947
Energy: 0.9696114154782027
Energy: 0.8695792160484189
Energy: 0.9681977774563357
Energy: 1.0775224262615033
Energy: 0.9681977774556699
Energy: 1.088112423080685
Energy: 0.9754484135566397
Energy: 0.9939049849150385
Energy: 0.9754484135566397
Energy: 1.0789361185203343
Energy: 0.7484078135175068
Energy: 1.0804292146215504
Energy: 0.7484078135168409
Energy: 1.0761150120302174
Energy: 0.749636968172361
Energy: 0.8652449321159732
Energy: 0.7496369681716952
Energy: 1.2734036620691958
Energy: 0.7477883641644097
Energy: 0.7357039787115766
Energy: 0.7477883641630781
Energy: 1.1335166605143543
Energy: 0.5299231985228771
Energy: 0.9065979987437178
Energy: 0.5299231985355275
Energy: 1.2649251914907667
Energy: 0.5314362308389453
Energy: 0.6374237081937832
Energy: 0.5314362308369479
Energy: 1.3675806371964039
Energy: 0.5285773340244293
Energy: 0.6539927048671234
Energy: 0.5285773340224318
Energy: 1.4153055828131402
Energy: 0.5375749318192367
Energy: 0.6586329202167707
Energy: 0.5375749318312213
Energy: 1.4516722662129644
Energy: 0.5290319038130196
Energy: 0.5334189988314212
Energy: 0.5290319038123538
Energy: 1.357626439132614
Energy: 0.5295705083868698
Energy: 0.5326475352882828
Energy: 0.5295705083868698

minimum gb energy = 0.5270648953068173 eV
minimum distance =  2.31443740188873 Angstroms
sigma value = 85


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

Energy: 1.4204127711769605
Energy: 0.5262534667930604
Energy: 0.47740822707234254
Energy: 0.47773150092289524
Energy: 1.4257121951696958
Energy: 0.47751084157505863
Energy: 0.5663341850161668
Energy: 0.4775108415744812
Energy: 1.2530356127652684
Energy: 0.47718647038629136
Energy: 0.5659082308338189
Energy: 0.4771864703828265
Energy: 1.1741000852496095
Energy: 0.4775995521667776
Energy: 0.7860361066285212
Energy: 0.477599552167355
Energy: 1.384488881522087
Energy: 0.6752524097608669
Energy: 0.7761268560606398
Energy: 0.6752524097608669
Energy: 1.0830498452825972
Energy: 0.6547509508271984
Energy: 0.7794295388973729
Energy: 0.6547509508266209
Energy: 1.0875150313397677
Energy: 0.5799269043445449
Energy: 0.9640428409178843
Energy: 0.5799269043237562
Energy: 1.2203165547476795
Energy: 0.8787900380201578
Energy: 0.8212126028883536
Energy: 0.8787900380190029
Energy: 1.0869225601146193
Energy: 0.8823329669168944
Energy: 0.9655964905884384
Energy: 0.882332966916317
Energy: 1.08601801821736
Energy: 0.895966816063548
Energy: 1.1288047388581703
Energy: 0.8959668160641254
Energy: 0.9744423811468652
Energy: 0.8781264066875741
Energy: 1.0543564014798532
Energy: 0.8781264066875741
Energy: 0.9377651314252684
Energy: 0.8776868082875248
Energy: 1.1300868470270553
Energy: 0.8776868082875248
Energy: 0.9622711550440654
Energy: 0.8734566991782278
Energy: 1.1685283944105387
Energy: 0.8734566991782278
Energy: 0.7599558825892212
Energy: 0.5819770091617839
Energy: 1.0543353592862355
Energy: 0.5819770091612063
Energy: 0.709178667290672
Energy: 0.5974637147375068
Energy: 1.2974605272934099
Energy: 0.5974637147386619
Energy: 0.7634237128553791
Energy: 0.5802726130169563
Energy: 1.1695340197393864
Energy: 0.5802726130158015
Energy: 0.5852312476359579
Energy: 0.4761679906510193
Energy: 1.1677934084096224
Energy: 0.4761679906515967
Energy: 0.5755800726542208
Energy: 0.5806070886451341
Energy: 1.4617793743628849
Energy: 0.5806070886457116
Energy: 0.5801901482157102
Energy: 0.47739528527250513
Energy: 1.3357409644686777
Energy: 0.47739528527192765
Energy: 0.5220664494735513
Energy: 0.47832658256181765
Energy: 1.3355717722058136
Energy: 0.47832658260859207
Energy: 0.5193309460195269
Energy: 0.47331878673635114
Energy: 1.5039669470851948
Energy: 0.47331878673808353
Energy: 0.5210416012374426
Energy: 0.47370497360157193
Energy: 1.208995989010226
Energy: 0.4737049736027268
Energy: 0.6100047432197006
Energy: 0.4759894523808609
Energy: 1.3808213740941007
Energy: 0.4759894523808609
Energy: 0.6122488719365464
Energy: 0.47556643990263725
Energy: 1.3781081846962784
Energy: 0.4755664399395948
Energy: 0.6100218448247776
Energy: 0.4769089870539485
Energy: 1.1728701347669899
Energy: 0.47690898723692515
Energy: 0.7814772024636079
Energy: 0.7710343358010945
Energy: 1.4198220279642393
Energy: 0.7710343358005171
Energy: 0.7904118919492691
Energy: 0.770403943624688
Energy: 1.2531342934438563
Energy: 0.7704039436252654
Energy: 0.9581953489943538
Energy: 0.5796789558519463
Energy: 1.1747089770199415
Energy: 0.5796789558513689
Energy: 0.9537165558326527
Energy: 0.8067677081484299
Energy: 1.2638705589181694
Energy: 0.8067677081484299
Energy: 0.9579625579484892
Energy: 0.876707374503083
Energy: 1.084042004522944
Energy: 0.876707374504238
Energy: 1.135683133860693
Energy: 0.8796531463189062
Energy: 0.9375308592059497
Energy: 0.8796531463183288
Energy: 1.0430185836277712
Energy: 0.8857451217850908
Energy: 1.1274243241575221
Energy: 0.8857451217845133
Energy: 1.12982880438431
Energy: 0.8815288230789251
Energy: 0.9277927159081976
Energy: 0.8815288230795026
Energy: 1.2975724288614903
Energy: 0.8780518117921189
Energy: 0.928162491861949
Energy: 0.8780518117926963
Energy: 1.0522876867317574
Energy: 0.7298224494971324
Energy: 0.952918692054959
Energy: 0.7298224494965548
Energy: 1.2967578125620807
Energy: 0.676156380383062
Energy: 0.772419564104492
Energy: 0.676156380381907
Energy: 1.3368546326054016
Energy: 0.6756554387791166
Energy: 0.7745304668225304
Energy: 0.6756554387785392
Energy: 1.2971848015971459
Energy: 0.47765047633477753
Energy: 0.5662353216140675
Energy: 0.47765047633420005
Energy: 1.4610458282935053
Energy: 0.4771536169896921
Energy: 0.5673803331142933
Energy: 0.4771536169908471
Energy: 1.3391173625856407
Energy: 0.47998455511720556
Energy: 0.5671670570501212
Energy: 0.4799845551160507
Energy: 1.1749983706388392
Energy: 0.4759301150454843
Energy: 0.47612258580521677
Energy: 0.47593011504490684
Energy: 1.425546897709068
Energy: 0.47628716732411736
Energy: 0.4765489365114214
Energy: 0.47628716732353993
Energy: 1.2558242926398246
Energy: 0.47663875653437304
Energy: 0.47623089580065975
Energy: 0.4766387565337956

minimum gb energy = 0.47331878673635114 eV
minimum distance =  2.30634748148253 Angstroms
sigma value = 113


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

Energy: 0.015463000206697915
Energy: 0.016212739702927706
Energy: 1.1095339832635724
Energy: 0.49483244089160666
Energy: 0.016172920051133573
Energy: 0.11151451413241148
Energy: 0.7216081403600547
Energy: 0.11151451413241148
Energy: 0.016070303960424515
Energy: 0.11005207855274897
Energy: 0.7201368197293527
Energy: 0.11005207855274897
Energy: 0.017167508500152372
Energy: 0.11139830660305464
Energy: 0.7224777177319202
Energy: 0.11139830660261071
Energy: 0.7213066994801559
Energy: 0.11192645851426072
Energy: 0.7225096381561423
Energy: 0.11192645851470466
Energy: 0.015969660109755767
Energy: 0.10987155746350262
Energy: 0.7202952707015081
Energy: 0.10987155746350262

minimum gb energy = 0.015463000206697915 eV
minimum distance =  2.52121300983791 Angstroms
sigma value = 1