Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
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=3.5196185708045964
cohesive_energy=4.4503473912097995
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=[1.8512349917553e-19, 2.71302978141756e-19, 3.39017371401132e-19, 3.9788134093429194e-19, 4.49038840857912e-19, 4.92183855434898e-19, 5.282696797624799e-19, 5.58597281267466e-19, 5.8422569870492995e-19, 6.059608269217739e-19, 6.244339235117939e-19, 6.401737067642099e-19, 6.536255817832739e-19, 6.651580491948059e-19, 6.750627051461939e-19, 6.83555843483028e-19, 6.9078646663227e-19, 6.968555117218619e-19, 7.018559049965759e-19, 7.0588377705445195e-19, 7.0901122584402e-19, 7.1123024048211e-19, 7.1253921879208805e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.11036377109396e-19, 7.083927856632958e-19, 7.044065701979039e-19, 6.988742542807019e-19, 6.915603179464919e-19, 6.82184380284324e-19, 6.70395564611352e-19, 6.557532723532259e-19, 6.376839242749739e-19, 6.1541206688574e-19, 5.8789468319679e-19, 5.53753901302884e-19, 5.11208100787014e-19, 4.58031858304554e-19, 3.91446999572148e-19, 3.07951166467872e-19, 2.02934896815708e-19, 6.984448709427899e-20, -1.0111528998370079e-19, -3.24197237536632e-19, -6.194815955361e-19, -1.0162574345929318e-18, -1.5592366980321658e-18, -2.3186379811921197e-18, -3.4233067268024395e-18]
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: 0.018107807655759273
Energy: 0.01889664610103978
Energy: 0.018540559258682015
Energy: 0.018359595622317818
Energy: 0.5689310053579301
Energy: 0.018535253808746488
Energy: 0.018896646101370613
Energy: 0.15237618599218575
Energy: 0.15409637316019534
Energy: 0.15245593747047176
Energy: 0.1521898184057052
Energy: 0.15375133733517427
Energy: 0.01854055925930693
Energy: 0.15409637315986446
Energy: 0.1535299841465076
Energy: 0.01854238604554721
Energy: 0.15210922256151044
Energy: 0.15308560835119692
Energy: 0.01835959562294273
Energy: 0.15245593747113342
Energy: 0.018542386042643202
Energy: 0.018548733016290356
Energy: 0.15221123564466724
Energy: 0.01857057635791538
Energy: 0.5689310053575993
Energy: 0.1521898184057052
Energy: 0.15210922256117962
Energy: 0.15221123564466724
Energy: 0.15235901702163968
Energy: 0.1520761753261569
Energy: 0.01853525380940816
Energy: 0.15375133733550508
Energy: 0.15308560835119692
Energy: 0.018570576356628798
Energy: 0.1520761753261569
Energy: 0.01860335216343751

minimum gb energy = 0.018107807655759273 eV
minimum distance =  2.48531999711 Angstroms
sigma value = 1


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

Energy: 1.6150612909710822
Energy: 1.095132365416954
Energy: 1.1078051689789263
Energy: 1.0584732711156164
Energy: 1.6319346151130536
Energy: 1.1074781767238475
Energy: 1.5655671681610988
Energy: 1.03722636968011
Energy: 1.0162184349314263
Energy: 1.0737035581955385
Energy: 1.0742665176603834
Energy: 1.0764206817775042
Energy: 1.0890672005798832
Energy: 1.035731246022571
Energy: 1.0223400449225124
Energy: 1.0561257313399974
Energy: 1.0641268404476525
Energy: 1.0480705337928165
Energy: 1.6299060229723141
Energy: 1.0453521216635913
Energy: 1.0232047399989568
Energy: 1.0475889499686837
Energy: 1.0455355933153585
Energy: 1.0470397384655772
Energy: 1.4975971999243305
Energy: 1.0777141651217204
Energy: 1.0784647032674681
Energy: 1.0764729729354359
Energy: 1.0639521386276918
Energy: 1.0801666127140717
Energy: 1.476650382448041
Energy: 1.0786388348414466
Energy: 1.0786578398357536
Energy: 1.0627742398679974
Energy: 1.0917686665370914
Energy: 1.07842237137357
Energy: 1.4780197794543908
Energy: 1.079068833837057
Energy: 1.0795054228876964
Energy: 1.0643856819764645
Energy: 1.0661761112519808
Energy: 1.0789357833199607
Energy: 1.4587768219706763
Energy: 1.084148546555126
Energy: 1.0849918605375648
Energy: 1.0187466153007012
Energy: 1.0624988501416188
Energy: 1.0779930587871487
Energy: 1.1963658935280141
Energy: 1.0637620950913627
Energy: 1.0656308032407658
Energy: 1.091107377067116
Energy: 1.0529944764635033
Energy: 1.0770635765966043
Energy: 1.1961299621999695
Energy: 1.0976581955615903
Energy: 1.0956720169080605
Energy: 1.0534410922964983
Energy: 1.077200346353288
Energy: 1.060248905216064
Energy: 1.2149402782866596
Energy: 1.0589660882269758
Energy: 1.0090315010285675
Energy: 1.1019652620191789
Energy: 1.0583409763630955
Energy: 1.0306937235932097
Energy: 1.094628025412614
Energy: 1.0453749222657884
Energy: 1.0477450955667476
Energy: 1.0580987309474825
Energy: 1.061320771849156
Energy: 1.0478983230489638
Energy: 1.095084198519279
Energy: 1.0621169595123163
Energy: 1.062646603550676
Energy: 1.0780500720489843
Energy: 1.0431497919289123
Energy: 1.0803951260872395
Energy: 1.2128485101051711
Energy: 1.047111125473552
Energy: 1.021348343905338
Energy: 1.0811309725257259
Energy: 1.0473768365204519
Energy: 1.0300032294176062
Energy: 1.1214375629934903
Energy: 1.0764975918896134
Energy: 1.0935408216504203
Energy: 1.064144506897374
Energy: 1.0763054120218651
Energy: 1.0169584547058135
Energy: 1.120525111878031
Energy: 1.0483044319698345
Energy: 1.047801847232866
Energy: 1.0747941194254524
Energy: 1.0381220603740324
Energy: 1.0477499770802714
Energy: 1.3873252948944517
Energy: 1.0659436871807786
Energy: 1.0759334005231618
Energy: 1.0236036054532671
Energy: 1.0644108761627968
Energy: 1.0480495701834274
Energy: 1.3315952550601584
Energy: 1.0709096116891526
Energy: 1.0900926872121055
Energy: 1.0752918657480548
Energy: 1.0584463826106751
Energy: 1.09002195769666
Energy: 1.3315056316606908
Energy: 1.0911827063827215
Energy: 1.0896180138080538
Energy: 1.072646620307694
Energy: 1.0762449731228514
Energy: 1.089106872599949
Energy: 1.435137719316766
Energy: 1.090567678775429
Energy: 1.0900730531778664
Energy: 1.0584862928070915
Energy: 1.0746234091901747
Energy: 1.0891252521569972
Energy: 1.5432081571420149
Energy: 1.0229088971367812
Energy: 1.009574197572795
Energy: 1.058495120800174
Energy: 1.0250135547498005
Energy: 1.0354696580642604
Energy: 1.5500302069832403
Energy: 1.0627475293835311
Energy: 1.0477469583829246
Energy: 1.0432117116343387
Energy: 1.0737607443895976
Energy: 1.047774074059278
Energy: 1.4377010979277633
Energy: 1.034387143498882
Energy: 1.01814885007759
Energy: 1.0647153566045808
Energy: 1.0624643680917532
Energy: 1.0665266273720915

minimum gb energy = 1.0090315010285675 eV
minimum distance =  2.28582988345428 Angstroms
sigma value = 33


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

Energy: 1.9842122626742023
Energy: 1.1514787658521073
Energy: 1.110019564932107
Energy: 1.1041058257264726
Energy: 1.1424739824735306
Energy: 1.150591683627349
Energy: 1.3932978882138631
Energy: 1.0735985443695704
Energy: 1.05592656314769
Energy: 1.128280512167489
Energy: 1.1123729927102304
Energy: 1.09394220012948
Energy: 1.4381752052442591
Energy: 1.1177714320913397
Energy: 1.0841494768396236
Energy: 1.103567591196842
Energy: 1.1267079495556898
Energy: 1.1297614633365383
Energy: 1.588244985841595
Energy: 1.1873939708350907
Energy: 1.1159585343059324
Energy: 1.104943513002979
Energy: 1.1191897869047647
Energy: 1.090757019697988
Energy: 1.4676275397586376
Energy: 1.1204050162981505
Energy: 1.104652960412394
Energy: 1.1273907445474587
Energy: 1.118638186287196
Energy: 1.0997396644846313
Energy: 1.573840836090648
Energy: 1.17983153508632
Energy: 1.1808450467584708
Energy: 1.1791252447806686
Energy: 1.2124427170979069
Energy: 1.1822828683391606
Energy: 1.5731550998434716
Energy: 1.1654005291101948
Energy: 1.1767527916244271
Energy: 1.1829805545023269
Energy: 1.166677076898286
Energy: 1.1744402741953668
Energy: 1.471352137788581
Energy: 1.151515645110559
Energy: 1.151512057006426
Energy: 1.1593611485343929
Energy: 1.151184325312913
Energy: 1.1515591501090623
Energy: 1.3049824355348243
Energy: 1.1509322382596072
Energy: 1.1991132545725443
Energy: 1.2070568620159061
Energy: 1.1453122410756151
Energy: 1.2049596616829283
Energy: 1.3062149253375286
Energy: 1.2030651352839712
Energy: 1.2042398395064535
Energy: 1.1980111705361838
Energy: 1.2038276032035908
Energy: 1.1908941075503343
Energy: 1.32286217979403
Energy: 1.063206239006204
Energy: 1.0665344166207642
Energy: 1.1981882927498926
Energy: 1.0634719977217681
Energy: 1.0669988347373796
Energy: 1.1815984199545453
Energy: 1.0975181477043954
Energy: 1.1465523526108399
Energy: 1.181625790585932
Energy: 1.113006615579434
Energy: 1.1317499426021376
Energy: 1.1810056079279996
Energy: 1.1670404194553239
Energy: 1.1908379885181077
Energy: 1.181067010670935
Energy: 1.1712210782063026
Energy: 1.1431978099234363
Energy: 1.2947824543315374
Energy: 1.1056442871489631
Energy: 1.0891992566904398
Energy: 1.2032305719827912
Energy: 1.104978957293848
Energy: 1.0898661215257557
Energy: 1.2842123525577291
Energy: 1.204334178920456
Energy: 1.1778453366290849
Energy: 1.198853133138209
Energy: 1.2071232619190777
Energy: 1.1676061113756802
Energy: 1.2823661357805436
Energy: 1.1702445657686493
Energy: 1.1705697062008436
Energy: 1.2118290905222608
Energy: 1.1783521081650852
Energy: 1.173574586166376
Energy: 1.5509025385613042
Energy: 1.164075344952293
Energy: 1.168235599596313
Energy: 1.1415743955755746
Energy: 1.1607008199405475
Energy: 1.168582664905101
Energy: 1.3961565368245952
Energy: 1.2192544770111584
Energy: 1.211661436282076
Energy: 1.1513260562004393
Energy: 1.158939806426525
Energy: 1.1524240648545696
Energy: 1.3966501649640597
Energy: 1.214073508415962
Energy: 1.2091684079402953
Energy: 1.1515285865275482
Energy: 1.2218956171516437
Energy: 1.2091112099772545
Energy: 1.4149105574065317
Energy: 1.2099880609312699
Energy: 1.1998044251579802
Energy: 1.1991919316035022
Energy: 1.1922781541202578
Energy: 1.1890031839939896
Energy: 1.6626614802202961
Energy: 1.1396344208756235
Energy: 1.0110588583869005
Energy: 1.0119945145861051
Energy: 1.1412938725571085
Energy: 1.0110083021874203
Energy: 1.2760735183566427
Energy: 1.1312210912466858
Energy: 1.129570064648175
Energy: 1.0447371347671324
Energy: 1.1646354572676367
Energy: 1.110386770278532
Energy: 1.4172530735007234
Energy: 1.1913430972282777
Energy: 1.1528196434642135
Energy: 1.1610998915949158
Energy: 1.1919112250343051
Energy: 1.1655220127207682
Energy: 1.6350879316954743
Energy: 1.202289197524954
Energy: 1.2027478349960956
Energy: 1.0887324287942448
Energy: 1.1772660789446703
Energy: 1.1181232311495344
Energy: 1.413662643935942
Energy: 1.190742764198137
Energy: 1.159645576779659
Energy: 1.1320140117908268
Energy: 1.1893418082203844
Energy: 1.1636021487368635
Energy: 1.5813493920419948
Energy: 1.1662981652123687
Energy: 1.168236483427017
Energy: 1.175999776066035
Energy: 1.1979633943445098
Energy: 1.167138687920286
Energy: 1.5777088477942054
Energy: 1.1699065411202305
Energy: 1.1692613837693837
Energy: 1.1714351696092808
Energy: 1.1630908252136245
Energy: 1.169100968687016
Energy: 1.470108702665831
Energy: 1.15143625047112
Energy: 1.1520096412891365
Energy: 1.1571692687030373
Energy: 1.15120673145799
Energy: 1.2128572125401154
Energy: 1.2761058615118097
Energy: 1.1514243222779699
Energy: 1.1524475189114334
Energy: 1.2093879639336442
Energy: 1.1518039696119573
Energy: 1.1943642375461747
Energy: 1.2751467736179667
Energy: 1.2053738323470156
Energy: 1.1791670886815802
Energy: 1.2034078318599313
Energy: 1.2080019041195356
Energy: 1.1844311650673758
Energy: 1.2976872998015505
Energy: 1.0631425778728034
Energy: 1.065972898664987
Energy: 1.154462599170549
Energy: 1.0634766253709502
Energy: 1.066676928674906
Energy: 1.2133336263819479
Energy: 1.0570606991971692
Energy: 1.0619006103584552
Energy: 1.1780296217790043
Energy: 1.0695973115923254
Energy: 1.1451992596247855
Energy: 1.2138296193778535
Energy: 1.2114186952372232
Energy: 1.1863958523718319
Energy: 1.1872492052676769
Energy: 1.1636873159257901
Energy: 1.1531749972678498
Energy: 1.213437006625647
Energy: 1.0886553073960863
Energy: 1.0894924182979635
Energy: 1.1738090192537296
Energy: 1.105528685967752
Energy: 1.1196956190674079
Energy: 1.279844053889063
Energy: 1.2121888082575898
Energy: 1.2120813197028366
Energy: 1.1932691165171483
Energy: 1.1709463639845532
Energy: 1.1511425846030565
Energy: 1.2771699692328393
Energy: 1.1726469993720456
Energy: 1.1724823045061266
Energy: 1.2043238570772037
Energy: 1.188241821037071
Energy: 1.1681843463833412
Energy: 1.2783256965323841
Energy: 1.0803938137598885
Energy: 1.080035842983624
Energy: 1.0927218566473424
Energy: 1.0951227548725027
Energy: 1.0801723535613963
Energy: 1.3938836670283297
Energy: 1.1983223125955942
Energy: 1.1224573845391737
Energy: 1.1461517199412548
Energy: 1.128716545825319
Energy: 1.2019115766088306
Energy: 1.3950292690689445
Energy: 1.140904772420455
Energy: 1.1328975307326368
Energy: 1.151546506377455
Energy: 1.143490411006435
Energy: 1.1527866196463958
Energy: 1.4676398266910482
Energy: 1.1390163340706254
Energy: 1.1440242460988996
Energy: 1.1357281180648378
Energy: 1.1395456034610807
Energy: 1.104651597888991
Energy: 1.6382345720775005
Energy: 1.1035625619909872
Energy: 1.0374349848592992
Energy: 1.0375828234089068
Energy: 1.067765692951946
Energy: 1.0925891015069753

minimum gb energy = 1.0110083021874203 eV
minimum distance =  2.27636939739004 Angstroms
sigma value = 51


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

Energy: 1.676314013303655
Energy: 1.0800870739459865
Energy: 1.07989311202217
Energy: 1.1068064571762537
Energy: 1.0647284237198096
Energy: 1.1183297731090815
Energy: 1.3859590116135925
Energy: 1.1192740932870253
Energy: 1.0708478039228297
Energy: 1.1160254937561165
Energy: 1.119683693818529
Energy: 1.07049843912236
Energy: 1.518404986751014
Energy: 1.1013878154285235
Energy: 1.0726749801285693
Energy: 1.0832897196494975
Energy: 1.1203277199383592
Energy: 1.0828332797464912
Energy: 1.515752427504321
Energy: 1.0619572323844402
Energy: 1.0678696351657273
Energy: 1.0748236750794746
Energy: 1.0717327006312733
Energy: 1.073795955776126
Energy: 1.2957815323342665
Energy: 1.1311462582692016
Energy: 1.1322883087019544
Energy: 1.1126935310636468
Energy: 1.1308679391683751
Energy: 1.1099099687415
Energy: 1.3014943221247672
Energy: 1.1332102022005288
Energy: 1.110602748090211
Energy: 1.1312971408858121
Energy: 1.1314467205769951
Energy: 1.1282143035586143
Energy: 1.301436205747341
Energy: 1.1127166974508704
Energy: 1.1106642820961967
Energy: 1.1312832330552973
Energy: 1.113193563318504
Energy: 1.1314071195558015
Energy: 1.3095751959318433
Energy: 1.0460894735614001
Energy: 1.0460439295159816
Energy: 1.096985942234586
Energy: 1.0469755397753797
Energy: 1.0458868886593495
Energy: 1.1207766752306174
Energy: 1.0467534644046674
Energy: 1.0464791453929903
Energy: 1.1017668917214951
Energy: 1.0469523983819284
Energy: 1.0771664944244024
Energy: 1.11981926377609
Energy: 1.1255144584153265
Energy: 1.0918073345275883
Energy: 1.119716024478591
Energy: 1.1186128589693949
Energy: 1.048267695756037
Energy: 1.1802686858730267
Energy: 1.0596917083025872
Energy: 1.0594860995830122
Energy: 1.0951547831242692
Energy: 1.0597859975495292
Energy: 1.0589952146714068
Energy: 1.1557354353510063
Energy: 1.1164107866092314
Energy: 1.1350228476604185
Energy: 1.089979440266712
Energy: 1.105062949485752
Energy: 1.0735234920037369
Energy: 1.1553840060667024
Energy: 1.077275016227453
Energy: 1.07674039424582
Energy: 1.1263356837329752
Energy: 1.0777970792295628
Energy: 1.0989858211276655
Energy: 1.1566905654841066
Energy: 1.0819447313306496
Energy: 1.0821066971486197
Energy: 1.0747655775881326
Energy: 1.0822987068375065
Energy: 1.0828650930376902
Energy: 1.3843273824718394
Energy: 1.0897517839992943
Energy: 1.0889761135470544
Energy: 1.0961150580891779
Energy: 1.08867863350677
Energy: 1.0855881581518347
Energy: 1.3882683375489278
Energy: 1.1080715882902716
Energy: 1.090008399009724
Energy: 1.0998524438559876
Energy: 1.1266170367022552
Energy: 1.0994382965181881
Energy: 1.4134768593965348
Energy: 1.1296002319304235
Energy: 1.1270041852331671
Energy: 1.128444500010213
Energy: 1.1294777116920365
Energy: 1.0881695974530432
Energy: 1.6403056947624786
Energy: 1.0899445363321183
Energy: 1.063021520594612
Energy: 1.044553328522687
Energy: 1.0901802715912876
Energy: 1.0944583099329415

minimum gb energy = 1.044553328522687 eV
minimum distance =  2.26307978662666 Angstroms
sigma value = 19


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

Energy: 1.4223225898013998
Energy: 1.0260199777233228
Energy: 1.0262721286492713
Energy: 1.0272111560455257
Energy: 1.0436455840131305
Energy: 1.0259726954275905
Energy: 1.4290745352479273
Energy: 1.0437586144112954
Energy: 1.0439249345296227
Energy: 1.062399327988828
Energy: 1.04384488190062
Energy: 1.0438772706161938
Energy: 1.5114009211687172
Energy: 1.043338675859244
Energy: 1.0434756521030901
Energy: 1.0647784625170211
Energy: 1.0436343505102472
Energy: 1.0435431246949258
Energy: 1.2167613414414018
Energy: 1.043653775875229
Energy: 1.0436320343991705
Energy: 1.049998195223173
Energy: 1.0436040635023283
Energy: 1.0439428428635333
Energy: 1.230121505470726
Energy: 1.0434064417283826
Energy: 1.0844166614525992
Energy: 1.0640960505343717
Energy: 1.0432075729638473
Energy: 1.0845139805798012
Energy: 1.2300752192591793
Energy: 1.00940384904134
Energy: 1.0839006053600522
Energy: 1.0632406843080986
Energy: 1.0092598560544668
Energy: 1.0612600409931632
Energy: 1.2335072805749852
Energy: 1.0836686426418498
Energy: 1.0611730984657104
Energy: 1.062628828948239
Energy: 1.0226248424111317
Energy: 1.0606078463915016
Energy: 1.189218478846759
Energy: 0.963681227033025
Energy: 0.9635803333668923
Energy: 1.0447756218081947
Energy: 0.9632701735191196
Energy: 0.9634258763751379
Energy: 1.043322376636683
Energy: 0.963591432243097
Energy: 0.9640556911465867
Energy: 1.043279050546787
Energy: 0.9635198067362181
Energy: 0.988995077655759
Energy: 1.0433584741762303
Energy: 1.026622764833323
Energy: 1.0439369720620306
Energy: 1.0435121741378146
Energy: 1.0631236539442717
Energy: 1.0436278557632641
Energy: 1.0415922405083284
Energy: 1.0504707727562275
Energy: 1.0508756686486238
Energy: 1.0419085606770242
Energy: 1.050592675242517
Energy: 1.0433107992305883
Energy: 1.2272951367570155
Energy: 1.0654499471270795
Energy: 1.0822591214154733
Energy: 1.0431072640159809
Energy: 1.0624914377181172
Energy: 1.0434281846368902
Energy: 1.00904414904482
Energy: 1.0616982172063396
Energy: 1.062013267384785
Energy: 1.009274102634078
Energy: 1.0627713687183495
Energy: 1.0631751780592402
Energy: 1.227912444010546
Energy: 1.0632364297323393
Energy: 1.0627146916284915
Energy: 1.0435690506973028
Energy: 1.0633276745561249
Energy: 1.0613726124274483
Energy: 1.4304672785282977
Energy: 1.0440527907435013
Energy: 1.0481324147686235
Energy: 0.9635568570251255
Energy: 1.0439842164503739
Energy: 0.9627555095209137
Energy: 1.4261206327777063
Energy: 1.0447754070749375
Energy: 0.9634181758716394
Energy: 0.9635897466579763
Energy: 1.0440294045000833
Energy: 0.9639377692130385
Energy: 1.2304567169238738
Energy: 1.0438897825267364
Energy: 1.04400799522423
Energy: 1.0638427338221292
Energy: 1.044043181367935
Energy: 1.0438019360774964
Energy: 1.2191896934475257
Energy: 1.0436813408958145
Energy: 1.043861812620534
Energy: 1.0499312186787517
Energy: 1.043676568044569
Energy: 1.043918555637959
Energy: 1.2137899918500954
Energy: 1.0434646160791912
Energy: 1.0436889736815032
Energy: 1.0498169319871016
Energy: 1.043640870391938
Energy: 1.0432622102992017
Energy: 1.2289069908770291
Energy: 1.009431442943905
Energy: 1.0835429040246567
Energy: 1.0631401769789817
Energy: 1.0092167937730603
Energy: 1.0836573076108242
Energy: 1.2226209479141004
Energy: 1.0822898175684366
Energy: 1.0611588025202792
Energy: 1.0631362350069407
Energy: 1.044286742539844
Energy: 1.0621776103295695
Energy: 1.2283866203582465
Energy: 1.0838785204001513
Energy: 1.083857714113652
Energy: 1.0623646198399068
Energy: 1.022866324084158
Energy: 1.0849105413867464
Energy: 1.191058512374113
Energy: 0.9653152598795524
Energy: 0.9650319088211471
Energy: 1.19068790924548
Energy: 0.963781438670438
Energy: 1.0267490385865152
Energy: 1.0439867458827745
Energy: 1.0258429667405766
Energy: 1.0461614713526033
Energy: 1.0441514231235638
Energy: 1.0390696774511818
Energy: 1.0439536905514901
Energy: 1.043682781963376
Energy: 1.0452761530180024
Energy: 1.043786374054004
Energy: 1.0436648032856735
Energy: 1.0641815135050487
Energy: 1.0435910886733841
Energy: 1.1919708113943233
Energy: 1.0499096648075121
Energy: 1.049918670586375
Energy: 1.0436396564631543
Energy: 1.0499667290557775
Energy: 1.0437792917001723
Energy: 1.227565892629713
Energy: 1.0630749208586283
Energy: 1.0827715727268203
Energy: 1.0434533319118016
Energy: 1.065912409870758
Energy: 1.0835627744383531
Energy: 1.00924094217416
Energy: 1.0622200605477101
Energy: 1.0599866498453896
Energy: 1.0093766810670237
Energy: 1.0627048665975083
Energy: 1.085185016232012
Energy: 1.1916808459545953
Energy: 1.0616314931836868
Energy: 1.0606703409998446
Energy: 1.0234991662800277
Energy: 1.0622904805251894
Energy: 1.0604635751091092
Energy: 1.4278789552343447
Energy: 1.0448516785996906
Energy: 0.9844599517153552
Energy: 0.9636084096020817
Energy: 1.045151567037952
Energy: 0.9636361815345741

minimum gb energy = 0.9627555095209137 eV
minimum distance =  2.37183405216558 Angstroms
sigma value = 27


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

Energy: 1.2174711377728284
Energy: 1.1240617412761822
Energy: 1.2480616429707945
Energy: 1.056148363131594
Energy: 1.81340820612923
Energy: 1.2478232025470275
Energy: 1.1025490671702165
Energy: 1.0562643558062992
Energy: 0.9735606970379903
Energy: 0.9748947663874737
Energy: 1.056036558364059
Energy: 0.9714326385041884
Energy: 1.0990403148347656
Energy: 1.0555903790547347
Energy: 0.9956138436276467
Energy: 0.9726654989566146
Energy: 1.055202105530001
Energy: 1.0002210060004546
Energy: 0.968958749135932
Energy: 0.9954165506925331
Energy: 0.9952862362252443
Energy: 0.972771503564879
Energy: 1.0550983970197172
Energy: 0.9733867234592891
Energy: 1.2157199700004957
Energy: 0.9169159534649978
Energy: 0.972073986957007
Energy: 1.0308156646262412
Energy: 0.9169353101342786
Energy: 0.9718956224067118
Energy: 1.052712335885454
Energy: 0.9181305297076887
Energy: 0.9165595802885272
Energy: 1.0529812490587702
Energy: 0.9193129976498077
Energy: 0.9172862081200246
Energy: 1.05723653184327
Energy: 0.9723161971934391
Energy: 0.9727805021379958
Energy: 1.0576403809574801
Energy: 0.9725786069850507
Energy: 0.9985311951796989
Energy: 1.0564752952550753
Energy: 0.9691905665387928
Energy: 0.9844762364219376
Energy: 1.0564537785736112
Energy: 0.9689852414242085
Energy: 0.9877061887086429
Energy: 1.0987280999253257
Energy: 0.9676513620013498
Energy: 0.9766866904379267
Energy: 1.0565824450109123
Energy: 0.9666757501039379
Energy: 0.9983231906798012
Energy: 1.1014541096119694
Energy: 0.994792895447557
Energy: 0.9644698876171178
Energy: 0.9956681548660089
Energy: 0.9955267758560974
Energy: 0.9667698642941154
Energy: 1.0988797234464045
Energy: 0.9965922343991579
Energy: 0.9974016662025986
Energy: 0.9954636104939714
Energy: 1.0337841941990142
Energy: 0.9958269400233114
Energy: 1.0994180324991132
Energy: 0.9984790705652239
Energy: 0.9718508530513504
Energy: 0.9734945696640782
Energy: 1.0003021163507695
Energy: 0.9716855501737747

minimum gb energy = 0.9165595802885272 eV
minimum distance =  2.30716973451378 Angstroms
sigma value = 9


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

Energy: 2.0571093605442066
Energy: 0.944923856286469
Energy: 0.8618603459834956
Energy: 0.9314592854039249
Energy: 0.9353050782256338
Energy: 0.8530468560866646
Energy: 0.8735700008633752
Energy: 0.9040506149754902
Energy: 0.9099416967707608
Energy: 0.8944709265975426
Energy: 0.9197977238663149
Energy: 0.8935316371670272
Energy: 0.9434176193323415
Energy: 0.9207295292287037
Energy: 0.871773318798952
Energy: 0.9179137977350125
Energy: 0.9195658491076
Energy: 0.8846947664770474
Energy: 0.9439023579367498
Energy: 0.8820642208065259
Energy: 0.881232123521961
Energy: 0.9057143872342546
Energy: 0.902427049231954
Energy: 0.8808646716422742
Energy: 1.0167238931469031
Energy: 0.9254797804102842
Energy: 0.8993682152956789
Energy: 0.9515102637225932
Energy: 0.9245200918826966
Energy: 0.8836230149496818
Energy: 0.9513118656198306
Energy: 0.9030456166015415
Energy: 0.9012852434040302
Energy: 0.9513347926676805
Energy: 0.8858327990848549
Energy: 0.8517005840846764
Energy: 0.9518544187372822
Energy: 0.8836200902381122
Energy: 0.8825714088705272
Energy: 0.9525025863449555
Energy: 0.8821393397167661
Energy: 0.9546911593728107
Energy: 0.974788745479729
Energy: 0.9108467987537469
Energy: 0.9400070066797558
Energy: 0.9747881320914944
Energy: 0.9037189661688285
Energy: 0.8719005460417093
Energy: 1.105395912192776
Energy: 0.9383117152009388
Energy: 0.8832258889535258
Energy: 0.96474902844275
Energy: 0.9383266089192933
Energy: 0.8891579234525521
Energy: 0.8717433676704278
Energy: 0.927411974386861
Energy: 0.8858174812495696
Energy: 0.8842922450253858
Energy: 0.9384124893840187
Energy: 0.916154633370238
Energy: 0.8719378709186619
Energy: 0.9522301813936842
Energy: 0.9363668844991382
Energy: 0.8894287835115816
Energy: 0.9520578363005968
Energy: 0.8984330987643872
Energy: 1.1218627272403965
Energy: 0.9521099198248235
Energy: 0.9523295999165241
Energy: 0.8988986658109777
Energy: 0.9519749757191028
Energy: 0.9089355909602845
Energy: 1.2536493356215284
Energy: 0.9464400020991448
Energy: 0.8972122183463865
Energy: 0.8733761425351809
Energy: 1.1197270674565714
Energy: 0.8681344437645453
Energy: 1.1193459647085984
Energy: 0.9517011243432394
Energy: 0.8991543794398063
Energy: 0.8989813805712773
Energy: 0.9514608142560167
Energy: 0.909529946540133
Energy: 0.9197182434509926
Energy: 0.912745334050673
Energy: 0.9136508589568083
Energy: 0.9196983325689321
Energy: 0.9159748170315458
Energy: 0.9521939606918599
Energy: 0.919566785120502
Energy: 0.8809087540308671
Energy: 0.8814848081679703
Energy: 0.9213746127830048
Energy: 0.9283109414898381
Energy: 0.8982200965217416
Energy: 0.91829161059848
Energy: 0.8966380345605677
Energy: 0.8800831862542811
Energy: 0.9182939167426446
Energy: 0.896513606848912
Energy: 0.9002149910621484
Energy: 0.9427248943744263
Energy: 0.8960584435639892
Energy: 0.880988094651358
Energy: 0.9180471348806732
Energy: 0.9138952992105515
Energy: 0.9104676588837269
Energy: 0.944417649249144
Energy: 0.8946713958633307
Energy: 0.894486326708233
Energy: 0.9186260468032388
Energy: 0.8946286180825322
Energy: 0.8845701647752602
Energy: 0.9430415396548176
Energy: 0.9022142780128313
Energy: 0.8755538691599009
Energy: 0.9011863330705482
Energy: 0.9014806152812249
Energy: 0.8715822187679275
Energy: 0.9427039126079702
Energy: 0.8750736634240976
Energy: 0.8806297265036799
Energy: 0.9008165332251835
Energy: 0.8983964601655441
Energy: 0.8882359111822076
Energy: 0.9911762345968657
Energy: 0.91233513913221
Energy: 0.9539435211529663
Energy: 0.9280000642231867
Energy: 0.9193581975310852
Energy: 0.9170044046332192
Energy: 0.9872715992059294
Energy: 0.9011238206453936
Energy: 0.9060843867679246
Energy: 0.924906651736006
Energy: 0.9198514857937052
Energy: 0.8567151910311206
Energy: 0.9423542718886724
Energy: 0.9030029313725351
Energy: 0.8971411753100508
Energy: 0.9381136316977686
Energy: 0.9199276159339507
Energy: 0.8839779006492242
Energy: 1.2628793780320249
Energy: 0.9033034355267633
Energy: 0.910890612418983
Energy: 0.9151052467699834
Energy: 0.9212075615178815
Energy: 0.9331411921979489
Energy: 0.9427189122481392
Energy: 0.89922923308639
Energy: 0.883203459863947
Energy: 0.9527046236559981
Energy: 0.8996470446219195
Energy: 0.9007544066192611
Energy: 0.9381669757547052
Energy: 0.8986028184802562
Energy: 0.8938557582975049
Energy: 0.9383828050202201
Energy: 0.9016384733404319
Energy: 0.9023797209255779
Energy: 0.9518228743106611
Energy: 0.8830437580199335
Energy: 0.8827452493542215
Energy: 0.9516252426140627
Energy: 0.8997900582934493
Energy: 0.9550373153921548
Energy: 0.9519806701113832
Energy: 0.9202040677397245
Energy: 0.8848259106168029
Energy: 0.9518868635422123
Energy: 0.9178796601694006
Energy: 0.9372820695076824
Energy: 0.9258059512046117
Energy: 0.9101218735088967
Energy: 0.9392332039487922
Energy: 0.9073874347881917
Energy: 0.9039599454644194
Energy: 0.8824482096634971
Energy: 0.8721417039005578
Energy: 0.927219425210841
Energy: 0.8845858458617369
Energy: 0.9145459803004733
Energy: 0.9382474941462712
Energy: 0.8939353716540069
Energy: 0.8805122065138613
Energy: 0.9508099336348027
Energy: 0.9355719102673603
Energy: 0.8839225383975311
Energy: 0.9507617183221261
Energy: 0.8981953315413352
Energy: 1.1198539496475854
Energy: 0.9517794130192488
Energy: 0.9517542341941697
Energy: 0.9498752292830509
Energy: 0.9527717961024901
Energy: 0.8827343640329698
Energy: 0.9362414606653937
Energy: 0.9519705484810728
Energy: 0.9525875742238681
Energy: 0.9161318907748607
Energy: 0.9518191522470294
Energy: 0.8849568782255108
Energy: 0.9306328065210793
Energy: 0.9516800896141622
Energy: 0.8991395292341562
Energy: 0.9136174573376922
Energy: 0.9521570172048998
Energy: 0.8996948834106046
Energy: 0.9327841781671401
Energy: 0.917815723504335
Energy: 0.8863961787202828
Energy: 0.934037175206457
Energy: 0.9214726949487795
Energy: 0.8705511455742567
Energy: 0.9185615096285505
Energy: 0.9100101133054689
Energy: 0.883659368870721
Energy: 0.9198940105475406
Energy: 0.9219869754877174
Energy: 0.8866029970780309
Energy: 0.9184108021574814
Energy: 0.8967190786141459
Energy: 0.8895068846943397
Energy: 0.9184091032330942
Energy: 0.8938701396935653
Energy: 0.8947319413239483
Energy: 0.971175961092159
Energy: 0.8802584747776474
Energy: 0.8747016280422824
Energy: 0.90360866355042
Energy: 0.8798918301183165
Energy: 0.9094533154720019
Energy: 0.9421082321171537
Energy: 0.8921342401493834
Energy: 0.8896821120175689
Energy: 0.9183105715602037
Energy: 0.8955422862965688
Energy: 0.8851854077695567
Energy: 0.9425263238772532
Energy: 0.8903316801725863
Energy: 0.8861585535444647
Energy: 0.8971232841183628
Energy: 0.9033525056638364
Energy: 0.8859050074563363
Energy: 0.9445559531055657
Energy: 0.9033089496919778
Energy: 0.8788844377221874
Energy: 0.8953692671792037
Energy: 0.9030199691402844
Energy: 0.8719298667409643
Energy: 0.9877009152587909
Energy: 0.9014589525914221
Energy: 0.8905266060104287
Energy: 0.9248986923974241
Energy: 0.9198625994420704
Energy: 0.8564771294152844

minimum gb energy = 0.8517005840846764 eV
minimum distance =  2.30073039414214 Angstroms
sigma value = 57


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

Energy: 0.7622708125338514
Energy: 0.7124554595915976
Energy: 0.7376571659124922
Energy: 0.7517604083099867
Energy: 0.7727769925092205
Energy: 0.754900809628513
Energy: 0.7632676978249797
Energy: 0.7555494457207144
Energy: 0.7570963865978614
Energy: 0.7947776091077536
Energy: 0.7957805533019339
Energy: 0.7826186954698958
Energy: 0.93891581340565
Energy: 0.7892482081127603
Energy: 0.7892421239547077
Energy: 0.7953512088474055
Energy: 0.8293016888510222
Energy: 0.7893614113915358
Energy: 0.9390902376718889
Energy: 0.7554199009079948
Energy: 0.7881067104120425
Energy: 0.7927531307486273
Energy: 0.7735805187342965
Energy: 0.7873441852534363
Energy: 0.9088735467454643
Energy: 0.4567848284289468
Energy: 0.4561151214133245
Energy: 0.8613581461426187
Energy: 0.45331500863307655
Energy: 0.7551157790803866
Energy: 0.8998771587086185
Energy: 0.45460454490362595
Energy: 0.45645051532986103
Energy: 0.7552721651037089
Energy: 0.45259575688258036
Energy: 0.45596185744121026
Energy: 0.9015253452534635
Energy: 0.7859941319659868
Energy: 0.7870266709905125
Energy: 0.8333387432062745
Energy: 0.7855102196219234
Energy: 0.7870574864138549
Energy: 0.9035626428496455
Energy: 1.026605128982833
Energy: 0.7970304728748245
Energy: 0.8374751377348293
Energy: 1.0246991912047452
Energy: 0.7887769531182873
Energy: 0.9155878487382839
Energy: 0.754850207096549
Energy: 0.7560347686595865
Energy: 0.9773538837862948
Energy: 0.7871811240894716
Energy: 0.7552375768710016
Energy: 0.45175279909492616
Energy: 0.7875577204778034
Energy: 0.4552149618653875
Energy: 0.45219433951981164
Energy: 0.9801826030641406
Energy: 0.48521083982918345
Energy: 0.45183004757109857
Energy: 0.968199007595692
Energy: 0.788295998692864
Energy: 0.4525109988739333
Energy: 0.9686893405084184
Energy: 0.45511587354601013
Energy: 0.9179902448803988
Energy: 0.7866844555956912
Energy: 0.7812712661822963
Energy: 0.9562245594550148
Energy: 0.7886612375339782
Energy: 0.7821306761179315
Energy: 0.9173748733361463
Energy: 0.7916519687696825
Energy: 0.7847735651566236
Energy: 0.8268091835719135
Energy: 0.8387456332359707
Energy: 0.7557938376304605
Energy: 0.9161204456692846
Energy: 0.7937558628261502
Energy: 0.7878068894323811
Energy: 0.8345000732629398
Energy: 0.8340427504071808
Energy: 0.7854217655740475
Energy: 0.9152473455310576
Energy: 0.45331342857581447
Energy: 0.453591464871503
Energy: 0.7958941547127809
Energy: 0.45719337736590104
Energy: 0.45364920959136135
Energy: 0.8972657021391071
Energy: 0.7876567417615276
Energy: 0.7888820348864019
Energy: 0.8331816730868307
Energy: 0.4540843337644449
Energy: 0.758655170383285
Energy: 0.9495539351891442
Energy: 0.7664668504307391
Energy: 0.7904898499917203
Energy: 0.7941669126427363
Energy: 0.755000194015767
Energy: 0.782508271932588
Energy: 0.9380585886752807
Energy: 0.7905224514734145
Energy: 0.764153479889182
Energy: 0.7625019804314206
Energy: 0.8150148245074766
Energy: 0.7855791840457819
Energy: 0.763219064762931
Energy: 0.7553518557836433
Energy: 0.7557838072385757
Energy: 0.7504160683761637
Energy: 0.7956370111252135
Energy: 0.7564340591214423

minimum gb energy = 0.45175279909492616 eV
minimum distance =  2.31828557764619 Angstroms
sigma value = 11


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

Energy: 1.719016346540502
Energy: 0.7777491130866911
Energy: 0.8768693423979492
Energy: 0.8131050645165381
Energy: 0.7684464294675994
Energy: 0.8736475871987879
Energy: 0.7900008305634408
Energy: 0.7849515050447333
Energy: 0.7896881195912374
Energy: 0.7818725566720138
Energy: 0.7714216429971594
Energy: 0.7929911303522346
Energy: 0.7694721760404075
Energy: 0.7810584649291422
Energy: 0.7842010196613092
Energy: 0.7712992911230783
Energy: 0.7798459877057073
Energy: 0.7746805985729495
Energy: 0.770881436782804
Energy: 0.7877081328827494
Energy: 0.7905915146612871
Energy: 0.7723221108985323
Energy: 0.7771757439830992
Energy: 0.7847559016059434
Energy: 0.7703996109491609
Energy: 0.8474654208732418
Energy: 0.8461293036476508
Energy: 0.79486731041224
Energy: 0.830522235958464
Energy: 0.7806025884173998
Energy: 0.8292455709836069
Energy: 0.8257069312684822
Energy: 0.8236227570429111
Energy: 0.7985874056216286
Energy: 0.7815393637859243
Energy: 0.847356796086283
Energy: 0.8278002189578084
Energy: 0.7771862289430878
Energy: 0.7802239751379998
Energy: 0.7710869873850541
Energy: 0.781452761640675
Energy: 0.7788969774050761
Energy: 0.7895744599886223
Energy: 0.7837256245800873
Energy: 0.7761801095068128
Energy: 0.8076719201754365
Energy: 0.7829139535637603
Energy: 0.7810113217745197
Energy: 0.8304889008064563
Energy: 0.807892388939823
Energy: 0.8302769664600621
Energy: 0.7891016974898395
Energy: 0.7741478570474669
Energy: 0.8285450765546584
Energy: 0.886804036142501
Energy: 0.8136611721019368
Energy: 0.8485985619088495
Energy: 0.768288327599753
Energy: 0.8166736823777108
Energy: 0.8209538102651659
Energy: 0.883380315899412
Energy: 0.8136967380798553
Energy: 0.8562334127327207
Energy: 0.7789485537048199
Energy: 0.8145889266617651
Energy: 0.8472468492230496
Energy: 0.8274607137235785
Energy: 0.7571506737595195
Energy: 0.7722578396778886
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Energy: 0.7508210185074861
Energy: 0.7917369791160486
Energy: 0.8876747334709408
Energy: 0.7473638178151061
Energy: 0.748706375891837
Energy: 0.7890858878542194
Energy: 0.7520306545146583
Energy: 0.7927476575916371
Energy: 0.8892612293817223
Energy: 0.849092433602606
Energy: 0.8486562651658818
Energy: 0.8130109096603502
Energy: 0.8139780485974719
Energy: 0.8488244398416459
Energy: 1.1563299545322654
Energy: 0.8011266546185835
Energy: 0.9476134259502935
Energy: 0.8320261332503932
Energy: 0.7927038837718374
Energy: 1.0062437999991238
Energy: 1.099924869345617
Energy: 0.8507792316954461
Energy: 0.8487543156047447
Energy: 0.8106140384040981
Energy: 0.8541230792346162
Energy: 0.8499711044731482
Energy: 1.2534048730717864
Energy: 0.814381119078116
Energy: 0.7609598459587995
Energy: 0.7562372853298103
Energy: 0.8320931421863949
Energy: 0.7613585113292869
Energy: 1.351711016855948
Energy: 0.8126155841949063
Energy: 0.8531246552100971
Energy: 0.8060579005989539
Energy: 0.8109657684317714
Energy: 0.8498322616484378
Energy: 1.1095104795198178
Energy: 0.7842427756065498
Energy: 0.8299429171904553
Energy: 0.7865153731773749
Energy: 0.7783274195872714
Energy: 0.822808687745353
Energy: 1.0332421062209796
Energy: 0.7796704130006548
Energy: 0.7923759377864443
Energy: 0.7780781011289882
Energy: 0.8948375420988218
Energy: 0.7947050689134352
Energy: 1.0998455447861606
Energy: 0.8510439714952028
Energy: 0.8124835022500339
Energy: 0.823298007303333
Energy: 0.8447440558379655
Energy: 0.816617446714939
Energy: 1.0813510595106024
Energy: 0.7764719038140078
Energy: 0.7616098346706396
Energy: 1.106929611144762
Energy: 0.803212258433269
Energy: 0.8579684396931975
Energy: 0.7715981375319709
Energy: 0.826399134061055
Energy: 0.8110313984496315
Energy: 0.7849536765236315
Energy: 0.784246701561762
Energy: 0.8173143569030236
Energy: 0.7749818854143422
Energy: 0.7795011289645868
Energy: 0.7740709921865557
Energy: 0.7764747137508922
Energy: 0.7748331130782586
Energy: 0.7818147960266848
Energy: 0.7696419088390722
Energy: 0.7768150731082923
Energy: 0.7982124547120083
Energy: 0.7746491260488205
Energy: 0.7720965050044281
Energy: 0.7919949643817092
Energy: 0.8724257449814563
Energy: 0.7883427275296518
Energy: 0.8328129478400091
Energy: 0.7669046704827206
Energy: 0.782125414223914
Energy: 0.846166502726631

minimum gb energy = 0.7473638178151061 eV
minimum distance =  2.31229665363817 Angstroms
sigma value = 41


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

Energy: 1.6397440964486778
Energy: 0.8759793457304595
Energy: 0.8691955443367175
Energy: 0.8995861324591282
Energy: 0.945833681515006
Energy: 0.8294984983277369
Energy: 0.8675743443068966
Energy: 0.8583710904744304
Energy: 0.8589082158566788
Energy: 0.8447719446259432
Energy: 0.8422557376984199
Energy: 0.838841068641786
Energy: 0.8381199115924098
Energy: 0.8420222036147732
Energy: 0.8401954121283264
Energy: 0.8404986077309557
Energy: 0.8452476063072811
Energy: 0.8394196958712888
Energy: 0.8385995141394282
Energy: 0.854294937192807
Energy: 0.8503128395074153
Energy: 0.8404591629069008
Energy: 0.8436270207578535
Energy: 0.8486890249701057
Energy: 0.8377983485665333
Energy: 0.8607177069742483
Energy: 0.8605684212566128
Energy: 0.8532356929965008
Energy: 0.8615791515981115
Energy: 0.8545995962328794
Energy: 0.9272629567386823
Energy: 0.8500056159517982
Energy: 0.8497074199521851
Energy: 0.8546040916959191
Energy: 0.844926428035312
Energy: 0.8507359162836745
Energy: 0.9297320966297212
Energy: 0.843292482930113
Energy: 0.847971394781158
Energy: 0.8374487889062827
Energy: 0.8586123757590955
Energy: 0.8483310118036619
Energy: 0.8684648170694265
Energy: 0.8735740563841214
Energy: 0.8747149006468625
Energy: 0.8035040498970782
Energy: 0.8731094207780696
Energy: 0.8167930765167764
Energy: 0.9284878308373359
Energy: 0.8480112754591694
Energy: 0.8518024418687848
Energy: 0.8599732919707918
Energy: 0.8465102984934987
Energy: 0.8513154982833643
Energy: 0.9290246023102233
Energy: 0.8529974185951796
Energy: 0.8589139542378386
Energy: 0.8387680702295096
Energy: 0.8582450799080059
Energy: 0.8498569269127956
Energy: 0.9297175786029536
Energy: 0.8546406442139656
Energy: 0.852845560036007
Energy: 0.8412121511539509
Energy: 0.8587736977738921
Energy: 0.8507878436081583
Energy: 0.9288531307483575
Energy: 0.8181951746350669
Energy: 0.8033003123334814
Energy: 0.8593173521822491
Energy: 0.8025121063059628
Energy: 0.850105984868413
Energy: 0.8418064730112229
Energy: 0.8018984783991601
Energy: 0.8026456795569028
Energy: 0.8567596909705528
Energy: 0.8027592839358973
Energy: 0.804407579544952
Energy: 0.8412729699994049
Energy: 0.8579625114389258
Energy: 0.8511212002402485
Energy: 0.8449687031709214
Energy: 0.8584019417811132
Energy: 0.8503714323226974
Energy: 0.8737852614238562
Energy: 0.8614147334445745
Energy: 0.8720479905311201
Energy: 0.8739601351784345
Energy: 0.8474666919038293
Energy: 0.8708069956127458
Energy: 0.8362845775508311
Energy: 0.8527870613625143
Energy: 0.8493153605392246
Energy: 0.8588832156636791
Energy: 0.865631181239729
Energy: 0.8484460123668811
Energy: 1.2704710068312564
Energy: 0.8602225249381175
Energy: 0.8318354414207653
Energy: 0.8053505599676088
Energy: 0.8630543091019516
Energy: 0.8040923091864488
Energy: 0.8680303219612024
Energy: 0.8604312699848398
Energy: 0.8613259235938856
Energy: 0.8180230878780628
Energy: 0.8642353748155468
Energy: 0.8341364564298903
Energy: 0.8376133050790043
Energy: 0.8443592200298998
Energy: 0.8428985532336278
Energy: 0.8398412329239817
Energy: 0.8438571507321538
Energy: 0.8398671068698159
Energy: 0.8379201897317253
Energy: 0.8420859158926164
Energy: 0.8386694584242068
Energy: 0.8404758586782328
Energy: 0.8441840440153011
Energy: 0.8403342456995708
Energy: 0.8366462925257797
Energy: 0.8413581509324441
Energy: 0.8384204374791271
Energy: 0.8645166799091534
Energy: 0.8433287796835577
Energy: 0.8385798020395973
Energy: 1.2907698682262516
Energy: 0.8592512952912165
Energy: 0.859403325576637
Energy: 1.2903293624617242
Energy: 0.8401877401087563
Energy: 0.8622129245852869
Energy: 0.9285593544970677
Energy: 0.8476064318413482
Energy: 0.8476326856429743
Energy: 0.8523232892640596
Energy: 0.843463449769897
Energy: 0.8493862010750172
Energy: 0.8682839085127976
Energy: 0.8409327692040577
Energy: 0.8467146250082739
Energy: 0.8650684395822854
Energy: 0.8419267401205305
Energy: 0.8171997231273292
Energy: 0.9297875858332337
Energy: 0.8434346785519555
Energy: 0.8480168052290671
Energy: 0.8538641438226987
Energy: 0.8442597239575614
Energy: 0.8504611262384687
Energy: 0.9292379908902408
Energy: 0.8588744458889918
Energy: 0.8533447874192942
Energy: 0.8402703318907482
Energy: 0.8606196023202485
Energy: 0.8407320090525896
Energy: 0.9292136034215396
Energy: 0.8592412328923219
Energy: 0.851290349693708
Energy: 0.8380170568580867
Energy: 0.8599693712989787
Energy: 0.8503088584414659
Energy: 1.1830578959064684
Energy: 0.8323167589528246
Energy: 0.9178565958083738
Energy: 0.8602495091750526
Energy: 0.8185885608366937
Energy: 0.8611274371449661
Energy: 0.8422050835008985
Energy: 0.8013074082040506
Energy: 0.8036331787969042
Energy: 0.8602620807813973
Energy: 0.8021427220131607
Energy: 0.8061223723238401
Energy: 0.9330424012854212
Energy: 0.8594085954661355
Energy: 0.8530328824124118
Energy: 0.8491830845869487
Energy: 0.8592480370145682
Energy: 0.8620263108062364
Energy: 0.8398214226793407
Energy: 0.8395612821876492
Energy: 0.8378423731604852
Energy: 0.8398826486492081
Energy: 0.844608065854027
Energy: 0.8392267761915423
Energy: 0.8362635454475964
Energy: 0.8417687990989093
Energy: 0.8500946710471547
Energy: 0.8452689370046153
Energy: 0.8405226086958486
Energy: 0.8414306633290155
Energy: 0.9861504024934098
Energy: 0.8605300775736774
Energy: 0.8333581057985633
Energy: 0.8097699760213172
Energy: 0.861394068644716
Energy: 0.8330454995300581

minimum gb energy = 0.8013074082040506 eV
minimum distance =  2.32026509015954 Angstroms
sigma value = 33


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

Energy: 1.0704357780717106
Energy: 0.8882439175410619
Energy: 0.8881632877908359
Energy: 0.8816184268621301
Energy: 0.9005145075567218
Energy: 0.8888424001284696
Energy: 0.9577411235995685
Energy: 0.9185578043664603
Energy: 0.9169775099914137
Energy: 0.8960751406710923
Energy: 0.9170036397821243
Energy: 0.8953653139706479
Energy: 0.9151111534493214
Energy: 0.8942235576898973
Energy: 0.8972438541583372
Energy: 0.9155393834152565
Energy: 0.8939888971067879
Energy: 0.8995542284705994
Energy: 0.9189577117646341
Energy: 0.9145289050937312
Energy: 0.895155799915117
Energy: 0.9205331622394491
Energy: 0.8930428925747974
Energy: 0.8952321900027436
Energy: 0.9181208523330399
Energy: 0.9179946491485854
Energy: 0.8676453147793902
Energy: 0.9394921280189636
Energy: 0.9174989284919283
Energy: 0.8669744627376001
Energy: 0.9604751691477128
Energy: 0.8959114035849819
Energy: 0.8951199772396035
Energy: 0.8709339692172786
Energy: 0.9007722154104805
Energy: 0.8976374821604541
Energy: 0.9591526607789193
Energy: 0.8957110360299114
Energy: 0.8949135802511158
Energy: 0.9140742649673507
Energy: 0.9186810352926001
Energy: 0.8929397161507515
Energy: 0.9552878857588236
Energy: 0.9171676000636313
Energy: 0.8810433748161689
Energy: 0.8643172356151247
Energy: 0.9566666667161682
Energy: 0.8815975193441392
Energy: 0.9579324231927461
Energy: 0.8920273357290709
Energy: 0.8667536566941851
Energy: 0.872383514571213
Energy: 0.8690925334507914
Energy: 0.8665216414410739
Energy: 1.0395741837994221
Energy: 0.8939061939815587
Energy: 0.8954050175412925
Energy: 0.8964670074971774
Energy: 0.8929089375880466
Energy: 0.8996856160350389
Energy: 0.9580771709776746
Energy: 0.8978414123244742
Energy: 0.8954324937977397
Energy: 0.9179894293737376
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Energy: 0.8937942009313955
Energy: 0.9577852710696626
Energy: 0.8639371682262127
Energy: 0.8637685339907183
Energy: 0.9392925986959795
Energy: 0.8702217041763529
Energy: 0.8631132416133992
Energy: 0.9707185483439821
Energy: 0.8635262244506156
Energy: 0.8633092866681149
Energy: 0.9385668144143449
Energy: 0.8736273699072866
Energy: 0.8631643324634022
Energy: 0.9128930524735887
Energy: 0.8967366332824206
Energy: 0.8943302903479056
Energy: 0.9147599061268574
Energy: 0.8950649474066468
Energy: 0.8929152123285181
Energy: 0.8640798009031493
Energy: 0.8957113320947856
Energy: 0.9163046440102863
Energy: 0.8947793744569341
Energy: 0.8956641339169087
Energy: 0.915159483618569
Energy: 0.9133318888641224
Energy: 0.9150151674037614
Energy: 0.8935491007982308
Energy: 0.9204312391588038
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Energy: 0.8943537781627058
Energy: 0.9606594528606195
Energy: 0.8993365277179514
Energy: 0.8943435016763286
Energy: 0.8934914546796542
Energy: 0.9760517838395968
Energy: 0.902745001485158
Energy: 0.9594928476312788
Energy: 0.8690051806639392
Energy: 0.8670280343912569
Energy: 0.9390146402518441
Energy: 0.8712084480047555
Energy: 0.8674301517262986
Energy: 0.9169347345220694
Energy: 0.8647296010207471
Energy: 0.86544814829655
Energy: 0.8974418688893389
Energy: 0.8669952541045204
Energy: 0.8924555557708467
Energy: 0.8675679724474223
Energy: 0.865152524045359
Energy: 0.8635798401457968
Energy: 0.8957045854298008
Energy: 0.8716711172207611
Energy: 0.8972083067562192
Energy: 0.8682710875985191
Energy: 0.86712470648131
Energy: 0.8675276808778626
Energy: 0.8669613934391559
Energy: 0.916492995415053
Energy: 0.8672245349662879
Energy: 0.9604340438802899
Energy: 0.9002959899365043
Energy: 0.9003581973315793
Energy: 0.959271066353733
Energy: 0.9013624314482754
Energy: 0.9164172797341069
Energy: 0.9125461375000479
Energy: 0.91626574228003
Energy: 0.9133336713566006
Energy: 0.8918253098319188
Energy: 0.9384886233025079
Energy: 0.8701378278401632
Energy: 0.9594621949548987
Energy: 0.9035606464190004
Energy: 0.863997794465044
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Energy: 0.8637202965764875
Energy: 0.9603208425933472
Energy: 0.920139393509282
Energy: 0.9187154479421298
Energy: 0.8901384697426065
Energy: 0.9193462530530973
Energy: 0.9147356266664316
Energy: 0.9204101673788203
Energy: 0.8955154401360451
Energy: 0.8994972746037955
Energy: 0.9218365980434966
Energy: 0.8946091072105925
Energy: 0.8998385946932639
Energy: 0.9145209790033935
Energy: 0.8958652529621774
Energy: 0.8939661039839331
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Energy: 0.8956000664144752
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Energy: 0.8679191757200269
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Energy: 1.0232166236691898
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Energy: 0.9006135708050517
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Energy: 0.8971952311117452
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Energy: 0.8972536678703459
Energy: 0.9215114652618134
Energy: 0.8964448815192617
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Energy: 0.9713288256887626
Energy: 0.8639171829234211
Energy: 0.8637276381034809
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Energy: 0.8643046785323536
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Energy: 0.897916966264293
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Energy: 0.8923849786943725
Energy: 0.894843312465381
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Energy: 0.8972979118494856
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Energy: 0.9179120209136645
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Energy: 0.8931146278725586
Energy: 0.8951422765219467
Energy: 0.9153590115111492
Energy: 0.8931159694534947
Energy: 1.0377991624531557
Energy: 0.874519320567617
Energy: 0.8679341989084352
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Energy: 0.9399916960377784
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Energy: 1.0385972649870059
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Energy: 0.871830271599391
Energy: 0.8675115308061355
Energy: 0.9138906376612581
Energy: 0.867472583680691
Energy: 0.8639895635478446
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Energy: 0.9672480108215035
Energy: 0.8946231385645821
Energy: 0.9233244970027464
Energy: 0.8639711925524365
Energy: 0.8966684881843744
Energy: 0.8958805844623098
Energy: 0.8666661585589063
Energy: 0.866064512965402
Energy: 0.8662491492178757
Energy: 0.8673554587658473
Energy: 0.8672382836772159
Energy: 0.8680099546059863
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Energy: 0.9568625625362882
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Energy: 0.9200831181843024
Energy: 0.9001847931490379
Energy: 0.9157448884698233
Energy: 0.912654739017271
Energy: 0.916021294958736
Energy: 0.8928740526988509
Energy: 0.918828960932105
Energy: 0.9388657601288739
Energy: 0.893552914017371
Energy: 1.1130000663587531
Energy: 0.8676749176516577
Energy: 0.8634904054372293
Energy: 0.8759999879259167
Energy: 0.9453228363700764
Energy: 0.8636887413865001

minimum gb energy = 0.8629621486584785 eV
minimum distance =  2.31509069456659 Angstroms
sigma value = 67


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

Energy: 1.2487564840943932
Energy: 0.9367599786063624
Energy: 0.9334032994457169
Energy: 0.9439127813995322
Energy: 0.9912750909079285
Energy: 0.9329877787047117
Energy: 1.046803586421468
Energy: 0.9464901238478477
Energy: 0.9443787145143837
Energy: 0.9482879152927265
Energy: 0.9507410684543898
Energy: 0.9447246822340167
Energy: 0.9864177757355682
Energy: 0.9028375732859175
Energy: 0.948458299984293
Energy: 0.9459244144363246
Energy: 0.9024289927192277
Energy: 0.948575741866399
Energy: 0.9866219667313695
Energy: 0.9425992092337594
Energy: 0.944835543558086
Energy: 0.9552868886401821
Energy: 0.9447260048823972
Energy: 0.9443975985713352
Energy: 0.9778810704385972
Energy: 0.9479370617251635
Energy: 0.9478268486186571
Energy: 0.97898181562059
Energy: 0.947871419378034
Energy: 0.948431964810866
Energy: 0.9791766438874794
Energy: 0.9417839309388819
Energy: 0.9520702140074773
Energy: 0.9808659959741299
Energy: 0.9411949412249448
Energy: 0.9531174692874207
Energy: 1.046485045298966
Energy: 0.9468844297327316
Energy: 0.9457669665344655
Energy: 0.9080097048119715
Energy: 0.9517216192524148
Energy: 0.9452188105030537

minimum gb energy = 0.9024289927192277 eV
minimum distance =  2.35629828677572 Angstroms
sigma value = 3


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

Energy: 1.6035373748047217
Energy: 1.1558280790023532
Energy: 1.0859038272567987
Energy: 1.0536889692523317
Energy: 1.1988840435719936
Energy: 1.0920439718940136
Energy: 1.0412420840906027
Energy: 1.0767369931865445
Energy: 1.0369394785284316
Energy: 1.0806747249656554
Energy: 1.0851235402092683
Energy: 1.036482707409306
Energy: 1.038405722910959
Energy: 1.0412633994224632
Energy: 1.0349924436327607
Energy: 1.0381679415613232
Energy: 1.0412924204077103
Energy: 1.0320504457158237
Energy: 1.0341503941842793
Energy: 1.0325418098069308
Energy: 1.0333583634484147
Energy: 1.03391409215336
Energy: 1.0320473077450654
Energy: 1.032649232691554
Energy: 1.0381218864772734
Energy: 1.0267826107342088
Energy: 1.026410641077035
Energy: 1.0395642112896508
Energy: 1.027871224471497
Energy: 1.02618316736645
Energy: 1.0248635486594793
Energy: 1.031048637695322
Energy: 1.026749939841834
Energy: 1.0269154159096299
Energy: 1.0334714305541695
Energy: 1.0259493354846185
Energy: 1.0305935884111574
Energy: 1.0748066261397082
Energy: 1.0756121111028025
Energy: 1.0412403990101693
Energy: 1.0949872831502894
Energy: 1.0719317827572048
Energy: 1.2065839694725835
Energy: 1.091384225680578
Energy: 1.065647803585119
Energy: 1.0270082179381257
Energy: 1.0977881673786998
Energy: 1.0644927576546899
Energy: 1.0313070525199886
Energy: 1.0341862808704387
Energy: 1.0718638958622932
Energy: 1.0448504724623036
Energy: 1.0663765127812486
Energy: 1.072153154403696
Energy: 1.025758261817148
Energy: 1.0235762537417774
Energy: 1.0239737546383738
Energy: 1.0954660408310302
Energy: 1.022892742755017
Energy: 1.0342693276337949
Energy: 1.1093654552933994
Energy: 1.0573483064923779
Energy: 1.0658794808242151
Energy: 1.1119305918654365
Energy: 1.033259035952355
Energy: 1.076299922363811
Energy: 1.1096984082637162
Energy: 1.028284631285165
Energy: 1.0265328856245748
Energy: 1.0831430254067702
Energy: 1.0321059052195551
Energy: 1.0267942012842437
Energy: 1.0597490820973707
Energy: 1.0272372181412806
Energy: 1.0259833100427844
Energy: 1.0708068927321568
Energy: 1.0279048059482223
Energy: 1.0272044812982042
Energy: 1.0491395554013956
Energy: 1.0326763149989948
Energy: 1.0289064909951555
Energy: 1.0283188567770898
Energy: 1.0301466602369227
Energy: 1.0335641833830174
Energy: 1.1103800157888513
Energy: 1.042059604029422
Energy: 1.0739005909412116
Energy: 1.0300841810691275
Energy: 1.0351582935626613
Energy: 1.0402384469702224
Energy: 1.116367057865687
Energy: 1.077259012447385
Energy: 1.0772536977569827
Energy: 1.0810951498993553
Energy: 1.0806625466292814
Energy: 1.0774058340600863
Energy: 1.2018555042629167
Energy: 1.0295137131789995
Energy: 1.028929869007462
Energy: 1.2026413144303625
Energy: 1.030053937871915
Energy: 1.0759227579008892
Energy: 1.093916689876461
Energy: 1.0733581826659528
Energy: 1.0974767021634246
Energy: 1.099234497866176
Energy: 1.0777260507276332
Energy: 1.0482440114095184
Energy: 1.2450606424463768
Energy: 1.0330629970336005
Energy: 1.0332865110372917
Energy: 1.0208307352152632
Energy: 1.063790023423771
Energy: 1.0251542902365944
Energy: 1.1544859047019265
Energy: 1.0349563964454107
Energy: 1.0361785715221938
Energy: 1.0214309670093111
Energy: 1.0456622891940657
Energy: 1.0250089373693843
Energy: 1.0564229757278865
Energy: 1.0576996847857494
Energy: 1.0592768259299001
Energy: 1.0511238209142295
Energy: 1.0545718574056644
Energy: 1.0471419489382836
Energy: 1.0415060411885166
Energy: 1.0577706103844013
Energy: 1.046553265782099
Energy: 1.047786844859412
Energy: 1.0570615475613634
Energy: 1.046845407367596
Energy: 1.0428703347215273
Energy: 1.0550755995426377
Energy: 1.0488152074416952
Energy: 1.0433431736111445
Energy: 1.054752960171648
Energy: 1.0553062103099256
Energy: 1.0509968585772322
Energy: 1.0385742591495548
Energy: 1.0390942383616832
Energy: 1.0510261723328649
Energy: 1.0382240683615698
Energy: 1.0605604784160945
Energy: 1.0303421723707984
Energy: 1.0654480365876315
Energy: 1.0640183315971417
Energy: 1.0842232768903062
Energy: 1.0711800869280292
Energy: 1.0314606893350506
Energy: 1.2482162635203888
Energy: 1.0375253969472273
Energy: 1.124554422030061
Energy: 1.0328068017648688
Energy: 1.0982247948800328
Energy: 1.0361007871809362
Energy: 1.0215659374424522
Energy: 1.0858679086144594
Energy: 1.063723969972313
Energy: 1.031437023011604
Energy: 1.1083063443942271
Energy: 1.0320877076188029
Energy: 1.0305832731987228
Energy: 1.0650135561678047
Energy: 1.0589602737169868
Energy: 1.0728443978056519
Energy: 1.034869708359934
Energy: 1.0285967369445053
Energy: 1.0335823020089436
Energy: 1.042584418348309
Energy: 1.036433068773349
Energy: 1.033773606458942
Energy: 1.042334775859396
Energy: 1.0367047377292056
Energy: 1.026427049267646
Energy: 1.0256441571368466
Energy: 1.0251700145526847
Energy: 1.0289688608638734
Energy: 1.0698792620789899
Energy: 1.0259109579807617
Energy: 1.0251436847484576
Energy: 1.030042496581507
Energy: 1.0295942473996607
Energy: 1.02757953496637
Energy: 1.0287441864485842
Energy: 1.0279268736898455
Energy: 1.0356981347306413
Energy: 1.0725874953091983
Energy: 1.0637889104821943
Energy: 1.0446964861376749
Energy: 1.0794677825498717
Energy: 1.0298421367974655
Energy: 1.2039340767531004
Energy: 1.0842541014509008
Energy: 1.0854801097796665
Energy: 1.0283940395969973
Energy: 1.111308264403871
Energy: 1.0339424980630818
Energy: 1.152837041350124
Energy: 1.0315856249881308
Energy: 1.027621481725443
Energy: 1.026554486254991
Energy: 1.1022140404350704
Energy: 1.0255635002068941
Energy: 1.025627798155098
Energy: 1.0320939866894236
Energy: 1.032129179882082
Energy: 1.032714458785114
Energy: 1.067913236005038
Energy: 1.0258968986685035
Energy: 1.1088557095388114
Energy: 1.0227817028182091
Energy: 1.0232780323165263
Energy: 1.110411041876004
Energy: 1.022988183944626
Energy: 1.0334749781153643
Energy: 1.1084235011465933
Energy: 1.0344995476634977
Energy: 1.0330421090142052
Energy: 1.0847628124547954
Energy: 1.0436660876238808
Energy: 1.0768935130995494
Energy: 1.0602442730060673
Energy: 1.032483764455799
Energy: 1.030949964483808
Energy: 1.0204046098028174
Energy: 1.033715143405699
Energy: 1.0295591543779459
Energy: 1.0550004705604872
Energy: 1.0277655898538416
Energy: 1.0271535324016927
Energy: 1.0787504657742595
Energy: 1.0288012092856758
Energy: 1.0255868828522121
Energy: 1.1082676815682881
Energy: 1.035566698794511
Energy: 1.0350080902896577
Energy: 1.0256322332954326
Energy: 1.0350797011653792
Energy: 1.0369463673661703
Energy: 1.2005751300613663
Energy: 1.029807460532896
Energy: 1.0297441333858417
Energy: 1.0749385869042596
Energy: 1.0751384342331152
Energy: 1.0290903318013507
Energy: 1.2130510960607472
Energy: 1.0544465569462051
Energy: 1.027566569005686
Energy: 1.1343271511766828
Energy: 1.027946811869405
Energy: 1.0499915753684108
Energy: 1.1557562241712422
Energy: 1.029201406369454
Energy: 1.0272164838825815
Energy: 1.169487215220135
Energy: 1.0285353194337017
Energy: 1.0777046482950257
Energy: 1.0424516615352677
Energy: 1.0333133484178452
Energy: 1.03389563708081
Energy: 1.030863659944832
Energy: 1.0456924673611014
Energy: 1.036546119095571
Energy: 1.4116862786797353
Energy: 1.0535029710822792
Energy: 1.064671526000623
Energy: 1.0759017118922394
Energy: 1.052815374749221
Energy: 1.1114748056113737
Energy: 1.0420349187421565
Energy: 1.050805933244028
Energy: 1.053562240320371
Energy: 1.0526428016231635
Energy: 1.0442693021083997
Energy: 1.0568942153178715
Energy: 1.0413291486859835
Energy: 1.047307544117574
Energy: 1.0478332659505225
Energy: 1.0465234858161139
Energy: 1.047324858283116
Energy: 1.0478553708870693
Energy: 1.0528985677178606
Energy: 1.0469024522816621
Energy: 1.047584902172659
Energy: 1.0411100243565736
Energy: 1.0547984352762396
Energy: 1.0475682121081762
Energy: 1.0441843350027749
Energy: 1.0309401798451991
Energy: 1.0344120153467993
Energy: 1.04449141356877
Energy: 1.0293852621275426
Energy: 1.032887481896933
Energy: 1.0355977865291115
Energy: 1.0286559145774476
Energy: 1.030023735575708
Energy: 1.0428982463829266
Energy: 1.0282640284097067
Energy: 1.0316529420636653
Energy: 1.0421630252720417
Energy: 1.0270697732063758
Energy: 1.0467132249208118
Energy: 1.059178072014717
Energy: 1.061427540675662
Energy: 1.0573374085930862

minimum gb energy = 1.0204046098028174 eV
minimum distance =  2.29724276518936 Angstroms
sigma value = 81


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

Energy: 1.6390538515012139
Energy: 0.9961459766975286
Energy: 0.9974562037864905
Energy: 0.9986387857061636
Energy: 1.1125409682335066
Energy: 0.9980203761491863
Energy: 0.9703740165449061
Energy: 1.0105846222420942
Energy: 0.9741883474071723
Energy: 0.9741720815502248
Energy: 0.9762593424262437
Energy: 1.0044194570756635
Energy: 0.9713080074244206
Energy: 0.9720916166365026
Energy: 0.9755186021932076
Energy: 1.0146379036481696
Energy: 0.9706526137222796
Energy: 0.9723277729269691
Energy: 0.972474817687759
Energy: 0.9768476699432473
Energy: 1.0081589400150184
Energy: 0.9726347803076598
Energy: 0.9660739193274878
Energy: 1.0081406018995418
Energy: 0.973947614094817
Energy: 1.0044589788471536
Energy: 1.0086263593257618
Energy: 0.9741848673096168
Energy: 1.008203081578438
Energy: 0.9714280894362062
Energy: 0.972067030017394
Energy: 1.0089666163292643
Energy: 1.0094821408399397
Energy: 0.970316307922969
Energy: 1.0086046362760974
Energy: 0.9724130415684175
Energy: 0.9690501416900212
Energy: 0.97472570802314
Energy: 1.0076334160845917
Energy: 1.0218664396528834
Energy: 0.9714805791849052
Energy: 1.0119557811511812
Energy: 1.119756651693983
Energy: 1.0712347023489757
Energy: 1.0707809937084993
Energy: 0.966276650484485
Energy: 1.1030319731044211
Energy: 1.0341992524698496
Energy: 0.9702426799447194
Energy: 1.008211987799144
Energy: 1.0033913489075106
Energy: 1.0330820110310102
Energy: 1.0128816069573323
Energy: 1.0047980151327558
Energy: 1.029540553848879
Energy: 0.9717077026618856
Energy: 0.9666274654908732
Energy: 1.0299954492061805
Energy: 0.9679731308061861
Energy: 0.9734956893013936
Energy: 0.9782731519526425
Energy: 0.966798513836076
Energy: 0.966943751560897
Energy: 0.9778667658131862
Energy: 1.0060038251518524
Energy: 1.0064949551274989
Energy: 0.9646371465162165
Energy: 1.0079659201497695
Energy: 1.0081422384473178
Energy: 0.9650045157784264
Energy: 0.9775415495844288
Energy: 0.9724490337011121
Energy: 0.9649416676654057
Energy: 0.9735832733689983
Energy: 0.9702966350039804
Energy: 0.9680055518638164
Energy: 0.9745693210083567
Energy: 0.9747270987396911
Energy: 0.9751816600829419
Energy: 0.9720053295789566
Energy: 0.9748775533484605
Energy: 0.9764036373325917
Energy: 0.9705267859191571
Energy: 1.0074480739338807
Energy: 1.1137181310821453
Energy: 1.0257150986242103
Energy: 1.0020953918285957
Energy: 0.9716963892528392
Energy: 0.971579108963583
Energy: 0.9726471584377152
Energy: 0.9751609321685247
Energy: 0.9737261078448629
Energy: 0.9702750242869773
Energy: 0.9761688061346766
Energy: 0.9770256202806727
Energy: 1.0098047181056933
Energy: 1.1119886138160036
Energy: 0.9665707754335646
Energy: 0.96588401994271
Energy: 1.1120034540476809
Energy: 0.9662399241748092
Energy: 0.9970432529789186
Energy: 0.9777269016955794
Energy: 1.0131172479533976
Energy: 1.0059576628917364
Energy: 0.9774849439370764
Energy: 1.0231636445370982
Energy: 1.0057424976385914
Energy: 1.1382332865381732
Energy: 0.9742332149626853
Energy: 0.9698516546795702
Energy: 0.9646453920658477
Energy: 0.9734271244218378
Energy: 0.9684378436514068
Energy: 1.221732893731347
Energy: 0.9728398085059173
Energy: 0.9705143150454583
Energy: 0.9660376417081886
Energy: 0.9805455755051138
Energy: 0.9695211472251141
Energy: 0.9723360311608666
Energy: 0.9759270226868354
Energy: 1.0052216119658028
Energy: 0.9786255544366315
Energy: 0.9752602903102169
Energy: 1.0056538082019715
Energy: 0.9760798571741528
Energy: 0.9645627073443361
Energy: 1.0717593815794402
Energy: 0.9756025196145938
Energy: 0.9651342656293153
Energy: 1.068736583214597
Energy: 0.9697249019670076
Energy: 0.9708411431136856
Energy: 1.022419957852708
Energy: 0.9711983157380663
Energy: 0.9769629148461066
Energy: 0.9733853636939852
Energy: 0.9709407251595258
Energy: 0.9719325294414869
Energy: 1.0147963716092758
Energy: 0.9720350166457861
Energy: 0.9701056630490249
Energy: 1.0151626163268004
Energy: 0.9767436510776983
Energy: 1.0041900222223212
Energy: 0.9724052813979636
Energy: 0.9770251466483407
Energy: 1.0084484517869894
Energy: 0.9718462969571988
Energy: 1.1151230757446822
Energy: 1.0580134011009694
Energy: 1.0563483989754632
Energy: 1.0047334661288572
Energy: 1.0618686491577558
Energy: 1.0560808612012929
Energy: 1.1144151496400878
Energy: 1.0564396944963783
Energy: 1.0551732826391709
Energy: 1.0028806279959772
Energy: 1.0583009110320256
Energy: 1.054967867041582
Energy: 0.9794060236951965
Energy: 0.9689935054879374
Energy: 1.0092902610034382
Energy: 0.9782716940803681
Energy: 1.0043894177377883
Energy: 0.9718770390421488
Energy: 0.9783371835104165
Energy: 0.9668985368657801
Energy: 0.9668723072143531
Energy: 0.9707003530082212
Energy: 0.9663035328765571
Energy: 0.9676223469772646
Energy: 0.9754383257983685
Energy: 0.9739977005679209
Energy: 1.0101946617210946
Energy: 0.9771823648046769
Energy: 0.9763306850330776
Energy: 1.0114742340375111
Energy: 0.9657061496182912
Energy: 1.0309828787588624
Energy: 0.9703252026015081
Energy: 1.0050384982924123
Energy: 0.9713954943120119
Energy: 1.0677452153948326
Energy: 0.9752790719411281
Energy: 0.9710707534699716
Energy: 0.9727457723330546
Energy: 0.9759314182102408
Energy: 0.9703028726230253
Energy: 1.0085978777279896
Energy: 1.113309387123604
Energy: 0.9697472139062686
Energy: 0.9710564643369938
Energy: 1.011828432957521
Energy: 0.9734889002216499
Energy: 1.0053502367957392
Energy: 1.1124472144190434
Energy: 0.9720085607761896
Energy: 1.0079891727843031
Energy: 1.0076294778115893
Energy: 0.9715657891047734
Energy: 1.007356733262711
Energy: 1.1151166141148448
Energy: 1.0137196678393698
Energy: 1.0060491352868586
Energy: 1.0547130925852959
Energy: 1.0022979788654212
Energy: 1.0060861191234352
Energy: 1.1227502457482523
Energy: 1.010973587238895
Energy: 0.9669699528247425
Energy: 1.1224790404654703
Energy: 1.0027252329478749
Energy: 1.059664666024544
Energy: 0.9709341250096016
Energy: 1.0100151481454624
Energy: 0.9711105596827003
Energy: 0.9761869436464983
Energy: 0.976007437173345
Energy: 1.0044507275638408
Energy: 1.2214633110157942
Energy: 0.9727017449746272
Energy: 0.9971336049840464
Energy: 0.9765257661393897
Energy: 0.9996155751227579
Energy: 0.9951065057438991

minimum gb energy = 0.9645627073443361 eV
minimum distance =  2.33556900198019 Angstroms
sigma value = 43


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

Energy: 1.7437373487273378
Energy: 1.1823888324082488
Energy: 1.1066784161426395
Energy: 1.0509959394143362
Energy: 1.2079414007924179
Energy: 1.0457126881880654
Energy: 0.9926876173747164
Energy: 1.001964175019939
Energy: 1.0021625029734396
Energy: 1.0533295549157204
Energy: 1.0059055729652682
Energy: 1.0110821807038488
Energy: 1.0235479899610598
Energy: 0.9937232851856289
Energy: 0.9931573669621152
Energy: 1.0555792762715388
Energy: 0.9954841842588502
Energy: 1.0122060621623699
Energy: 1.0110432154809283
Energy: 0.9943875358438975
Energy: 1.0110956213417284
Energy: 1.0112427973431826
Energy: 0.9950484504545046
Energy: 1.0118604699252125
Energy: 1.0107846180583357
Energy: 1.0376343464593536
Energy: 1.0471323435957918
Energy: 1.0109821088080222
Energy: 1.051600202300961
Energy: 1.051078433633236
Energy: 1.011728104933903
Energy: 1.0511895741157302
Energy: 1.0386856560979898
Energy: 1.0557405371172102
Energy: 1.0243305305668051
Energy: 1.0464974358446222
Energy: 1.011568839320424
Energy: 1.0109763959697788
Energy: 1.0110986263252995
Energy: 1.0121698478350118
Energy: 1.0120443810031585
Energy: 1.0127070314626012
Energy: 1.1571285702617444
Energy: 1.012228672876917
Energy: 1.0116593471618764
Energy: 1.0016300282176087
Energy: 1.0127788436713254
Energy: 1.0117140481050506
Energy: 1.00740271016724
Energy: 1.0124918158625726
Energy: 1.012241088587122
Energy: 1.0071377465567983
Energy: 1.0120846972513282
Energy: 1.0256617020331251
Energy: 1.2113628269173142
Energy: 1.0123123136814893
Energy: 1.0124006366135552
Energy: 1.121902284206056
Energy: 1.0125914355072645
Energy: 1.012466734339016
Energy: 1.00027576363507
Energy: 1.03669427059798
Energy: 1.0416551357883712
Energy: 1.0064423453825666
Energy: 1.0162273802487516
Energy: 1.0186285721135946
Energy: 1.1386916993030893
Energy: 1.0117048500753751
Energy: 1.011617770577569
Energy: 1.0192202517103417
Energy: 1.011853174419925
Energy: 1.0116302082899984
Energy: 1.176489398879593
Energy: 1.0114962593663839
Energy: 1.0270240451746024
Energy: 0.9952389694101991
Energy: 1.013143602129148
Energy: 1.0269568789984405
Energy: 1.0005265904781862
Energy: 1.0245282845586206
Energy: 1.0180456124676367
Energy: 1.0068123912750204
Energy: 1.0111665936580767
Energy: 1.0024035316014335
Energy: 1.0028548412000875
Energy: 1.002103253316528
Energy: 1.0122351702624288
Energy: 1.013965243247426
Energy: 0.9930179693944857
Energy: 1.0150345272612618
Energy: 1.0011285575733202
Energy: 1.0552920461101267
Energy: 1.0132642145051016
Energy: 0.9996991459633549
Energy: 1.0125142431813885
Energy: 1.0004014573856816
Energy: 1.0013992076164886
Energy: 1.003035270159164
Energy: 1.003054947657495
Energy: 1.0014672429583804
Energy: 1.0002471869991145
Energy: 1.0035701276624478
Energy: 1.0002291104039613
Energy: 1.0109713312541544
Energy: 1.0020892463841582
Energy: 1.0432781468199837
Energy: 1.0604965732261296
Energy: 0.9998319910450278
Energy: 1.0086288176532057
Energy: 1.0001544100064899
Energy: 1.0001638925743213
Energy: 1.0123403504000197
Energy: 1.0002951763473886
Energy: 1.0114814236454852
Energy: 1.126384989372681
Energy: 0.9999222203995847
Energy: 0.9997414062468841
Energy: 1.0119502547479131
Energy: 1.0035093586651673
Energy: 1.0116861589495008
Energy: 1.0004611062405944
Energy: 1.0138361652745898
Energy: 1.0036163832388056
Energy: 1.037308734394946
Energy: 1.025987487912781
Energy: 1.0020303632049967
Energy: 1.1465736346066595
Energy: 1.0283392745360762
Energy: 1.0311900383562427
Energy: 1.1464670689950662
Energy: 0.9967883542453688
Energy: 1.1502767811494143
Energy: 1.0387231259663692
Energy: 1.0127553389251465
Energy: 1.0144765460462695
Energy: 1.0181281053638767
Energy: 1.0529024355612864
Energy: 1.032526631911394
Energy: 1.1132094478693382
Energy: 1.0027910718732225
Energy: 1.0028628604146792
Energy: 1.00645610142974
Energy: 1.0000295110274975
Energy: 1.022705688867729
Energy: 1.0379205590241274
Energy: 1.0025055934807066
Energy: 1.003186551393891
Energy: 1.0148736452550937
Energy: 1.0020733730242872
Energy: 1.0033661536551561
Energy: 1.0720904369035378
Energy: 1.0003776167524503
Energy: 1.0134670868781444
Energy: 1.0032051388226373
Energy: 1.0003987782501478
Energy: 1.004415584093241
Energy: 1.0715503589299564
Energy: 1.0129596266906524
Energy: 1.0128452525082214
Energy: 1.066702871948483
Energy: 1.0006793328717911
Energy: 1.0129365119307898
Energy: 1.0572146535208986
Energy: 1.0144513068891259
Energy: 1.023288527024305
Energy: 1.0114809094902597
Energy: 1.0229594004285127
Energy: 1.0240590544817565
Energy: 1.0403651832356349
Energy: 1.011709897039399
Energy: 1.0111667241956495
Energy: 1.0403688398280808
Energy: 1.000692018118368
Energy: 1.0109103969761983
Energy: 1.0101508998165905
Energy: 1.0188798087200694
Energy: 1.0079750122084645
Energy: 1.0537625317986377
Energy: 1.0130123475101191
Energy: 1.0122591924156454
Energy: 0.9952573110396626
Energy: 1.0714926019377848
Energy: 1.0528986921930363
Energy: 1.0272778369585966
Energy: 1.0705210516117063
Energy: 0.9942609415652747

minimum gb energy = 0.9926876173747164 eV
minimum distance =  2.30243713266783 Angstroms
sigma value = 57


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

Energy: 1.3381732132379238
Energy: 1.0508820195645316
Energy: 1.043485595247669
Energy: 0.9536083288008439
Energy: 1.601605965898033
Energy: 1.0432678872474432
Energy: 0.9477480018895904
Energy: 1.0029654060241098
Energy: 1.0108765769436918
Energy: 1.016910758314287
Energy: 1.0158373551758761
Energy: 0.9998830714474329
Energy: 1.0223346837737406
Energy: 0.9748690231980762
Energy: 0.9608208611311502
Energy: 1.0026137139846667
Energy: 0.9737713337074803
Energy: 0.9480954665425407
Energy: 1.000368118211636
Energy: 0.9602804457494409
Energy: 0.9473919494222427
Energy: 1.001078384265898
Energy: 0.9483880797966135
Energy: 1.00157345699612
Energy: 1.0013753472566898
Energy: 1.0000466316559091
Energy: 1.0079866462063876
Energy: 1.0016205214109297
Energy: 1.006786078251156
Energy: 1.0005508018844522
Energy: 0.9512659408777179
Energy: 0.9993320686607169
Energy: 0.9879765744045199
Energy: 0.9911924851316333
Energy: 1.0057187689127056
Energy: 0.9884310694740304
Energy: 1.0172978552415508
Energy: 1.0009130544593243
Energy: 1.0017148625881391
Energy: 1.0187585840535995
Energy: 1.001323362744145
Energy: 1.0064947240133948
Energy: 0.9969772107472147
Energy: 1.000663915136866
Energy: 1.000355392042775
Energy: 0.9852658361284641
Energy: 1.0016447646429645
Energy: 1.0030183037411549
Energy: 1.0152320670874775
Energy: 1.0019777481616505
Energy: 1.0027998741093647
Energy: 1.0155638406919478
Energy: 1.0022998051426568
Energy: 1.000062472804118
Energy: 1.187824684624238
Energy: 0.994574877406558
Energy: 0.9942565191305044
Energy: 1.1230912378846853
Energy: 0.9960146053052968
Energy: 0.9958528892025235
Energy: 1.0063003213700457
Energy: 0.9949004159227801
Energy: 1.0073069415639675
Energy: 1.0181193518591158
Energy: 1.000755309421376
Energy: 1.0014764082005103
Energy: 0.947887357897247
Energy: 1.0035064569030352
Energy: 1.0016701755482051
Energy: 0.9519442605273801
Energy: 1.0181815308202125
Energy: 1.0405820150684053
Energy: 0.9487110368936269
Energy: 1.0021161776848446
Energy: 1.0403095554074238
Energy: 0.974323173818781
Energy: 1.0051944771365267
Energy: 1.0407753462148206
Energy: 1.0037644342698453
Energy: 0.9976456379364107
Energy: 0.9978980240413724
Energy: 1.0156094594964615
Energy: 1.0165003777843298
Energy: 1.0081274942334189
Energy: 1.0139548447679485
Energy: 0.9497573849609083
Energy: 0.9550123855507711
Energy: 1.0112852807039803
Energy: 0.9486479897828087
Energy: 0.9538055602371501
Energy: 1.000749412464162
Energy: 0.9981474920561294
Energy: 0.99730326220562
Energy: 1.0017944654411892
Energy: 1.0171475781285368
Energy: 1.0055862192451863
Energy: 1.002066125893607
Energy: 0.9901848957919261
Energy: 1.0026968217645018
Energy: 1.0059151923659886
Energy: 0.9902112857248594
Energy: 0.9959497010667568
Energy: 1.002784118568527
Energy: 1.0093060546196813
Energy: 0.9893256367828939
Energy: 1.0084054472649555
Energy: 1.0015408711198799
Energy: 0.9955638342363029
Energy: 1.0184733076279844
Energy: 1.0022494109243603
Energy: 1.0023059248633361
Energy: 1.0194435800179948
Energy: 1.0012063756729312
Energy: 1.0071053862942578
Energy: 1.0168153206722421
Energy: 1.003882263636037
Energy: 1.012314180149808
Energy: 1.019170199231909
Energy: 1.0033748851770508
Energy: 1.0068485685114394
Energy: 1.015864326902924
Energy: 1.0071907729663279
Energy: 0.9917137893494722
Energy: 1.0166692698376314
Energy: 1.0071608137907073
Energy: 0.9991553595408005
Energy: 1.1870316553706854
Energy: 0.9933273735130845
Energy: 1.0009522663892931
Energy: 1.1234262794596006
Energy: 0.994066724243446
Energy: 1.00071096387141
Energy: 1.0040925687901474
Energy: 1.0050512539186325
Energy: 0.9939050712079406
Energy: 1.01546040893713
Energy: 1.0162281846289452
Energy: 0.9987529114458118
Energy: 0.9488873762275172
Energy: 1.0021933525591247
Energy: 1.0403777085567405
Energy: 0.9750436421943401
Energy: 1.0054123100090315
Energy: 1.0407865665754117

minimum gb energy = 0.9473919494222427 eV
minimum distance =  2.28408457368986 Angstroms
sigma value = 17


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

Energy: 1.5425351894619015
Energy: 1.0945637377496948
Energy: 1.1727195195795388
Energy: 0.9307057234112042
Energy: 1.0150832008886805
Energy: 0.929898994643136
Energy: 0.9308086784805357
Energy: 1.0328526023171618
Energy: 1.0085428109147947
Energy: 1.0601505493421435
Energy: 1.0326909601356449
Energy: 0.9861548759428392
Energy: 1.2531845051050534
Energy: 0.9589119271961704
Energy: 0.9586480304714792
Energy: 1.033540767563713
Energy: 0.9589493415758352
Energy: 0.9322274269067802
Energy: 1.0303018928409238
Energy: 0.9454151008016847
Energy: 0.9316340146795192
Energy: 1.0297504204369456
Energy: 0.9560608788754316
Energy: 1.0250183686389933
Energy: 0.9176296808627936
Energy: 0.9458443541617823
Energy: 0.9590182941066523
Energy: 0.9185909931626988
Energy: 0.945343761196299
Energy: 0.9592124234857045
Energy: 0.9315750709246599
Energy: 0.906363767710694
Energy: 0.9587514790376394
Energy: 0.9101300992544619
Energy: 0.9034708014892436
Energy: 0.9431757059234356
Energy: 0.9035008598288988
Energy: 0.9022546449134615
Energy: 0.9027764176419829
Energy: 0.9031748513969459
Energy: 0.9033819364532505
Energy: 0.9269260891886779
Energy: 0.9033596234153238
Energy: 0.9522213161959447
Energy: 0.9530502093883013
Energy: 0.9501829207327125
Energy: 0.9511692621365431
Energy: 0.9505916372919129
Energy: 0.9058630515576716
Energy: 0.9501874684128006
Energy: 0.948665640719145
Energy: 0.9077561147925631
Energy: 0.9507304420284649
Energy: 0.9061829719405815
Energy: 0.9027876329710282
Energy: 0.9594460814906289
Energy: 0.9590549325425634
Energy: 0.9030255011170062
Energy: 0.9593964777842193
Energy: 0.9464469463008635
Energy: 0.9046092202752175
Energy: 0.9597732757929099
Energy: 0.9588428626702118
Energy: 0.9456052205733533
Energy: 1.0314308719015866
Energy: 0.9470444790159135
Energy: 1.0278621618166257
Energy: 1.0299984805527393
Energy: 1.030127246627685
Energy: 1.0275855174223743
Energy: 1.0320770639003742
Energy: 1.0324551470670575
Energy: 1.0284050634561381
Energy: 1.027102541156659
Energy: 1.043020972474075
Energy: 0.9583061244806957
Energy: 1.0251297694365535
Energy: 1.0435128983884845
Energy: 1.048208694228206
Energy: 1.0323538157282406
Energy: 1.03112430548528
Energy: 1.0444235116942586
Energy: 1.0331656094478228
Energy: 0.9741792583993812
Energy: 1.0320602465762605
Energy: 1.0216279977755411
Energy: 1.055380954957472
Energy: 1.0249782635106937
Energy: 1.0206515745007587
Energy: 1.096226423878688
Energy: 1.0335906349487012
Energy: 1.0599511424402404
Energy: 1.0002468831525382
Energy: 1.032543398278929
Energy: 1.0600222650579612
Energy: 1.032169190676589
Energy: 1.014113723345853
Energy: 1.0333588307820307
Energy: 1.1297119156941353
Energy: 0.930192397119505
Energy: 1.0346828069414682
Energy: 1.1299577178764468

minimum gb energy = 0.9022546449134615 eV
minimum distance =  2.28368605415271 Angstroms
sigma value = 17


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

Energy: 1.6330195200785946
Energy: 1.1395883848947146
Energy: 0.9828790756435217
Energy: 0.9236933365913087
Energy: 1.028189930575506
Energy: 0.9821969622890775
Energy: 0.9216865613081019
Energy: 1.0141369734407557
Energy: 0.9142828975816066
Energy: 1.0133766010953054
Energy: 1.0157482691953175
Energy: 0.9546462964556464
Energy: 1.197054021886193
Energy: 0.8899213011221814
Energy: 0.9325328255406481
Energy: 1.012724393901808
Energy: 0.8906539196097606
Energy: 0.9278207427167228
Energy: 1.0172232002839066
Energy: 0.9276290269877245
Energy: 0.9227789192454612
Energy: 1.0186613826265092
Energy: 0.8976205881795883
Energy: 0.9220038028092964
Energy: 0.8918324164033484
Energy: 0.9133944393646211
Energy: 0.9168605477948178
Energy: 0.8926946191145041
Energy: 0.9187554444518429
Energy: 0.908615841205091
Energy: 0.9371360373614809
Energy: 0.8772250676114276
Energy: 0.8885144623974578
Energy: 0.8895701580840725
Energy: 0.877865603842344
Energy: 0.8893560487211067
Energy: 0.817150299995582
Energy: 0.8781752938379902
Energy: 0.8776595800147475
Energy: 0.8518689930186456
Energy: 0.8812768435905447
Energy: 0.8799598665507257
Energy: 0.8181935044844347
Energy: 0.8767195018007333
Energy: 0.8799280351511688
Energy: 0.8645528785394274
Energy: 0.8698178205850498
Energy: 0.8805777749326702
Energy: 0.8193658226306058
Energy: 0.8795905434559297
Energy: 0.8197281218875113
Energy: 0.8209691327856035
Energy: 0.8514319390119721
Energy: 0.8187987922606392
Energy: 0.8188477977675943
Energy: 0.8747709481971839
Energy: 0.8750171414024768
Energy: 0.8185933679199191
Energy: 0.8741515984926549
Energy: 0.8744352214260582
Energy: 0.8375296937822047
Energy: 0.8178370498881995
Energy: 0.8730634949338357
Energy: 0.8731460113338775
Energy: 0.8187960398111235
Energy: 0.8731174195551847
Energy: 0.8217627508556032
Energy: 0.8190248737850623
Energy: 0.8186839859700226
Energy: 0.8206116278107712
Energy: 0.824121471015869
Energy: 0.8589815574811861
Energy: 0.8777746224125096
Energy: 0.8832994256571528
Energy: 0.8813537962958086
Energy: 0.8791459722180408
Energy: 0.8610109973524627
Energy: 0.8804671195797876
Energy: 0.8795743834509671
Energy: 0.892170435563309
Energy: 0.8856548116827421
Energy: 0.878710839642558
Energy: 0.8811394715135552
Energy: 0.8777008604833507
Energy: 0.8779418529393668
Energy: 0.8724669686351665
Energy: 0.8734222466732723
Energy: 0.8780479048092309
Energy: 0.87955739383807
Energy: 0.9147445183742052
Energy: 1.0110942988892984
Energy: 0.9146989465001127
Energy: 0.911407333489686
Energy: 0.9108228997867549
Energy: 0.8938982924253015
Energy: 0.9112033500856197
Energy: 0.8185980458697591
Energy: 1.0144245681177788
Energy: 1.014244242807702
Energy: 0.8359629708237044
Energy: 1.0138161296168762
Energy: 0.8769508649379284
Energy: 0.8954028544620634
Energy: 1.0145045218035196
Energy: 1.0170381364390118
Energy: 0.8948373336118887
Energy: 1.0131872610066686
Energy: 0.9090579506705593
Energy: 1.1199692553873373
Energy: 1.0162686601580169
Energy: 0.9686153370794611
Energy: 1.0143453884991986
Energy: 0.9118948316539119
Energy: 0.9116796029137562
Energy: 1.1993737113259901
Energy: 0.9035693467809036
Energy: 0.9024949101922094
Energy: 1.0142943532314976
Energy: 0.8776548272360717
Energy: 1.0191351283527503
Energy: 1.1063587819022376
Energy: 0.9921287427764087
Energy: 1.0015827485743785
Energy: 1.0146875706232876
Energy: 1.0147895330017669
Energy: 1.0131929434132583
Energy: 0.8313505969440372
Energy: 1.027876810263201
Energy: 1.1016633950887096
Energy: 0.9228666081886434
Energy: 1.020464106329788
Energy: 0.9225251337490966
Energy: 0.8361364975664503
Energy: 1.0198149858351626
Energy: 1.018235069648813
Energy: 0.8387201706956792
Energy: 1.0138375258245844
Energy: 0.977604653292572
Energy: 1.1877129036132479
Energy: 0.9258113188428717
Energy: 0.9142194438226353
Energy: 1.0153219662324109
Energy: 0.8309730126388595
Energy: 0.9917755216094821
Energy: 1.0134646512528334
Energy: 0.8964917914238504
Energy: 0.9327874192608729
Energy: 1.0136292428877065
Energy: 0.8935318519581852
Energy: 0.9287648851651118
Energy: 0.8964152830529198
Energy: 0.9163876664041605
Energy: 0.9129676382840929
Energy: 0.8961331683159351
Energy: 0.8790660351626701
Energy: 0.9143720342859974
Energy: 0.9415105350765366
Energy: 0.9169615114420498
Energy: 0.9149682934139898
Energy: 0.8906480479762328
Energy: 0.9172932921621983
Energy: 0.8886701912776996
Energy: 0.8043868261338097
Energy: 0.8783763547699184
Energy: 0.8781958716503472
Energy: 0.8052565554395086
Energy: 0.8806702292763339
Energy: 0.8781948322103106
Energy: 0.8219352103538045
Energy: 0.8815964468495946
Energy: 0.8821763550125447
Energy: 0.8802060783448638
Energy: 0.8770262065579475
Energy: 0.8822471196940932
Energy: 0.8192387154504555
Energy: 0.8688867830096124
Energy: 0.8791185703546458
Energy: 0.8192890305682763
Energy: 0.8690652639719961
Energy: 0.8789265395386566
Energy: 0.8245860339392894
Energy: 0.8743373063157842
Energy: 0.8740900598594249
Energy: 0.8258194557270795
Energy: 0.8756935218742883
Energy: 0.8519957890154733
Energy: 0.8202478236059143
Energy: 0.8750100569140145
Energy: 0.8740032433954693
Energy: 0.872543602260066
Energy: 0.8754995928108926
Energy: 0.873835567526879
Energy: 0.8319619944462281
Energy: 0.8191908806828383
Energy: 0.8189164865322573
Energy: 0.8324008998971465
Energy: 0.8197449284853198
Energy: 0.8187355363458984
Energy: 0.9010757942268547
Energy: 0.8910207168779145
Energy: 0.8823711456307068
Energy: 0.8822543807260673
Energy: 0.8577242545427267
Energy: 0.882270132705304
Energy: 0.8865223598949975
Energy: 0.8849916888632731
Energy: 0.880444460568231
Energy: 0.878246649089704
Energy: 0.8583045535622572
Energy: 0.8826931020444209
Energy: 0.8788088535156166
Energy: 0.8797255398091239
Energy: 0.9102212218772225
Energy: 0.8787497700615065
Energy: 0.8800206713772539
Energy: 0.9110869686622336
Energy: 1.1249201866281668
Energy: 0.9079213700142331
Energy: 0.9133910756326992
Energy: 0.8805917078285859
Energy: 0.9273623876418683
Energy: 0.9111572922158095
Energy: 0.817484518061156
Energy: 1.0131216872001434
Energy: 1.012864030627004
Energy: 0.8840166726668123
Energy: 1.0154295547956795
Energy: 0.9134591501979648
Energy: 0.8837393461634916
Energy: 1.0094334943207846
Energy: 0.9204319193563302
Energy: 0.9148185371283595
Energy: 1.0114121123466107
Energy: 0.9027358689365063
Energy: 0.8772410320129163
Energy: 1.0127248628243564
Energy: 0.9915434522670014
Energy: 0.8940908813285751
Energy: 1.018384596742726
Energy: 0.9540180980529097
Energy: 1.1271690520750308
Energy: 0.8928724044295687
Energy: 1.01659162792342
Energy: 1.0212136142315762
Energy: 0.9099320452652722
Energy: 1.0127487479768906
Energy: 1.1865676093191613
Energy: 0.9615243649604515
Energy: 0.9145231748887492
Energy: 1.0162227258977652
Energy: 0.8933123632569383
Energy: 0.9949735959226178
Energy: 0.8382846208172253
Energy: 1.019520278775308
Energy: 1.017724204604404
Energy: 0.8308973607893202
Energy: 1.0173354454911165
Energy: 0.9769584295161713

minimum gb energy = 0.8043868261338097 eV
minimum distance =  2.30698902100839 Angstroms
sigma value = 57


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

Energy: 0.7652210543397256
Energy: 1.0894580111626841
Energy: 0.9440751812971753
Energy: 0.8480209624757049
Energy: 1.307708127230349
Energy: 0.9321363486940685
Energy: 0.9055793340957714
Energy: 0.8753406429236329
Energy: 0.870977484875551
Energy: 0.9613604098088749
Energy: 0.982155790181029
Energy: 0.9201916708763126
Energy: 1.1352784951603778
Energy: 0.8459222046112039
Energy: 0.8463459348844502
Energy: 0.9887135781642629
Energy: 0.8451431161535835
Energy: 0.9032277170297769
Energy: 0.9835780698274725
Energy: 0.8456566997521165
Energy: 0.8944277819687414
Energy: 0.9839996099821929
Energy: 0.8328233867574325
Energy: 0.9006657290055896
Energy: 0.8462737858948419
Energy: 0.8764313909435574
Energy: 0.8705506454309786
Energy: 0.8470582947092642
Energy: 0.8586970737704264
Energy: 0.8683542028198501
Energy: 0.8316990178387801
Energy: 0.8561907148575383
Energy: 0.8456236871922548
Energy: 0.8222847677485158
Energy: 0.8563903725894297
Energy: 0.8474912398728687
Energy: 0.7850007360311648
Energy: 0.8647585717415992
Energy: 0.8558002355968403
Energy: 0.8313340202520415
Energy: 0.8634516390132654
Energy: 0.8337990599414733
Energy: 0.9165619462965202
Energy: 0.8135638158033539
Energy: 0.8194329935778258
Energy: 0.7908011004961255
Energy: 0.8129476632876518
Energy: 0.8305813018218087
Energy: 0.7900740712658618
Energy: 0.817940341665311
Energy: 0.7859667848697699
Energy: 0.7920267350996412
Energy: 0.7948889632012667
Energy: 0.7858662459493159
Energy: 0.7862275432722517
Energy: 0.8160694559342097
Energy: 0.8167503283414341
Energy: 0.7862048251045543
Energy: 0.8136257541833792
Energy: 0.8176701628611298
Energy: 0.7638077969184585
Energy: 0.7534672734199634
Energy: 0.8205587614079046
Energy: 0.8113178042339871
Energy: 0.7546928408562361
Energy: 0.8082834351937526
Energy: 0.7910481138708826
Energy: 0.764283835620473
Energy: 0.7538284118546493
Energy: 0.8038934378075872
Energy: 0.7605939228659269
Energy: 0.7942763876286478
Energy: 0.7529803018719189
Energy: 0.847639705377731
Energy: 0.8442182037935573
Energy: 0.8132053725020948
Energy: 0.8138606772400429
Energy: 0.8134680013853527
Energy: 0.7546543060925829
Energy: 0.8104409817594701
Energy: 0.7541299216783782
Energy: 0.7569749600607709
Energy: 0.7993691048071
Energy: 0.7542274444288797
Energy: 0.7540814226384766
Energy: 0.8128254065593881
Energy: 0.8094430119977524
Energy: 0.7540091159029151
Energy: 0.8370338931358662
Energy: 0.8086854778844168
Energy: 0.8066294130048665
Energy: 0.7858458892909325
Energy: 0.8159357613240859
Energy: 0.8454806356587239
Energy: 0.7863033151263954
Energy: 0.8139035707704428
Energy: 0.7986241240278407
Energy: 0.7862743208614129
Energy: 0.7859185426301429
Energy: 0.8132637895348425
Energy: 0.7952165673398093
Energy: 0.8192882384348432
Energy: 0.7580272439263329
Energy: 0.821883745702494
Energy: 0.837690146114192
Energy: 0.8026238034654264
Energy: 0.8206563369256465
Energy: 0.8401507776320895
Energy: 0.8561213355282978
Energy: 0.8329857819531004
Energy: 0.8453076359441196
Energy: 0.8585763432770084
Energy: 0.8368957419173059
Energy: 0.8565482350684153
Energy: 0.8583424819847477
Energy: 0.8385600240068465
Energy: 0.8434289194067458
Energy: 0.8974258129118066
Energy: 0.833431342321005
Energy: 0.8804481731785242
Energy: 1.0634078550111539
Energy: 0.8792986894232617
Energy: 0.8789270648219937
Energy: 0.8813894338369462
Energy: 0.8613682051048157
Energy: 0.8794265478877255
Energy: 0.7548414402179521
Energy: 0.9806069732448116
Energy: 0.8559210390969699
Energy: 0.8311307552522663
Energy: 0.9936071057457992
Energy: 0.8781796839868878
Energy: 0.7922890938754491
Energy: 0.9897583782161696
Energy: 0.9488545886450193
Energy: 0.7889631537436328
Energy: 0.9857569977373495
Energy: 0.9473069932616687
Energy: 1.05939382057373
Energy: 0.8566230933633231
Energy: 0.8662270386629806
Energy: 0.9141684795262036
Energy: 0.8906903499580019
Energy: 0.8910845143064035
Energy: 1.1407747112094226
Energy: 0.8615820142569162
Energy: 0.8620668885518313
Energy: 0.9912597583342886
Energy: 0.8756336239173849
Energy: 0.9745527823473541
Energy: 1.1344744245800065
Energy: 0.9702425632497597
Energy: 0.9515203043282143
Energy: 0.9572521446053958
Energy: 0.9578653310838291
Energy: 0.9286987406955781
Energy: 0.762076175092483
Energy: 0.9901851354917471
Energy: 0.9021592934230732
Energy: 0.848113348053236
Energy: 0.9907218709252271
Energy: 0.9033304128171505

minimum gb energy = 0.7529803018719189 eV
minimum distance =  2.27798102576122 Angstroms
sigma value = 43


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

Energy: 0.6641260691710698
Energy: 0.9483958344116984
Energy: 0.8416194774713269
Energy: 0.7380469331247572
Energy: 0.8969253061993971
Energy: 0.8059009956060131
Energy: 0.9480803029548714
Energy: 0.7772647698155354
Energy: 0.7552625828491519
Energy: 0.8570197088115645
Energy: 0.7785009652459562
Energy: 0.7506484839589478
Energy: 0.9875528408041767
Energy: 0.7171358867575679
Energy: 0.7212348278418406
Energy: 0.8725620832127998
Energy: 0.716717253423969
Energy: 0.7429648917534529
Energy: 0.8664926878690813
Energy: 0.7209712676983859
Energy: 0.7441247267905479
Energy: 0.7787480447925876
Energy: 0.7391057933105667
Energy: 0.8133037892217115
Energy: 0.7785297903379096
Energy: 0.7826534621472976
Energy: 0.7550054756101293
Energy: 0.7909014764044703
Energy: 0.7793888351737768
Energy: 0.7635215981992947
Energy: 0.6418764340363862
Energy: 0.775535879232558
Energy: 0.73910338696358
Energy: 0.7036170587340635
Energy: 0.7754375251976434
Energy: 0.7139566198657253
Energy: 0.9041692295381202
Energy: 0.7752743111196291
Energy: 0.7753076118533567
Energy: 0.721899998287571
Energy: 0.7756120183801762
Energy: 0.7204809782372393
Energy: 0.9009619511188764
Energy: 0.6945480088108588
Energy: 0.7078555084077309
Energy: 0.7166244158089274
Energy: 0.6942933551412601
Energy: 0.7072219625540701
Energy: 0.7161835607985392
Energy: 0.7063189808178336
Energy: 0.7137881854847015
Energy: 0.7183110968644115
Energy: 0.6576498029733129
Energy: 0.7130505228831078
Energy: 0.7142556168553851
Energy: 0.697942224727794
Energy: 0.6981300306028279
Energy: 0.7138445443635424
Energy: 0.6972187265334869
Energy: 0.698030366925653
Energy: 0.6362455938167956
Energy: 0.6734304277457343
Energy: 0.6975805333148294
Energy: 0.7118625299370823
Energy: 0.6736097108325602
Energy: 0.6902771613722949
Energy: 0.7137177561746979
Energy: 0.6737065566262145
Energy: 0.6731958277953835
Energy: 0.7207735795705061
Energy: 0.6742055917252138
Energy: 0.6930178252365804
Energy: 0.8604400354340025
Energy: 0.7117330823664859
Energy: 0.7227501472450876
Energy: 0.7196084787094963
Energy: 0.7114253291149105
Energy: 0.7227056818118404
Energy: 0.6503170904225152
Energy: 0.6760781131408635
Energy: 0.6498186435756333
Energy: 0.6522312569003331
Energy: 0.6390087012747269
Energy: 0.6499117895198273
Energy: 0.6497393624998526
Energy: 0.6814871203575057
Energy: 0.6807475871977828
Energy: 0.6496312288992916
Energy: 0.6824201140858561
Energy: 0.6803963533326852
Energy: 0.6433565089999177
Energy: 0.6388756813301175
Energy: 0.6401853324770027
Energy: 0.6967128931470403
Energy: 0.6392247453415988
Energy: 0.6827730697588463
Energy: 0.6544280266543908
Energy: 0.6391314254570349
Energy: 0.6388652340536413
Energy: 0.6962582696557217
Energy: 0.6392519200272555
Energy: 0.6843409146400107
Energy: 0.6383638474281162
Energy: 0.7095057969996645
Energy: 0.6845345708470777
Energy: 0.6394962616886686
Energy: 0.7074912985927267
Energy: 0.6840730016817222
Energy: 0.6392104898303497
Energy: 0.6721561380845842
Energy: 0.6385878092444954
Energy: 0.6408356933242477
Energy: 0.7707663582009767
Energy: 0.6391421032100603
Energy: 0.6392046962468753
Energy: 0.7099026624623707
Energy: 0.7023136545720761
Energy: 0.6393307603345022
Energy: 0.7088899254568333
Energy: 0.6916795491525747
Energy: 0.6776901927653296
Energy: 0.6500813385315525
Energy: 0.6499474246491431
Energy: 0.7094309175769218
Energy: 0.6503112541851214
Energy: 0.6918484394830225
Energy: 0.6411191110628011
Energy: 0.6500000212552337
Energy: 0.650560878630735
Energy: 0.6862401432955303
Energy: 0.650203413994508
Energy: 0.6840329494258327
Energy: 0.6732617508492509
Energy: 0.6865663405090775
Energy: 0.6858577548565491
Energy: 0.6733740100382527
Energy: 0.687111866525934
Energy: 0.6859927857165097
Energy: 0.6738096066868932
Energy: 0.7010997273169614
Energy: 0.6737497345212228
Energy: 0.6759515617648367
Energy: 0.6513786012449445
Energy: 0.6735827066846714
Energy: 0.8769526145962436
Energy: 0.7059088725146276
Energy: 0.7182445418502802
Energy: 0.6955752743193001
Energy: 0.7056846733468571
Energy: 0.7171988733936205
Energy: 0.8156778910463777
Energy: 0.7132684997484546
Energy: 0.7130854969771799
Energy: 0.7185331896499833
Energy: 0.7134443969832344
Energy: 0.6974245491625993
Energy: 0.6397537225879659
Energy: 0.7131816187651321
Energy: 0.7259186759156531
Energy: 0.7074509593648194
Energy: 0.713222681548105
Energy: 0.7010674571216414
Energy: 0.7141996153645056
Energy: 0.7257742897124257
Energy: 0.7236756315768503
Energy: 0.7394051165793827
Energy: 0.7252506159002471
Energy: 0.7207658490415633
Energy: 0.7786249802582947
Energy: 0.7263542760807561
Energy: 0.7757098908090468
Energy: 0.7810152066885555
Energy: 0.6873611140351901
Energy: 0.7754613020308823
Energy: 0.9346363956834292
Energy: 0.7064493161602441
Energy: 0.7258883949096582
Energy: 0.7773672646376178
Energy: 0.7065024274651496
Energy: 0.7267955585286997
Energy: 0.932167315274008
Energy: 0.7771878502388798
Energy: 0.7784419538282746
Energy: 0.7773420509764059
Energy: 0.7772634262705875
Energy: 0.7820144171199946
Energy: 0.6517830305227676
Energy: 0.8725847763492393
Energy: 0.7522728923250702
Energy: 0.7149111607390736
Energy: 0.8726832892116546
Energy: 0.7325184738786146
Energy: 0.8009455294464307
Energy: 0.8480852982870648
Energy: 0.8035126458328171
Energy: 0.7786528407664263
Energy: 0.8398938816039476
Energy: 0.8005134480351295
Energy: 0.9332251082050621
Energy: 0.7560575847524625
Energy: 0.7637387971257966
Energy: 0.7789310632432158
Energy: 0.7808321083499734
Energy: 0.8408628108703843
Energy: 0.9874243858584866
Energy: 0.7379714625309254
Energy: 0.7822949632084703
Energy: 0.8727841897820663
Energy: 0.7375994350368991
Energy: 0.785602340602384
Energy: 0.9229210969960304
Energy: 0.8426393350103349
Energy: 0.8040755072442527
Energy: 0.8546493035648074
Energy: 0.8569814879783344
Energy: 0.752950802657826

minimum gb energy = 0.6362455938167956 eV
minimum distance =  2.33547441222163 Angstroms
sigma value = 81


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

Energy: 0.06942559539430529
Energy: 0.12235196912067843
Energy: 0.06947301247102271
Energy: 0.07220854580464434
Energy: 0.07259924827074508
Energy: 0.0700629591013143
Energy: 0.12244202926919191
Energy: 0.07194233056949473
Energy: 0.07204648611172615
Energy: 0.12226393796923796
Energy: 0.07767293678183225
Energy: 0.07221352537088843
Energy: 0.1226158466420552
Energy: 0.06986292480376174
Energy: 0.069770391445511
Energy: 0.12233326869576922
Energy: 0.06980836830739627
Energy: 0.12140551777909034
Energy: 0.07605517202262564
Energy: 0.0700130532232786
Energy: 0.07017846005093314
Energy: 0.07477627921645116
Energy: 0.06975070977845238
Energy: 0.12186814327477945
Energy: 0.12117076612115062
Energy: 0.12237800280081512
Energy: 0.12228371578243406
Energy: 0.12253638787030095
Energy: 0.12202502245926272
Energy: 0.12305443006998927
Energy: 0.07072030882469883
Energy: 0.07246764859115101
Energy: 0.06968415352704053
Energy: 0.07254260591435542
Energy: 0.07207670139752323
Energy: 0.07000622150200161
Energy: 0.12270180152454882
Energy: 0.07181078812434176
Energy: 0.07215887201520302
Energy: 0.12264083478907659
Energy: 0.07185935130312979
Energy: 0.07231007481963508
Energy: 0.12263652419663175
Energy: 0.06986448413296453
Energy: 0.0700318657178787
Energy: 0.12310536117059372
Energy: 0.06999305935323706
Energy: 0.12275565109865216
Energy: 0.07357105656763972
Energy: 0.06985365984857224
Energy: 0.12146123962059144
Energy: 0.07506013600409835
Energy: 0.07012726417915731
Energy: 0.12408184339697736
Energy: 0.07045958364047646
Energy: 0.12196825396427668
Energy: 0.1218611395941008
Energy: 0.06937015160444136
Energy: 0.12180509501712342
Energy: 0.1220437123420008

minimum gb energy = 0.06937015160444136 eV
minimum distance =  2.46436268488124 Angstroms
sigma value = 3


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

Energy: 0.834337235165313
Energy: 0.8562929894961576
Energy: 0.8243895612413397
Energy: 0.744186129357816
Energy: 0.8108392799426903
Energy: 0.7455321544161575
Energy: 0.7991547110007735
Energy: 0.8121202923239323
Energy: 0.8218019375128058
Energy: 0.8122398410852903
Energy: 0.81350930088041
Energy: 0.8201884584061172
Energy: 0.8325112427942318
Energy: 0.7636850543528302
Energy: 0.763007824208264
Energy: 0.8132746545175598
Energy: 0.7635445689774971
Energy: 0.8085354632883195
Energy: 0.7737363038646689
Energy: 0.7647425048857636
Energy: 0.7639550606450812
Energy: 0.7735500747366244
Energy: 0.6978703066059585
Energy: 0.8117854497424918
Energy: 0.7066795605723432
Energy: 0.8225170772357251
Energy: 0.8216272003620771
Energy: 0.7066368169573645
Energy: 0.8124064270896479
Energy: 0.8220990421390167
Energy: 0.7881011249368779
Energy: 0.8201935988066151
Energy: 0.7736292780045283
Energy: 0.6566618557350936
Energy: 0.8197745908295323
Energy: 0.7002472127703182
Energy: 0.7740284515904394
Energy: 0.7183257839278536
Energy: 0.7172240986027968
Energy: 0.7748942771544629
Energy: 0.719888060316062
Energy: 0.7825158073246157
Energy: 0.7746402349414595
Energy: 0.724141291073411
Energy: 0.7070175926936626
Energy: 0.7746338131364824
Energy: 0.6263608207634385
Energy: 0.708759319644905
Energy: 0.7341599802665711
Energy: 0.7068798373992576
Energy: 0.782759065080932
Energy: 0.8057739700079596
Energy: 0.6608604559832562
Energy: 0.7804244824974912
Energy: 0.6687910297926567
Energy: 0.7150606566914218
Energy: 0.7150186500372451
Energy: 0.6685550581172818
Energy: 0.7205007825660545
Energy: 0.7180749970219882
Energy: 0.7731842826736725
Energy: 0.7202346916501277
Energy: 0.7197561602683278
Energy: 0.6347815008726481
Energy: 0.7775392973810253
Energy: 0.6629856535379584
Energy: 0.6662417826080531
Energy: 0.7199426617257474
Energy: 0.7184934371329494
Energy: 0.6663137983872709
Energy: 0.6700853085055899
Energy: 0.6662942629567916
Energy: 0.6686001625981195
Energy: 0.6151466534620361
Energy: 0.6694519189710502
Energy: 0.6688316629682931
Energy: 0.6145086067759943
Energy: 0.6693886890693563
Energy: 0.7639843911654737
Energy: 0.71805962754515
Energy: 0.6675159920103091
Energy: 0.6714679774229009
Energy: 0.6346442161882758
Energy: 0.6701022027264267
Energy: 0.7593500404479705
Energy: 0.6338095564681624
Energy: 0.6335401845674592
Energy: 0.7590706444000525
Energy: 0.6394347840462721
Energy: 0.634731016555068
Energy: 0.7594615035453832
Energy: 0.6351046379438589
Energy: 0.6367687869009898
Energy: 0.6191836829955617
Energy: 0.7532665635277574
Energy: 0.6390722909866821
Energy: 0.6176124604048282
Energy: 0.6357012306338432
Energy: 0.7367042165518319
Energy: 0.6173421733978903
Energy: 0.6361212714050953
Energy: 0.6170500508911081
Energy: 0.6186229174178131
Energy: 0.6889609548521755
Energy: 0.6875117844045583
Energy: 0.6186736852136655
Energy: 0.6190032654805095
Energy: 0.6888174955391628
Energy: 0.7489590419631059
Energy: 0.6937712001470917
Energy: 0.7389999320907292
Energy: 0.6195997216365033
Energy: 0.6178038727502488
Energy: 0.7303367111321761
Energy: 0.7519609895645384
Energy: 0.6173539473144837
Energy: 0.6170679082930953
Energy: 0.7539030426360539
Energy: 0.6234792616980636
Energy: 0.618023428978961
Energy: 0.7527617455409683
Energy: 0.7376566443137182
Energy: 0.7387533526331383
Energy: 0.7528447447385191
Energy: 0.7404405266608567
Energy: 0.735949834009697
Energy: 0.6369134537692895
Energy: 0.7382554785720591
Energy: 0.6353639322684159
Energy: 0.6344420723525878
Energy: 0.7388917078237088
Energy: 0.6338687183387107
Energy: 0.6342280662480317
Energy: 0.6689863614003506
Energy: 0.6700988057368044
Energy: 0.6342802750696134
Energy: 0.6697556900842242
Energy: 0.6709706027193527
Energy: 0.763047066691736
Energy: 0.6692468792714127
Energy: 0.6678548014351292
Energy: 0.6211865903959849
Energy: 0.6678069898516892
Energy: 0.6475732702209829
Energy: 0.7065270143166695
Energy: 0.6663459955019535
Energy: 0.6661004539708179
Energy: 0.7050578438535856
Energy: 0.6669555109219764
Energy: 0.6671573047170786
Energy: 0.7824509939321022
Energy: 0.6871187959018842
Energy: 0.6844998502233381
Energy: 0.7777659092101751
Energy: 0.7404641012153422
Energy: 0.7186944500469088
Energy: 0.7197498767604023
Energy: 0.6852746364724395
Energy: 0.6833244521379696
Energy: 0.7185689209208879
Energy: 0.7861868284942692
Energy: 0.7175496231008137
Energy: 0.6833163774838581
Energy: 0.7838110051469993
Energy: 0.7842853080949154
Energy: 0.6834136428242075
Energy: 0.8174693736602571
Energy: 0.7835079243732965
Energy: 0.7805222006528456
Energy: 0.7750667087632745
Energy: 0.7410001902929126
Energy: 0.6400481456888598
Energy: 0.7747945720879548
Energy: 0.6802103391725702
Energy: 0.7158178985838
Energy: 0.7826972320338346
Energy: 0.7836969227311162
Energy: 0.7159086947391667
Energy: 0.7746139153724104
Energy: 0.7845038918756349
Energy: 0.7843368094935732
Energy: 0.6791502750322651
Energy: 0.7300755394969289
Energy: 0.7842241641749943
Energy: 0.6353131050660427
Energy: 0.7317649868800805
Energy: 0.857136128694052
Energy: 0.7267118221947684
Energy: 0.8170009364923616
Energy: 0.810031850675609
Energy: 0.677761228841953
Energy: 0.7521031645820582
Energy: 0.7268957574745127
Energy: 0.773872273278699
Energy: 0.7740308340122861
Energy: 0.7269679195338415
Energy: 0.7804380090632982
Energy: 0.7740297106938219

minimum gb energy = 0.6145086067759943 eV
minimum distance =  2.26968825298221 Angstroms
sigma value = 67


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

Energy: 1.0024950024254697
Energy: 0.9984389285201172
Energy: 0.978892367355889
Energy: 0.7940129825794078
Energy: 1.1124259500598086
Energy: 0.9816588431522982
Energy: 0.9337320937672295
Energy: 0.973919359518812
Energy: 0.9616425715339706
Energy: 0.9626928509432893
Energy: 0.9693414211325798
Energy: 0.9639196527007188
Energy: 0.9861922773493936
Energy: 0.8861087936626842
Energy: 0.9627293414392681
Energy: 0.9582759999648249
Energy: 0.8896422660777958
Energy: 0.9650269055220926
Energy: 0.8997399895223867
Energy: 0.9600974935685865
Energy: 0.9630542581406898
Energy: 0.9006777810908421
Energy: 0.9009854730044458
Energy: 0.9631794014460898
Energy: 0.8933719015966326
Energy: 0.9725399810168012
Energy: 0.9668324953271639
Energy: 0.8935643849707932
Energy: 0.9679434322316003
Energy: 0.9658074546711047
Energy: 0.923869737105791
Energy: 0.9598567454433015
Energy: 0.8923664818749328
Energy: 0.8201979223369048
Energy: 0.959079118845589
Energy: 0.8932719627747536
Energy: 0.8948701811730929
Energy: 0.9070274068154716
Energy: 0.8993152421519683
Energy: 0.8954822869152611
Energy: 0.9024865331034229
Energy: 0.8285705065356803
Energy: 0.8975361713687896
Energy: 0.7846029628288074
Energy: 0.8160996584582767
Energy: 0.8974338255564411
Energy: 0.77691656395158
Energy: 0.8278046477915865
Energy: 0.9283866338300114
Energy: 0.9010553051195738
Energy: 0.823062623868338
Energy: 0.8235236037058548
Energy: 0.8178743069353019
Energy: 0.8247562781547894
Energy: 0.8578932058862382
Energy: 0.8236179597961468
Energy: 0.8200173051720272
Energy: 0.9356399487577597
Energy: 0.8212991138252069
Energy: 0.8190103717597752
Energy: 0.9312848882392278
Energy: 0.8193081539784453
Energy: 0.8181953206256181
Energy: 0.7786668119439829
Energy: 0.9120563478968404
Energy: 0.875541994664071
Energy: 0.7776245331994704
Energy: 0.8273303873803031
Energy: 0.8199995686774858
Energy: 0.7775977882445824
Energy: 0.8219766806983164
Energy: 0.7759747250052594
Energy: 0.7778086186930186
Energy: 0.7878698309542952
Energy: 0.7776684113860752
Energy: 0.7766986432683098
Energy: 0.7808310224379678
Energy: 0.7754989421705085
Energy: 0.9077263601652034
Energy: 0.779929872573804
Energy: 0.7790220290108805
Energy: 0.7781872314292055
Energy: 0.8496799617178598
Energy: 0.7804995659470002
Energy: 0.9081393057051087
Energy: 0.781562003165376
Energy: 0.7776864622135099
Energy: 0.9092770990025293
Energy: 0.7796402362749341
Energy: 0.7777416180011706
Energy: 0.908709298997899
Energy: 0.8544725414303143
Energy: 0.9054100963752241
Energy: 0.856377356330802
Energy: 0.8552869293590522
Energy: 0.8203149563786533
Energy: 0.8247941409827128
Energy: 0.7752477776419018
Energy: 0.7975402176924036
Energy: 0.8192515440513061
Energy: 0.7674353849878244
Energy: 0.8186060198893332
Energy: 0.8198749748963442
Energy: 0.8208987463744986
Energy: 0.8977391362097698
Energy: 0.8202861326423049
Energy: 0.9025201206075703
Energy: 0.8183996559708904
Energy: 0.906812334953331
Energy: 0.9272730054366438
Energy: 0.8468953558974667
Energy: 0.7908842451395734
Energy: 0.9278725737083199
Energy: 0.8465071453626584
Energy: 0.8188640888569738
Energy: 0.9005407983697874
Energy: 0.8980093058822548
Energy: 0.9001685450306682
Energy: 0.90115594955276
Energy: 0.8968317820882776
Energy: 0.9033849548837547
Energy: 0.9190149058974397
Energy: 0.9433444675083851
Energy: 0.9039584395529706
Energy: 0.9212120992693021
Energy: 0.9427841589128254
Energy: 0.9857171826790154
Energy: 0.7816202410963233
Energy: 0.9431143131708206
Energy: 0.9605883608432441
Energy: 0.7861510906497421
Energy: 0.9418077523991402
Energy: 0.9334124655008464
Energy: 0.9037032871673832
Energy: 0.8943592036579542
Energy: 0.9355857551312238
Energy: 0.8994400633020925
Energy: 0.8972806302123175

minimum gb energy = 0.7674353849878244 eV
minimum distance =  2.26694696520421 Angstroms
sigma value = 33


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

Energy: 1.1360855293184497
Energy: 1.1277828555191651
Energy: 1.130977504878373
Energy: 0.9185836256249582
Energy: 1.0992303479393861
Energy: 1.0526357393082832
Energy: 1.0172869385380165
Energy: 1.0641412763740812
Energy: 0.9692499254150979
Energy: 0.9659325049833395
Energy: 0.9743098637960608
Energy: 0.9646195288701432
Energy: 1.0962475921285508
Energy: 0.9602487537153456
Energy: 1.0221735184394303
Energy: 0.9744620687877029
Energy: 0.9618354824092465
Energy: 1.0472963889905826
Energy: 0.9676009190389585
Energy: 1.0223193064398393
Energy: 1.0243309860059415
Energy: 0.9674772966622044
Energy: 0.9652566963321665
Energy: 1.0472691615703256
Energy: 0.9682560649476926
Energy: 0.974455100895135
Energy: 0.8899323996227964
Energy: 0.9683758027724584
Energy: 0.9727394723351653
Energy: 0.9677188055482793
Energy: 1.0461385263925027
Energy: 0.8888610698993648
Energy: 0.8902531486331796
Energy: 0.8921998351630234
Energy: 0.8945402764808205
Energy: 0.8888484094524104
Energy: 0.9692446257079396
Energy: 0.9747381039388914
Energy: 0.9774948637862032
Energy: 0.9684935036193731
Energy: 0.8907491828053642
Energy: 0.9662897804286988
Energy: 0.9693605160109003
Energy: 0.8872704442831219
Energy: 0.889541978272762
Energy: 0.9692619577104887
Energy: 0.894796993339251
Energy: 0.9666401424554484
Energy: 1.011539461026579
Energy: 0.9781507888173275
Energy: 0.9693824365796823
Energy: 0.9001549775102081
Energy: 0.8899272745793011
Energy: 0.9692244320656519
Energy: 1.0111450897911523
Energy: 0.8898907506893714
Energy: 0.8891896812726917
Energy: 1.013074328902719
Energy: 0.8900433429044308
Energy: 0.889505713687485
Energy: 1.0126368604529545
Energy: 0.889314193971968
Energy: 0.8894122993474067
Energy: 0.892777021392854
Energy: 0.95461634675233
Energy: 0.8896102718906047
Energy: 0.8886586983891128
Energy: 0.889049294144195
Energy: 0.8947986902672653
Energy: 0.8886598674239025
Energy: 0.9055547791297726
Energy: 0.8886225352216022
Energy: 0.8882621436441772
Energy: 0.9681372031299479
Energy: 0.9358584273221832
Energy: 0.888359867642296
Energy: 0.8979123755278144
Energy: 0.8885057987474722
Energy: 1.0151945546980323
Energy: 0.9672931917338253
Energy: 0.9663568203500031
Energy: 0.8703184217084993
Energy: 1.0101239314991448
Energy: 0.8653842986011921
Energy: 0.9479835158986798
Energy: 0.9686619286977622
Energy: 0.9645214214929746
Energy: 0.9510274360610315
Energy: 0.9689926644027478
Energy: 0.9659905027686656
Energy: 0.9677505948363302
Energy: 0.9875787856190069
Energy: 0.9899538929083139
Energy: 0.9689547522555938
Energy: 0.9057522055441428
Energy: 0.9639544293561754
Energy: 1.0979734748113028
Energy: 0.9054604562361162
Energy: 0.9075073714185727
Energy: 0.9745944953102412
Energy: 0.9125095320729296
Energy: 0.9495358358760465
Energy: 1.0991088537694298
Energy: 0.9694483349665216
Energy: 0.8982089440252506
Energy: 0.9656483482337205
Energy: 0.9700095017137271
Energy: 1.0502247615932925
Energy: 1.0720246968225138
Energy: 0.9753194736042667
Energy: 1.086745918995516
Energy: 0.9019709854226482
Energy: 0.9748874907866312
Energy: 0.8627332327974778
Energy: 1.0167255994354407
Energy: 0.9741015844129233
Energy: 1.0569418023108414
Energy: 1.0184589671273916
Energy: 0.9729707093052244
Energy: 0.9673602351348829
Energy: 1.0991610980389428
Energy: 1.024554294499949
Energy: 1.0252541025329158
Energy: 0.9738350998409329
Energy: 0.9739821041588352
Energy: 1.0475587307794763
Energy: 0.9740074026840301
Energy: 0.9598362939293086
Energy: 1.0228682015561195
Energy: 0.9757443197041911
Energy: 0.960882387612831
Energy: 1.0473590212234738
Energy: 0.968176003126729
Energy: 0.9763795521882092
Energy: 0.8999202729908022
Energy: 0.9681058551661152
Energy: 0.9739764060718492
Energy: 0.9650848869440947
Energy: 1.0460159543257677
Energy: 0.8913496546249253
Energy: 0.8915669299460878
Energy: 0.8848002662357044
Energy: 0.8906153685482973
Energy: 0.9604697879664044
Energy: 0.9684490290037667
Energy: 0.9731453408753784
Energy: 0.9735146103957922
Energy: 0.9683852776814552
Energy: 0.8918734475888298
Energy: 0.9660997899997761
Energy: 0.9689750092275814
Energy: 0.8868193285079496
Energy: 0.8896511625494798
Energy: 0.9689884002418141
Energy: 0.8939919249740408
Energy: 0.9669069818801083
Energy: 1.0112126885120465
Energy: 0.8907361368634562
Energy: 0.8903960597915898
Energy: 0.9023623039051267
Energy: 0.9124307187942516
Energy: 0.9020734822545099
Energy: 1.010416866814616
Energy: 0.8898702650691149
Energy: 0.8892447337734924
Energy: 1.012762916901752
Energy: 0.8906465210062294
Energy: 0.8893906129058504
Energy: 1.0126211895546477
Energy: 0.9603516213787627
Energy: 0.8905902889096267
Energy: 0.8943779356815893
Energy: 0.8909045839192609
Energy: 0.8896662646289852
Energy: 0.8883330437712299
Energy: 0.8897865832515156
Energy: 0.890818015393067
Energy: 0.8883987418544478
Energy: 0.9090953841800976
Energy: 0.8884020983536605
Energy: 0.8917522299107984
Energy: 0.8986370102078824
Energy: 0.8898287633984143
Energy: 0.8891393207782867
Energy: 0.9682707231149913
Energy: 0.8888079204151687
Energy: 1.017001849908619
Energy: 0.9667579967934361
Energy: 0.9667037136311445
Energy: 0.8700551004623173
Energy: 1.0141037258918353
Energy: 0.8650789806460876
Energy: 1.0162692978538435
Energy: 0.9687947440596149
Energy: 0.9649000939349354
Energy: 1.0190832985858846
Energy: 0.9697845737059846
Energy: 0.9381885425227672
Energy: 0.9664089726119688
Energy: 0.9863984134006044
Energy: 0.9639789582959571
Energy: 0.9670381343324185
Energy: 0.9060372297323606
Energy: 0.9654986426697089
Energy: 1.1461347457589206
Energy: 0.905066281393762
Energy: 0.9071385183595502
Energy: 0.9769481411083538
Energy: 0.8709438734891396
Energy: 1.03310175230853
Energy: 1.1023550132744213
Energy: 0.9675976768707231
Energy: 1.0487159379254969
Energy: 0.9758186398201661
Energy: 0.9702200825912595
Energy: 0.9651596346596383
Energy: 1.073218864589061
Energy: 0.9762324166143
Energy: 1.0864305108824066
Energy: 0.9095103003994977
Energy: 0.976380195647573
Energy: 0.8623087342553569

minimum gb energy = 0.8623087342553569 eV
minimum distance =  2.29044672226489 Angstroms
sigma value = 41


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

Energy: 1.2472008259290295
Energy: 1.2580990844088469
Energy: 1.0364558739989596
Energy: 1.0342008705600387
Energy: 1.1387293303707968
Energy: 1.0391331514293032
Energy: 1.1094810207304928
Energy: 1.0888154317097403
Energy: 1.0889802392554881
Energy: 1.086211931087793
Energy: 1.0884298883719314
Energy: 1.063433515606205
Energy: 1.2290834792079885
Energy: 1.039571793418618
Energy: 1.0355753935610215
Energy: 1.0861763245309644
Energy: 1.074125043225765
Energy: 1.0371659981237342
Energy: 1.0829289521113012
Energy: 1.0391971908033844
Energy: 1.0363141612828968
Energy: 1.082918324902013
Energy: 1.0411738732355131
Energy: 1.0517420681469267
Energy: 1.066130620865548
Energy: 1.0895392750742128
Energy: 1.062230459074737
Energy: 1.066585547327892
Energy: 1.0890961918721456
Energy: 1.0409149341353514
Energy: 1.1593531067804363
Energy: 1.0428801152539109
Energy: 1.0405769533781528
Energy: 1.0455904941232546
Energy: 1.1400152625593996
Energy: 1.039833550547374
Energy: 1.0649044530286063
Energy: 1.040898815400544
Energy: 1.0616988299627284
Energy: 1.0648302318725469
Energy: 1.0400238103596795
Energy: 1.0439469053186583
Energy: 1.0707586015818125
Energy: 1.0420558209962834
Energy: 1.0409036450535751
Energy: 1.0722300692232485
Energy: 1.0505975105535943
Energy: 1.066627831345638
Energy: 1.1285842290731258
Energy: 1.0429202668197757
Energy: 1.038807144952968
Energy: 1.1306640751103731
Energy: 1.06156455272559
Energy: 1.0389821729734645
Energy: 1.0939266555779468
Energy: 1.0727700367641804
Energy: 1.083123991397844
Energy: 1.0776424753878302
Energy: 1.0672694343641222
Energy: 1.0402073655364203
Energy: 1.1641775264062666
Energy: 1.0966727088305137
Energy: 1.0446351219058536
Energy: 1.1646975300695386
Energy: 1.0151985609243197
Energy: 1.1326005240125614
Energy: 1.2280280884253931
Energy: 1.0152371220923335
Energy: 1.0158191806497396
Energy: 1.0866037844263932
Energy: 1.0146439098843054
Energy: 1.0891518083797564
Energy: 1.2319572748828242
Energy: 1.069835363002068
Energy: 1.0626753510887164
Energy: 1.0872845465067813
Energy: 1.0676602841441591
Energy: 1.0639776585714857
Energy: 1.1759358665004753
Energy: 1.0688235341227452
Energy: 1.0155060365650663
Energy: 1.020367239230877
Energy: 1.085856476653065
Energy: 1.0163704494824997

minimum gb energy = 1.0146439098843054 eV
minimum distance =  2.28227227713834 Angstroms
sigma value = 11


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

Energy: 1.7445770178494557
Energy: 1.3440886660755087
Energy: 1.2429144749378838
Energy: 1.2452961874054134
Energy: 1.2792870304717057
Energy: 1.2309537746654642
Energy: 1.32533954810543
Energy: 1.193610601530981
Energy: 1.1944968599627181
Energy: 1.2312345657269113
Energy: 1.1932934304107625
Energy: 1.2203183759955691
Energy: 1.3866831826221
Energy: 1.1829560159974335
Energy: 1.2184343137364992
Energy: 1.196711836790036
Energy: 1.1819454544306918
Energy: 1.2219980158391466
Energy: 1.2536756594688194
Energy: 1.1820280928100189
Energy: 1.2078466331023
Energy: 1.1994507345414183
Energy: 1.181687298701258
Energy: 1.2204659573813545
Energy: 1.223234969814689
Energy: 1.1936061855793643
Energy: 1.196190167057677
Energy: 1.2227872797346517
Energy: 1.1924398258704292
Energy: 1.2272006485516143
Energy: 1.252153857876961
Energy: 1.2246538801045446
Energy: 1.214805239582405
Energy: 1.1949917793644693
Energy: 1.212543933756714
Energy: 1.2139008898268173
Energy: 1.2122882996928595
Energy: 1.2119196328125401
Energy: 1.2125331802056405
Energy: 1.212016514545366
Energy: 1.2122293990097617
Energy: 1.2069399365023823
Energy: 1.2108362968485606
Energy: 1.1954654998906216
Energy: 1.2265478276526922
Energy: 1.1926464501390512
Energy: 1.2311857994700566
Energy: 1.2170597536985308
Energy: 1.2195949582717278
Energy: 1.1967277987046447
Energy: 1.2206882028848132
Energy: 1.175832814133368
Energy: 1.1932558857230668
Energy: 1.2144771396780163
Energy: 1.2068812713537842
Energy: 1.1966382733611227
Energy: 1.2194113258096324
Energy: 1.1768572032517146
Energy: 1.1936198946639123
Energy: 1.214817956205723
Energy: 1.212093373939751
Energy: 1.1993482868501857
Energy: 1.2243704887732727
Energy: 1.1929005750596202
Energy: 1.1993227331347376
Energy: 1.1967866064200996
Energy: 1.1965795654695641
Energy: 1.1906091153142224
Energy: 1.2197006821739205
Energy: 1.1966955350133168
Energy: 1.2100035782900422
Energy: 1.2163585479491899
Energy: 1.1928469549410192
Energy: 1.2089738963076373
Energy: 1.2093981917248589
Energy: 1.1930340315135455
Energy: 1.208639637605469
Energy: 1.214284967594442
Energy: 1.1996488215688363
Energy: 1.1960465837926204
Energy: 1.2203913440413674
Energy: 1.182638538817705
Energy: 1.2438134818663873
Energy: 1.2202660069275515
Energy: 1.1934806581118207
Energy: 1.2089613618644768
Energy: 1.216031797268697
Energy: 1.1867825543254558
Energy: 1.2051251305023276
Energy: 1.2197013117228963
Energy: 1.1854938908862207
Energy: 1.2107995535906773
Energy: 1.2202362233817692
Energy: 1.187033067856138
Energy: 1.205597675312648
Energy: 1.1844941298319938
Energy: 1.183835237957144
Energy: 1.1990116488407965
Energy: 1.2188805032361927
Energy: 1.1844219989597127
Energy: 1.1950557505382804
Energy: 1.2177461304899666
Energy: 1.2295890787997128
Energy: 1.2570371054469893
Energy: 1.2476642940123652
Energy: 1.199435329869528
Energy: 1.2791099721738601
Energy: 1.2003358828135051
Energy: 1.2007414872143902
Energy: 1.19310255184569
Energy: 1.2001867867758493
Energy: 1.2010719431184957
Energy: 1.1937249287083986
Energy: 1.2194411506549956
Energy: 1.219844428032799
Energy: 1.1845466756734102
Energy: 1.2203042408842535
Energy: 1.2006332812539708
Energy: 1.1844230397675926
Energy: 1.192189197460689
Energy: 1.2866303142653115
Energy: 1.1841013888887906
Energy: 1.2109221830672718
Energy: 1.1948094544053118
Energy: 1.1840119090718404
Energy: 1.1939046638559752
Energy: 1.2423538429225214
Energy: 1.193002557948939
Energy: 1.1960917031126759
Energy: 1.2067555107993029
Energy: 1.195116769030755
Energy: 1.2152795471467035
Energy: 1.2181019090498695
Energy: 1.2024516317874085
Energy: 1.216186791018218
Energy: 1.1811413493347611
Energy: 1.2020207747991876
Energy: 1.2201076256089718
Energy: 1.2810960604394879
Energy: 1.2021048853121736
Energy: 1.218533640896446
Energy: 1.1922643615675075
Energy: 1.2016972120196066
Energy: 1.2017622842868092
Energy: 1.276165193823086
Energy: 1.2108922698143318
Energy: 1.1997231927482728
Energy: 1.2778078606706047
Energy: 1.220785942295631
Energy: 1.2032402740960333
Energy: 1.271335205918508
Energy: 1.2290165710461047
Energy: 1.2168329687377761
Energy: 1.1945987483066052
Energy: 1.216478738245395
Energy: 1.2202228746631167
Energy: 1.2699716943462382
Energy: 1.1837111488425287
Energy: 1.183982875549299
Energy: 1.2005498759997075
Energy: 1.1872843104066761
Energy: 1.2206349305117554
Energy: 1.2709244934897288
Energy: 1.1858387503095855
Energy: 1.2205663682168002
Energy: 1.1995390886553052
Energy: 1.1856031540869316
Energy: 1.2184514821550645
Energy: 1.2754492506968962
Energy: 1.2114408087665591
Energy: 1.2131895514118503
Energy: 1.218646030817224
Energy: 1.2182692510854627
Energy: 1.1975633412308657
Energy: 1.3861051403408107
Energy: 1.1946422974625264
Energy: 1.2458836079043665
Energy: 1.2135595633624203
Energy: 1.1926317673152065
Energy: 1.213381132139396
Energy: 1.2435305505330172
Energy: 1.1983128068981477
Energy: 1.1901117473315364
Energy: 1.1845346282901228
Energy: 1.1963758824581097
Energy: 1.2030825076329321

minimum gb energy = 1.175832814133368 eV
minimum distance =  2.27515339532075 Angstroms
sigma value = 57


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

Energy: 1.5861712336896945
Energy: 1.3317479571337163
Energy: 1.329110402661831
Energy: 1.3260686716681471
Energy: 1.7293420934644068
Energy: 1.3300723724367662
Energy: 1.189377070473954
Energy: 1.221269526033707
Energy: 1.2228537338338556
Energy: 1.222450172369284
Energy: 1.2199016683075488
Energy: 1.2226939819201514
Energy: 1.2786581182375951
Energy: 1.2262453907814241
Energy: 1.219994227175691
Energy: 1.2810792465782452
Energy: 1.2105140231121683
Energy: 1.2226777729015261
Energy: 1.2096430489400127
Energy: 1.218304057553041
Energy: 1.2223557419158546
Energy: 1.2140506023844444
Energy: 1.2005863556000347
Energy: 1.2225674322693991
Energy: 1.2195437917782421
Energy: 1.2186105885034295
Energy: 1.220425723923371
Energy: 1.214681231316719
Energy: 1.215638924060917
Energy: 1.222603339936445
Energy: 1.2093198245444055
Energy: 1.2188113595974541
Energy: 1.2211573383103633
Energy: 1.2206959182535795
Energy: 1.2224023943290576
Energy: 1.2225436959053655
Energy: 1.2735571513560358
Energy: 1.218627132742135
Energy: 1.2237701825920972
Energy: 1.2747406984461036
Energy: 1.210936014433719
Energy: 1.2238208417276055
Energy: 1.2750247422261534
Energy: 1.215498818253871
Energy: 1.2231960210880195
Energy: 1.2185617596087515
Energy: 1.2103064177022824
Energy: 1.2222196197985542
Energy: 1.189445349678584
Energy: 1.2171049093600745
Energy: 1.223767182631348
Energy: 1.1904560843957779
Energy: 1.2121139324963448
Energy: 1.2214579239310228
Energy: 1.2541860960795326
Energy: 1.215879937654093
Energy: 1.2240235550581047
Energy: 1.190362834000477
Energy: 1.2099223366959415
Energy: 1.22093209044895
Energy: 1.273885149064765
Energy: 1.2150642244741299
Energy: 1.2175001035828508
Energy: 1.2192802356868848
Energy: 1.2107738755308535
Energy: 1.2218238829037118
Energy: 1.260094914937827
Energy: 1.2244557810821681
Energy: 1.2197845937689342
Energy: 1.260852968415626
Energy: 1.2299041831867
Energy: 1.2206791332361806
Energy: 1.2224901230848728
Energy: 1.221807681608613
Energy: 1.2197753667538282
Energy: 1.2219472039056816
Energy: 1.220747072330778
Energy: 1.2219641485530857
Energy: 1.208764606222011
Energy: 1.2821268696897934
Energy: 1.212916610217854
Energy: 1.2227661149125166
Energy: 1.276020531043624
Energy: 1.2198642996986582
Energy: 1.2182633277226045
Energy: 1.219306023451424
Energy: 1.223234216256537
Energy: 1.2178964135923116
Energy: 1.2184088503928732
Energy: 1.221645949570552
Energy: 1.279850773827547
Energy: 1.2203722890454294
Energy: 1.2191306774448694
Energy: 1.2751902798483057
Energy: 1.218966958429833
Energy: 1.2226210102536788
Energy: 1.1891261152142991
Energy: 1.2207465787353213
Energy: 1.2224380555869234
Energy: 1.190386012324056
Energy: 1.2194807993267167
Energy: 1.2222241565191614

minimum gb energy = 1.1891261152142991 eV
minimum distance =  2.28842502726561 Angstroms
sigma value = 9


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

Energy: 1.933032627775884
Energy: 1.3589514631942434
Energy: 1.2821312669027394
Energy: 1.2830548157495179
Energy: 1.322825062145199
Energy: 1.283448747188839
Energy: 1.3278379044575574
Energy: 1.278398022741625
Energy: 1.2797326777091615
Energy: 1.2780725907110377
Energy: 1.251105742379286
Energy: 1.2827115180340354
Energy: 1.2998779426685685
Energy: 1.2848902188968363
Energy: 1.2827559964096515
Energy: 1.250465610822332
Energy: 1.292673284284913
Energy: 1.2803949856978567
Energy: 1.2734372404805354
Energy: 1.289068279317532
Energy: 1.28639807650839
Energy: 1.2779390521341465
Energy: 1.2805702215310812
Energy: 1.2846067537927415
Energy: 1.298959894559196
Energy: 1.2543870670408448
Energy: 1.2475226708143623
Energy: 1.2469266538400698
Energy: 1.2517360927625019
Energy: 1.2485700098037047
Energy: 1.2755781331803995
Energy: 1.2755003463849544
Energy: 1.273136443311225
Energy: 1.278295673880271
Energy: 1.27841057853044
Energy: 1.2732904515790768
Energy: 1.2708127486234715
Energy: 1.2690200694447082
Energy: 1.2899030866637144
Energy: 1.2468790310001867
Energy: 1.2732379309670196
Energy: 1.2881576373626207
Energy: 1.3182203231851235
Energy: 1.268256651803747
Energy: 1.2771312173856197
Energy: 1.2767541753194938
Energy: 1.2670468162148576
Energy: 1.275146530933742
Energy: 1.3186978183441866
Energy: 1.2523379931514773
Energy: 1.2541072518361391
Energy: 1.2950687324118546
Energy: 1.2494531218338194
Energy: 1.2791631138206914
Energy: 1.3204464971724201
Energy: 1.252788135178411
Energy: 1.254055851688325
Energy: 1.2949349638449055
Energy: 1.2476258604534296
Energy: 1.249109576261352
Energy: 1.31817420564209
Energy: 1.2630663996172797
Energy: 1.2606808858476481
Energy: 1.2750525494099851
Energy: 1.2654803587557057
Energy: 1.2600372276190095
Energy: 1.3205511916946233
Energy: 1.2588934535622625
Energy: 1.284748538948922
Energy: 1.2999059870758831
Energy: 1.2587366806420792
Energy: 1.2823387798286907
Energy: 1.4768398746071139
Energy: 1.278163147371984
Energy: 1.279422908304597
Energy: 1.2795374638380044
Energy: 1.2764116363146147
Energy: 1.27098567130555
Energy: 1.3270494546644789
Energy: 1.2848473429151375
Energy: 1.2842515573213547
Energy: 1.2837373506531684
Energy: 1.2772963162920368
Energy: 1.285270578205257
Energy: 1.3159452996619154
Energy: 1.2565116633445088
Energy: 1.2524516067557647
Energy: 1.2946307806277606
Energy: 1.2607964364142423
Energy: 1.2529455673692733
Energy: 1.2962692240356186
Energy: 1.2847798317678998
Energy: 1.2467448958322083
Energy: 1.2486351380071545
Energy: 1.2924096554175897
Energy: 1.2512916400026575
Energy: 1.3023782009068805
Energy: 1.2909864495575134
Energy: 1.2869796066153956
Energy: 1.2770971202976389
Energy: 1.2906958623162752
Energy: 1.28423849682792
Energy: 1.3967997573947561
Energy: 1.2794608404413073
Energy: 1.2497117425910205
Energy: 1.2996048482655518
Energy: 1.2747062236527527
Energy: 1.248891654675428
Energy: 1.2962605601590005
Energy: 1.2877547730329095
Energy: 1.284798583425512
Energy: 1.2486401273834642
Energy: 1.2829696413855551
Energy: 1.2816788272823854
Energy: 1.298788860510433
Energy: 1.2898260313173473
Energy: 1.2841369948410943
Energy: 1.2481486147482774
Energy: 1.282225168274043
Energy: 1.2809746398104247
Energy: 1.3027729762753908
Energy: 1.2534057298072934
Energy: 1.2494531611126924
Energy: 1.2661549943305948
Energy: 1.2973368536746817
Energy: 1.2499233912137262

minimum gb energy = 1.2467448958322083 eV
minimum distance =  2.27585012335646 Angstroms
sigma value = 27


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

Energy: 1.7385308950057443
Energy: 1.3008680518359637
Energy: 1.2424955785345642
Energy: 1.2494160379296102
Energy: 1.6838274980849146
Energy: 1.3037936611727092
Energy: 1.3210986684129367
Energy: 1.240351556852515
Energy: 1.2698364823286028
Energy: 1.2371891795728283
Energy: 1.2656769627098874
Energy: 1.2398328220928976
Energy: 1.3628191426731913
Energy: 1.2493770690586818
Energy: 1.2945734738812267
Energy: 1.2339761077332094
Energy: 1.2631870903657982
Energy: 1.2463798432562825
Energy: 1.435375280645102
Energy: 1.2581442963022746
Energy: 1.2413988027352327
Energy: 1.3283800403576196
Energy: 1.2437907835205895
Energy: 1.2340270341222617
Energy: 1.2709487103318664
Energy: 1.2672920178088005
Energy: 1.3382740095361279
Energy: 1.2718060387119006
Energy: 1.3133118026385757
Energy: 1.2407574116961397
Energy: 1.4144399977512367
Energy: 1.3306718269591014
Energy: 1.3240464630522164
Energy: 1.3416641948456907
Energy: 1.3326967894490878
Energy: 1.3197548860278403
Energy: 1.397055262221692
Energy: 1.289951292885254
Energy: 1.2741498819998736
Energy: 1.2343783327896392
Energy: 1.2982754811410437
Energy: 1.2834125624833432
Energy: 1.3856776984283086
Energy: 1.2863203588857477
Energy: 1.3524054436206467
Energy: 1.361581089933928
Energy: 1.2867997253985277
Energy: 1.3519446228753467
Energy: 1.3829615300001832
Energy: 1.3341535610809545
Energy: 1.3382462262340034
Energy: 1.316993900726147
Energy: 1.3338668333740356
Energy: 1.3285552615882714
Energy: 1.3784917676342878
Energy: 1.2945427550569564
Energy: 1.2940967737239581
Energy: 1.3162489498191097
Energy: 1.2954938327989145
Energy: 1.2889348156152636
Energy: 1.3829101441646776
Energy: 1.3402625425096562
Energy: 1.3582754266075034
Energy: 1.3447197655282686
Energy: 1.267631271800981
Energy: 1.3538233834517919
Energy: 1.3487392285345934
Energy: 1.2942595613330374
Energy: 1.2941947711969344
Energy: 1.2946031021303521
Energy: 1.294069682215207
Energy: 1.2939175224808417
Energy: 1.451217713213892
Energy: 1.3462671154996437
Energy: 1.2965683070647034
Energy: 1.2853350549468734
Energy: 1.3438637083458107
Energy: 1.2979634077204267
Energy: 1.4239927014156188
Energy: 1.304055374442228
Energy: 1.3022594194110912
Energy: 1.2806293971190807
Energy: 1.3051656132966463
Energy: 1.3019614639718255
Energy: 1.346653600350649
Energy: 1.2791263381145928
Energy: 1.2833206202680232
Energy: 1.299417478439566
Energy: 1.2748777383562273
Energy: 1.2853259248284294
Energy: 1.3383598034348807
Energy: 1.2825986547670152
Energy: 1.2984550065341198
Energy: 1.3221147041410795
Energy: 1.2793236306184828
Energy: 1.32508225745897
Energy: 1.2616548392364972
Energy: 1.2865183387411314
Energy: 1.2855594894794018
Energy: 1.2730040642212104
Energy: 1.3130115179802735
Energy: 1.285360898887935
Energy: 1.328381088070445
Energy: 1.3316714832884051
Energy: 1.3355939218974326
Energy: 1.313057860786415
Energy: 1.332745498530616
Energy: 1.3237545991436461
Energy: 1.3609120506637375
Energy: 1.2846006635278382
Energy: 1.3025339638771607
Energy: 1.368054363338844
Energy: 1.267664872594283
Energy: 1.299441621549385
Energy: 1.3809984053818483
Energy: 1.271438612558082
Energy: 1.2710136830367547
Energy: 1.2356737300219758
Energy: 1.2729762517821375
Energy: 1.271438629984322
Energy: 1.3800207125794721
Energy: 1.3421234136883498
Energy: 1.32144889671083
Energy: 1.3153457741320833
Energy: 1.334353797136159
Energy: 1.3324516703871288
Energy: 1.2618920860053666
Energy: 1.2674614722899222
Energy: 1.2625601303508183
Energy: 1.262685115381455
Energy: 1.3749112416381701
Energy: 1.2381135340829903
Energy: 1.3781885226971737
Energy: 1.2659389504461853
Energy: 1.2553343703079822
Energy: 1.2337688398759508
Energy: 1.259974513075613
Energy: 1.3325330028334217
Energy: 1.4020648166948806
Energy: 1.2635648684882375
Energy: 1.2663587110883772
Energy: 1.2332637415820642
Energy: 1.2628466872225992
Energy: 1.2435431228380187
Energy: 1.3918654569506077
Energy: 1.26049937109022
Energy: 1.3311956299906036
Energy: 1.2501681476938844
Energy: 1.2631926065252592
Energy: 1.2705772226349157

minimum gb energy = 1.2332637415820642 eV
minimum distance =  2.20736058118418 Angstroms
sigma value = 19


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

Energy: 1.2899965110918288
Energy: 1.3175447098184834
Energy: 1.2699377952203768
Energy: 1.2316822317814127
Energy: 1.2650626497567
Energy: 1.270440687934068
Energy: 1.2696129029404661
Energy: 1.230075049671623
Energy: 1.2263565955773443
Energy: 1.2232605668819863
Energy: 1.2339985194995533
Energy: 1.2246642699364092
Energy: 1.2742121694816682
Energy: 1.2241755000535695
Energy: 1.2266540042413685
Energy: 1.2393831524990058
Energy: 1.2213622200535577
Energy: 1.229305961868192
Energy: 1.2692951106556105
Energy: 1.2253919001958633
Energy: 1.2254725875865091
Energy: 1.2293542694104855
Energy: 1.2255370944619801
Energy: 1.2241784780612437
Energy: 1.2294643476290958
Energy: 1.2313999196451855
Energy: 1.2322722829724109
Energy: 1.2342128802287116
Energy: 1.2391107194931226
Energy: 1.2279312791246253
Energy: 1.2481870303735596
Energy: 1.2261755423572531
Energy: 1.225711857169635
Energy: 1.221702702296748
Energy: 1.2271653122632449
Energy: 1.2246882774489922
Energy: 1.231442193387361
Energy: 1.2191531806480225
Energy: 1.2208431636361792
Energy: 1.22328903497191
Energy: 1.2196732718109862
Energy: 1.2229948149531824
Energy: 1.2662329986336154
Energy: 1.2243112763597055
Energy: 1.2260000353306784
Energy: 1.2347628442875778
Energy: 1.2189538197939804
Energy: 1.2304230755964116
Energy: 1.2115911866934026
Energy: 1.2302571969381653
Energy: 1.2270390115226812
Energy: 1.220617069118001
Energy: 1.2275525489867265
Energy: 1.228415068152296
Energy: 1.2125538562671594
Energy: 1.2347734898741982
Energy: 1.2311719624030781
Energy: 1.2234138333739002
Energy: 1.2380378375399264
Energy: 1.230323838829393
Energy: 1.2729056633945095
Energy: 1.206176510780492
Energy: 1.2089099409846547
Energy: 1.2271989052280836
Energy: 1.2014539893465015
Energy: 1.2119711630761956
Energy: 1.2721485801630943
Energy: 1.206219169339756
Energy: 1.2060886510449378
Energy: 1.2129380417923923
Energy: 1.201872669389267
Energy: 1.2061782088425235
Energy: 1.2606156459908038
Energy: 1.2176530612091068
Energy: 1.227338602477806
Energy: 1.2120296491979157
Energy: 1.2193732520026512
Energy: 1.2087441149534786
Energy: 1.3046491896151529
Energy: 1.23969575561992
Energy: 1.2263679102298588
Energy: 1.1959676123472627
Energy: 1.2385692935787622
Energy: 1.2261889597711784
Energy: 1.2701025111960165
Energy: 1.2000853518812749
Energy: 1.211278365066828
Energy: 1.2119212075613153
Energy: 1.1961022557848533
Energy: 1.2116188073591971
Energy: 1.2830398463821224
Energy: 1.2063887738994599
Energy: 1.214692968661575
Energy: 1.2082733733617437
Energy: 1.1956933530733063
Energy: 1.2160833589735056
Energy: 1.2322268752163403
Energy: 1.2296743513067308
Energy: 1.2404717814508461
Energy: 1.1900904140265653
Energy: 1.2403286625447019
Energy: 1.2406068126747076
Energy: 1.2779736971039235
Energy: 1.2098459552669063
Energy: 1.2099333846529103
Energy: 1.1918459553713843
Energy: 1.2082194221407427
Energy: 1.2074535614452422
Energy: 1.2798310722949562
Energy: 1.202851004751205
Energy: 1.2060268579770936
Energy: 1.2449290557548967
Energy: 1.192397260320611
Energy: 1.2378433800124342
Energy: 1.2583302502454248
Energy: 1.195343103856575
Energy: 1.1967421075436167
Energy: 1.2392416250516904
Energy: 1.19258271063008
Energy: 1.2104310518382633
Energy: 1.1922975103415454
Energy: 1.2107413292112386
Energy: 1.2104921482294464
Energy: 1.198754875697349
Energy: 1.2103398272667434
Energy: 1.2077156189983165
Energy: 1.1894562650451228
Energy: 1.2120725725193477
Energy: 1.210002310452348
Energy: 1.1909939395828335
Energy: 1.215657651066514
Energy: 1.2090030580655131
Energy: 1.2392841197717535
Energy: 1.1983312158905501
Energy: 1.2030785999763924
Energy: 1.23582315130268
Energy: 1.1869852728577621
Energy: 1.2152317215554833
Energy: 1.2745424664965317
Energy: 1.1999979711223554
Energy: 1.2072516957557684
Energy: 1.250515728103476
Energy: 1.1869077010305933
Energy: 1.2104785752209402
Energy: 1.2746048038653826
Energy: 1.214259884487108
Energy: 1.2109635003416153
Energy: 1.1981182687889322
Energy: 1.203699113622704
Energy: 1.209330303344902
Energy: 1.2307820583777271
Energy: 1.2276243334100283
Energy: 1.2282721029057604
Energy: 1.2144392805532989
Energy: 1.2278040120159779
Energy: 1.226611639856973
Energy: 1.2746388458332294
Energy: 1.2250414169164712
Energy: 1.2246721153133335
Energy: 1.225403142354478
Energy: 1.221658406369116
Energy: 1.2265326617248355
Energy: 1.2737275491099138
Energy: 1.223140738500478
Energy: 1.2246187103980783
Energy: 1.2293005606222345
Energy: 1.2220184974866135
Energy: 1.2252930527492505
Energy: 1.2827511635330089
Energy: 1.2735921537534833
Energy: 1.2722450379070154
Energy: 1.1758850841758117
Energy: 1.2666376001652015
Energy: 1.2094292311248298

minimum gb energy = 1.1758850841758117 eV
minimum distance =  2.26405478491874 Angstroms
sigma value = 101


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

Energy: 1.7719952418939593
Energy: 1.1857004280305061
Energy: 1.1844456828086725
Energy: 1.1195139691219105
Energy: 1.1913022780903533
Energy: 1.179927195338557
Energy: 1.293968938533046
Energy: 1.1569793565073139
Energy: 1.1851565450331016
Energy: 1.156487323739741
Energy: 1.155373456472704
Energy: 1.1820546927964173
Energy: 1.2551339038213611
Energy: 1.1641454404062852
Energy: 1.1696932567215108
Energy: 1.1882953838862567
Energy: 1.155839556246762
Energy: 1.1844876035710685
Energy: 1.2358386310921985
Energy: 1.1726469773928843
Energy: 1.1831308726131222
Energy: 1.1798087991904047
Energy: 1.1611982576682995
Energy: 1.181965623392959
Energy: 1.1666895911598005
Energy: 1.1879008007631113
Energy: 1.1869795492284054
Energy: 1.1713202042357347
Energy: 1.188466632698153
Energy: 1.1833077606172537
Energy: 1.1800868356902008
Energy: 1.176934627374417
Energy: 1.1810382606829501
Energy: 1.1494724548717448
Energy: 1.17301706761291
Energy: 1.1824024223034837
Energy: 1.2345338123065266
Energy: 1.1523581686377184
Energy: 1.1510808623410211
Energy: 1.19251600272115
Energy: 1.1489377637940865
Energy: 1.1802857900004018
Energy: 1.196837412784143
Energy: 1.1627275332204439
Energy: 1.1681598608228523
Energy: 1.1910178221596102
Energy: 1.1571856534049405
Energy: 1.1594019631743981
Energy: 1.1499561569579233
Energy: 1.1820283994964174
Energy: 1.174156302334601
Energy: 1.15481245771548
Energy: 1.1829248192317632
Energy: 1.1699374494132526
Energy: 1.1474297716372743
Energy: 1.1963570992532435
Energy: 1.1923929739177257
Energy: 1.1555777603924444
Energy: 1.1937191179302367
Energy: 1.1907977590459582
Energy: 1.2456782952226129
Energy: 1.1174488172115808
Energy: 1.11881773656423
Energy: 1.1825014527165194
Energy: 1.1230693752834817
Energy: 1.1774301378548888
Energy: 1.261834203370508
Energy: 1.165150215484554
Energy: 1.1711044356078886
Energy: 1.1649020678797515
Energy: 1.1551335924866175
Energy: 1.1686952625428888
Energy: 1.1800420554616071
Energy: 1.1816297715297952
Energy: 1.1828788994930777
Energy: 1.1483081100198265
Energy: 1.182428462025554
Energy: 1.1721599979424016
Energy: 1.1792047363378675
Energy: 1.1612655738451165
Energy: 1.1858657488273179
Energy: 1.1579249151817501
Energy: 1.187980978747472
Energy: 1.182485596819266
Energy: 1.2563021665449332
Energy: 1.160770069786392
Energy: 1.1684041860954377
Energy: 1.187937082287712
Energy: 1.155744907177857
Energy: 1.179204819179503
Energy: 1.2558531309493883
Energy: 1.165386508117584
Energy: 1.1814778874065455
Energy: 1.182896485843488
Energy: 1.1604132664260172
Energy: 1.1824654620269275
Energy: 1.1877530920070267
Energy: 1.1634801558508991
Energy: 1.1874313766729527
Energy: 1.1169506435112748
Energy: 1.1854407846480108
Energy: 1.1141308326517478
Energy: 1.3012667827089348
Energy: 1.1825774561331315
Energy: 1.187144521338632
Energy: 1.1847850710580987
Energy: 1.1823849162962254
Energy: 1.1844447538355376
Energy: 1.254040838543753
Energy: 1.163185882101353
Energy: 1.1696026460039979
Energy: 1.1851658425036766
Energy: 1.1544730022477483
Energy: 1.1588503504987904
Energy: 1.2336651204077917
Energy: 1.1648824468197732
Energy: 1.1594717147802407
Energy: 1.1828849872780247
Energy: 1.1549787561940343
Energy: 1.1800328253628625
Energy: 1.1696696011961876
Energy: 1.181379162377377
Energy: 1.1828328067542795
Energy: 1.1754686305843605
Energy: 1.1821031090478227
Energy: 1.1816941876899916
Energy: 1.1817401074298033
Energy: 1.1571115496804087
Energy: 1.1837135936152465
Energy: 1.1594184003594175
Energy: 1.1567313941657023
Energy: 1.1608480156716496
Energy: 1.200164045944453
Energy: 1.1566341134997329
Energy: 1.1493137980802377
Energy: 1.187555301337819
Energy: 1.15357083745292
Energy: 1.1488726932814204
Energy: 1.2180237190977528
Energy: 1.1603531336622308
Energy: 1.1470242392293117
Energy: 1.191104290124115
Energy: 1.1561219160770382
Energy: 1.188038552556204
Energy: 1.1578047750408358
Energy: 1.1591761505438616
Energy: 1.1573078421422132
Energy: 1.1603442184035146
Energy: 1.1818375539836075
Energy: 1.1588164934324827
Energy: 1.1496923099780483
Energy: 1.1593852807569975
Energy: 1.185887715928593
Energy: 1.15591339302643
Energy: 1.1603182107202525
Energy: 1.1822592029268157
Energy: 1.1852463235427644
Energy: 1.118427103065485
Energy: 1.11859480724514
Energy: 1.1573916944808345
Energy: 1.1228191144231106
Energy: 1.11893929701981
Energy: 1.2548911411053174
Energy: 1.1214381813682837
Energy: 1.1221652733158867
Energy: 1.187419151639111
Energy: 1.1241561033104785
Energy: 1.1831676463219276
Energy: 1.1790267437815307
Energy: 1.1885646122584157
Energy: 1.1823676087512847
Energy: 1.1490825074132018
Energy: 1.1893725332608185
Energy: 1.1798343372585938
Energy: 1.1825918677495544
Energy: 1.1555188958491607
Energy: 1.1836452599854077
Energy: 1.1495977325983655
Energy: 1.1574016617748104
Energy: 1.1811947432136205
Energy: 1.254926793271347
Energy: 1.156220753044996
Energy: 1.1772774425691352
Energy: 1.160687197070771
Energy: 1.15410714431492
Energy: 1.182253275702086
Energy: 1.2559030613758455
Energy: 1.1575261613176742
Energy: 1.1593236676698349
Energy: 1.1823702810794807
Energy: 1.1600561136534084
Energy: 1.1808377681015552
Energy: 1.190558624499698
Energy: 1.1601461177643917
Energy: 1.1689909354069494
Energy: 1.1144467102179814
Energy: 1.1531717642273718
Energy: 1.1858066484166923

minimum gb energy = 1.1141308326517478 eV
minimum distance =  2.25403745036452 Angstroms
sigma value = 33


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

Energy: 0.020486645654990473
Energy: 0.02127870776845189
Energy: 0.02123147355837803
Energy: 0.023180701921985906
Energy: 1.1515022900024279
Energy: 0.02116648131002954
Energy: 0.021176750804166405
Energy: 0.16794810156447895
Energy: 0.1653928057900124
Energy: 0.16672434682270598
Energy: 0.16754688942388235
Energy: 0.16511883158304969
Energy: 1.5884779464231131
Energy: 1.152864319105287
Energy: 1.1499858257742097
Energy: 1.1464899381594136
Energy: 1.1508360837213802
Energy: 1.1498989458072395
Energy: 0.598935433690306
Energy: 0.16794810156536272
Energy: 0.16539280578912866
Energy: 0.16672434682088647
Energy: 0.1675468894265856
Energy: 0.1651188315812302

minimum gb energy = 0.020486645654990473 eV
minimum distance =  2.45652953117965 Angstroms
sigma value = 1