Model name: model_name=EAM_Dynamo_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5224674642086033
cohesive_energy=4.44900897936396
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=[3.6166253594608797e-19, 4.2564385764824396e-19, 4.66270250556582e-19, 4.9848521613642e-19, 5.25419407530594e-19, 5.48566053361992e-19, 5.688544160783339e-19, 5.86991055575214e-19, 6.03656896922082e-19, 6.18943264187076e-19, 6.32898222669216e-19, 6.455938703170321e-19, 6.57113520315492e-19, 6.67532474966394e-19, 6.76826701620228e-19, 6.849657589209479e-19, 6.91960862104992e-19, 6.97839248175138e-19, 7.02640971547236e-19, 7.064221084034759e-19, 7.09257961045656e-19, 7.11217423069038e-19, 7.123645815389819e-19, 7.12753910461044e-19, 7.122556335278699e-19, 7.1047561528749605e-19, 7.06917180983382e-19, 7.0100194485065395e-19, 6.920393687600579e-19, 6.792155469815219e-19, 6.615643670047439e-19, 6.379002181205639e-19, 6.06779539181748e-19, 5.66515238192694e-19, 5.151414444234839e-19, 4.50293345162334e-19, 3.6909823770448196e-19, 2.68159507585848e-19, 1.434393492534252e-19, -1.002244797751968e-20, -1.98762828860772e-19, -4.35570944072508e-19, -7.412037609509819e-19, -1.14329722425606e-18, -1.6786004594418e-18, -2.3959269820162798e-18, -3.36324112479378e-18, -4.6808391450627e-18, -6.512543603649539e-18, -9.1541964160224e-18, -1.3153934252205357e-17, -1.9585808262333e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018071199013523883
Energy: 0.5259405778569283
Energy: 0.018696845893823234
Energy: 0.01839626679766349
Energy: 0.5260423429730674
Energy: 0.018856797916087634
Energy: 0.5259405778569283
Energy: 0.13502961159410934
Energy: 0.13508828676039666
Energy: 0.13461438411849683
Energy: 0.13439200363834364
Energy: 0.13466713371869732
Energy: 0.01869684589187813
Energy: 0.13508828675944248
Energy: 0.13498996814705222
Energy: 0.01945478778278294
Energy: 0.1344721109303852
Energy: 0.13440582187046912
Energy: 0.01839626679733319
Energy: 0.13461438411882712
Energy: 0.019454787782159037
Energy: 0.018794482884736882
Energy: 0.13470350961668662
Energy: 0.01867812151316759
Energy: 0.5260423429730674
Energy: 0.13439200363863724
Energy: 0.1344721109300549
Energy: 0.13470350961668662
Energy: 0.13450492499962685
Energy: 0.13447352184129321
Energy: 0.018856797916087634
Energy: 0.134667133718367
Energy: 0.13440582187046912
Energy: 0.01867812151316759
Energy: 0.1344735218406326
Energy: 0.01874357601540477

minimum gb energy = 0.018071199013523883 eV
minimum distance =  2.48564284068035 Angstroms
sigma value = 1


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

Energy: 1.6188880159123222
Energy: 1.6780433428843762
Energy: 1.1325863618597682
Energy: 1.121283270893449
Energy: 1.1442704987446142
Energy: 1.133363272947953
Energy: 1.523558680434989
Energy: 1.152407819498274
Energy: 1.1527962563703862
Energy: 1.1243181313817423
Energy: 1.1530859125267487
Energy: 1.1048273870304608
Energy: 1.340967343090078
Energy: 1.1022205597628278
Energy: 1.0781765573845172
Energy: 1.1034155869780518
Energy: 1.152729325361567
Energy: 1.0788865335213211
Energy: 1.6693132002127455
Energy: 1.0785656744030072
Energy: 1.1080910475805072
Energy: 1.0845832970898288
Energy: 1.078330508463049
Energy: 1.0842465868519526
Energy: 1.5395706895023442
Energy: 1.1513243291754387
Energy: 1.1508818243562164
Energy: 1.12954115235266
Energy: 1.151544087241888
Energy: 1.1514488512955912
Energy: 1.5078763186792903
Energy: 1.127933621305245
Energy: 1.1281284530335982
Energy: 1.1238609416032084
Energy: 1.1279405751668763
Energy: 1.1297035683872076
Energy: 1.5049491651036808
Energy: 1.1078784179393695
Energy: 1.127838814040886
Energy: 1.1242143986817692
Energy: 1.106762851734844
Energy: 1.125343008658339
Energy: 1.425073500024206
Energy: 1.1364799109440027
Energy: 1.1368598823164844
Energy: 1.1145390181031043
Energy: 1.1382149393433414
Energy: 1.1276415021099915
Energy: 1.222885814298588
Energy: 1.1247375360209895
Energy: 1.1261069768581777
Energy: 1.139354109216022
Energy: 1.1244491140729804
Energy: 1.1235384351902205
Energy: 1.223107742576494
Energy: 1.1382525611923913
Energy: 1.1305585665787559
Energy: 1.1510613808438475
Energy: 1.140087271272196
Energy: 1.1508448805950224
Energy: 1.300393056308222
Energy: 1.1090741973172953
Energy: 1.1100548804768182
Energy: 1.2570118319800672
Energy: 1.1090357848561392
Energy: 1.0562245475228298
Energy: 1.152820914945072
Energy: 1.08443737657182
Energy: 1.085147122896467
Energy: 1.1528679554900683
Energy: 1.139748463983372
Energy: 1.0795330616871668
Energy: 1.1525656264125015
Energy: 1.1253449550483139
Energy: 1.152760238985091
Energy: 1.1524832978146158
Energy: 1.138638282188222
Energy: 1.1301954028510597
Energy: 1.1733494686006412
Energy: 1.0849905434886151
Energy: 1.0844934606941752
Energy: 1.1289368984543915
Energy: 1.0850024593224215
Energy: 1.0783481193324356
Energy: 1.1729057759641144
Energy: 1.1382545158991422
Energy: 1.1114727142048373
Energy: 1.1639005336696062
Energy: 1.1420114237484877
Energy: 1.1604825256306874
Energy: 1.1728804305349285
Energy: 1.0844338881227495
Energy: 1.0841795610221006
Energy: 1.139048243498936
Energy: 1.0834898266997282
Energy: 1.0836527096987243
Energy: 1.3358053242708952
Energy: 1.1276804111743377
Energy: 1.125951704587677
Energy: 1.0854889839587851
Energy: 1.125718028881426
Energy: 1.0860691421881095
Energy: 1.341741945308072
Energy: 1.121258945527562
Energy: 1.1394932857661155
Energy: 1.1387529073722231
Energy: 1.1455259952814305
Energy: 1.1398573604639715
Energy: 1.3400446410815794
Energy: 1.1395530692434597
Energy: 1.137963134627299
Energy: 1.1388324082792178
Energy: 1.140032119847671
Energy: 1.1384300468579558
Energy: 1.348878146689066
Energy: 1.1400688894193034
Energy: 1.1391845655617183
Energy: 1.123167287439055
Energy: 1.1401736506852542
Energy: 1.1379723278055787
Energy: 1.619788449784611
Energy: 1.0512651695723134
Energy: 1.1092091032864844
Energy: 1.1096521906506018
Energy: 1.1488836104698146
Energy: 1.1090386077751329
Energy: 1.600707396175608
Energy: 1.083635949012455
Energy: 1.0831797709440147
Energy: 1.1046698088152125
Energy: 1.1573414603366372
Energy: 1.084098178212815
Energy: 1.5932949923057618
Energy: 1.1603887446126375
Energy: 1.1604924015628304
Energy: 1.0985717673898097
Energy: 1.1615711275751182
Energy: 1.1360683520511992

minimum gb energy = 1.0512651695723134 eV
minimum distance =  2.33218966389886 Angstroms
sigma value = 33


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

Energy: 1.8413435715900892
Energy: 1.1174855198410758
Energy: 1.1210335420308355
Energy: 1.1228865478033236
Energy: 1.2261912005973166
Energy: 1.1456009144513073
Energy: 1.4643365980718406
Energy: 1.1628256332117213
Energy: 1.1478593643907582
Energy: 1.1711161674364314
Energy: 1.1622276483721408
Energy: 1.148210089076413
Energy: 1.4404045779165735
Energy: 1.1327060729329184
Energy: 1.1347316838928148
Energy: 1.1377763963420708
Energy: 1.1685139926945978
Energy: 1.1150328963386495
Energy: 1.567393846116938
Energy: 1.1841285517513507
Energy: 1.121095587017115
Energy: 1.135064737373775
Energy: 1.1804364020296
Energy: 1.1342215935243443
Energy: 1.4605057473144964
Energy: 1.2428846502180255
Energy: 1.1703796248560072
Energy: 1.1558577710075355
Energy: 1.1648586018493963
Energy: 1.2416127449606964
Energy: 1.5570264391928352
Energy: 1.1794449110585064
Energy: 1.1798569351492614
Energy: 1.1808549049228272
Energy: 1.1800695894300115
Energy: 1.181122679642026
Energy: 1.5580176542705495
Energy: 1.1721081054038505
Energy: 1.1741746049732291
Energy: 1.1878059784486905
Energy: 1.1741749423094847
Energy: 1.1799216676224256
Energy: 1.4628614546030774
Energy: 1.1869977838095338
Energy: 1.189718863566433
Energy: 1.227057595581966
Energy: 1.188273253801498
Energy: 1.1895444591776962
Energy: 1.2915716856466641
Energy: 1.187008700643822
Energy: 1.190440010081768
Energy: 1.2425080568480669
Energy: 1.1871353108961682
Energy: 1.1992512422181896
Energy: 1.288484203675368
Energy: 1.2273755041210601
Energy: 1.1998019377389104
Energy: 1.2375897825149533
Energy: 1.2360674232408775
Energy: 1.235349128501575
Energy: 1.3507656546618634
Energy: 1.023145500639891
Energy: 1.0230344641132896
Energy: 1.1946284258179523
Energy: 1.0230111232345964
Energy: 1.0232009820216423
Energy: 1.2277026202685029
Energy: 1.0975070922594532
Energy: 1.1737621117400299
Energy: 1.228117154170276
Energy: 1.1522528829192131
Energy: 1.1648969845480257
Energy: 1.2300914541016832
Energy: 1.2127189086910388
Energy: 1.2021197441002422
Energy: 1.2270707812730686
Energy: 1.2459923315965666
Energy: 1.1966458316208761
Energy: 1.3420569872273052
Energy: 1.1352535451202663
Energy: 1.1351116904014968
Energy: 1.339766946229343
Energy: 1.1350795700135248
Energy: 1.167130874709131
Energy: 1.2748901960485015
Energy: 1.2265324412329688
Energy: 1.236475700532181
Energy: 1.2390025807518084
Energy: 1.2264880121767192
Energy: 1.2409578464924997
Energy: 1.2788311104451344
Energy: 1.1763986918200013
Energy: 1.176720867144155
Energy: 1.1778664927297688
Energy: 1.1765361903470295
Energy: 1.1774454939237218
Energy: 1.4609986235279266
Energy: 1.1835120424639693
Energy: 1.1831845005165422
Energy: 1.2031088737940572
Energy: 1.1830238862582676
Energy: 1.1833341182169181
Energy: 1.327384250636881
Energy: 1.2082683708561646
Energy: 1.1971898615441254
Energy: 1.1882199254773465
Energy: 1.2336254724407558
Energy: 1.1872080550701574
Energy: 1.3273785736380987
Energy: 1.2432124159332503
Energy: 1.2132002707047367
Energy: 1.1862128277638178
Energy: 1.2410412006457605
Energy: 1.1916371261402683
Energy: 1.4796214069806668
Energy: 1.240705282809907
Energy: 1.2372629942385904
Energy: 1.2373222963280195
Energy: 1.2408708867384235
Energy: 1.2356834595578317
Energy: 1.2847811376660827
Energy: 1.1934088955294513
Energy: 1.0224874106161401
Energy: 1.0234900851367317
Energy: 1.2639042901829225
Energy: 1.0224455978437423
Energy: 1.2839930341196677
Energy: 1.1696106604483667
Energy: 1.1659766682150217
Energy: 1.085322019069719
Energy: 1.2249421085615884
Energy: 1.1732716459784969
Energy: 1.50649047137123
Energy: 1.2238022169018097
Energy: 1.2101731626701844
Energy: 1.2371895954299263
Energy: 1.2233963187331807
Energy: 1.2143103276739673
Energy: 1.5728303517259599
Energy: 1.3104030722896172
Energy: 1.3138489969560612
Energy: 1.1331137595399066
Energy: 1.3120485652065312
Energy: 1.1691891907121046
Energy: 1.4563483452082848
Energy: 1.2330202215328372
Energy: 1.2155676087968326
Energy: 1.2353415658407294
Energy: 1.2381098693030927
Energy: 1.2393449270054144
Energy: 1.458323455610772
Energy: 1.1755495913338125
Energy: 1.1789336251704077
Energy: 1.1764130857185
Energy: 1.177231482541116
Energy: 1.1774750422875186
Energy: 1.5564135572600528
Energy: 1.1828155399271512
Energy: 1.1834961908442354
Energy: 1.1850304142962678
Energy: 1.2043216599114712
Energy: 1.1832537798765301
Energy: 1.4581857911461138
Energy: 1.1865098766824966
Energy: 1.1878279599984303
Energy: 1.2607049043230296
Energy: 1.1863172256962045
Energy: 1.2137916030107097
Energy: 1.294149581899776
Energy: 1.1864831011568195
Energy: 1.1870020691009115
Energy: 1.2417522440254953
Energy: 1.1865146278575884
Energy: 1.1990060047395605
Energy: 1.288707059055938
Energy: 1.233716751104527
Energy: 1.2222126955445591
Energy: 1.2367086424235398
Energy: 1.2210548826933316
Energy: 1.2340829733099719
Energy: 1.3352161310367852
Energy: 1.0228894323257698
Energy: 1.0221593230247168
Energy: 1.1648426152858606
Energy: 1.022036190058999
Energy: 1.0222047782053745
Energy: 1.2238215678389703
Energy: 1.0226240060021543
Energy: 1.022175991190005
Energy: 1.2207215140385153
Energy: 1.0233300451172933
Energy: 1.1631328140159565
Energy: 1.2253646679549168
Energy: 1.223960304169896
Energy: 1.2012926114941387
Energy: 1.2226366278582588
Energy: 1.2316181042067806
Energy: 1.2101606830697826
Energy: 1.230412041479101
Energy: 1.13446410375172
Energy: 1.134968741884166
Energy: 1.22750476313146
Energy: 1.1683325163536473
Energy: 1.1692156141945658
Energy: 1.274339941032464
Energy: 1.2294635993077965
Energy: 1.2411861520501042
Energy: 1.2431515498766517
Energy: 1.2366394588520646
Energy: 1.2078052088623066
Energy: 1.2745175456811466
Energy: 1.1794558790568817
Energy: 1.180260367376393
Energy: 1.2474607155607296
Energy: 1.1801336930494453
Energy: 1.1793254795531174
Energy: 1.2742300092097651
Energy: 1.1828044139501706
Energy: 1.0843891750523016
Energy: 1.1990649529812285
Energy: 1.084361998078232
Energy: 1.1823481099097237
Energy: 1.327692027562089
Energy: 1.197238673567035
Energy: 1.1272393725787309
Energy: 1.1865911967239473
Energy: 1.1206109886985791
Energy: 1.197509061200599
Energy: 1.3396255602680414
Energy: 1.137876389081222
Energy: 1.1284445517475838
Energy: 1.188741255996018
Energy: 1.1756387141667088
Energy: 1.1877895512359204
Energy: 1.4601870489890203
Energy: 1.1753131031617596
Energy: 1.16316522395282
Energy: 1.1540926843470574
Energy: 1.1773148899694192
Energy: 1.177325015031557
Energy: 1.7535673505330627
Energy: 1.0918445588861114
Energy: 1.0219756443479855
Energy: 1.0236970598176847
Energy: 1.0917645437486592
Energy: 1.0683365884480858

minimum gb energy = 1.0219756443479855 eV
minimum distance =  2.34388512302053 Angstroms
sigma value = 51


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

Energy: 1.6862531120642497
Energy: 1.7060206162694231
Energy: 1.0959966278785809
Energy: 1.1025676709282395
Energy: 1.128967069019881
Energy: 1.1037459797793852
Energy: 1.318474955499854
Energy: 1.1718874308140423
Energy: 1.1721082318594083
Energy: 1.101373570748722
Energy: 1.1716610267576846
Energy: 1.1286991030556481
Energy: 1.5567310609544478
Energy: 1.1353349893664713
Energy: 1.1057074402121667
Energy: 1.0832626035213029
Energy: 1.1339351382205092
Energy: 1.0609180029333711
Energy: 1.54301826132057
Energy: 1.0606813831958968
Energy: 1.061019455964706
Energy: 1.1053589142624265
Energy: 1.09029487831231
Energy: 1.0827705218389432
Energy: 1.3188507046981603
Energy: 1.1727124389733181
Energy: 1.1723818410364055
Energy: 1.0890165696391891
Energy: 1.172335699035305
Energy: 1.1312254350397055
Energy: 1.3184666568290575
Energy: 1.1328980584474915
Energy: 1.1314444552995069
Energy: 1.1730342955082638
Energy: 1.1333000358128547
Energy: 1.1311064279284397
Energy: 1.3170964944590937
Energy: 1.132786961035754
Energy: 1.1325302917914932
Energy: 1.1738833317975996
Energy: 1.1426643048710148
Energy: 1.1720918203098436
Energy: 1.3509465001304475
Energy: 1.033145908222027
Energy: 1.0329506216691882
Energy: 1.0901050652947897
Energy: 1.0337323939184466
Energy: 1.0327520753970574
Energy: 1.1716976735558158
Energy: 1.0331624970391895
Energy: 1.0328845438573622
Energy: 1.1717266188714544
Energy: 1.0337880856878143
Energy: 1.06090190604496
Energy: 1.1729124243448565
Energy: 1.0456833209368472
Energy: 1.0812373467243874
Energy: 1.1731776062877057
Energy: 1.110235558620476
Energy: 1.172189292267139
Energy: 1.172695532496415
Energy: 1.0790563892099143
Energy: 1.057913695636135
Energy: 1.1295859975655358
Energy: 1.0516660374373854
Energy: 1.0572058751539013
Energy: 1.203448452668517
Energy: 1.0458577471051085
Energy: 1.0932717323701115
Energy: 1.1922143953434627
Energy: 1.1277250279636817
Energy: 1.1291459281096121
Energy: 1.2029284449127082
Energy: 1.0826103293375857
Energy: 1.082228125354302
Energy: 1.1961132488346662
Energy: 1.0833718414384053
Energy: 1.083598624489936
Energy: 1.2044348988270965
Energy: 1.088466536083995
Energy: 1.0881974197405264
Energy: 1.1526646966539429
Energy: 1.1079578822349985
Energy: 1.1278678183645185
Energy: 1.395574873316307
Energy: 1.1073792572929086
Energy: 1.0960486958989841
Energy: 1.120206848524601
Energy: 1.1231782400975323
Energy: 1.0961109208983963
Energy: 1.4015049535407522
Energy: 1.1137324645541498
Energy: 1.0864155936225761
Energy: 1.1203823128140324
Energy: 1.1517044851875073
Energy: 1.1381381236506414
Energy: 1.4471977668989895
Energy: 1.1926618910098148
Energy: 1.1924065434801314
Energy: 1.128845621271197
Energy: 1.1920038230146695
Energy: 1.1550935253049452
Energy: 1.6860802780543511
Energy: 1.1288152932249922
Energy: 1.0751559128526718
Energy: 1.0313637524074089
Energy: 1.1296832770727383
Energy: 1.0752441246940543

minimum gb energy = 1.0313637524074089 eV
minimum distance =  2.37066133737846 Angstroms
sigma value = 19


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

Energy: 1.420440151570064
Energy: 1.0793418533893548
Energy: 0.9781622361720285
Energy: 1.2264234080532712
Energy: 1.080308325317633
Energy: 0.9760786985742312
Energy: 1.2461049871319327
Energy: 1.0785990297078147
Energy: 1.0781870993840805
Energy: 0.998277124554414
Energy: 1.0787313066199904
Energy: 1.0229395839481872
Energy: 1.5426230579152818
Energy: 1.0788032846912046
Energy: 1.0790475042401468
Energy: 0.9595375173600421
Energy: 1.0786230821674336
Energy: 1.078744361459956
Energy: 1.2366930896162853
Energy: 1.078806240460888
Energy: 1.0790098627513318
Energy: 1.051560549374784
Energy: 1.0216488258314165
Energy: 1.0228984352728692
Energy: 1.2467650489184243
Energy: 1.078355880323438
Energy: 1.0638357441020119
Energy: 0.9973030798414836
Energy: 1.0631775867622792
Energy: 1.0631181766211621
Energy: 1.2465396538821667
Energy: 0.9876018386301824
Energy: 0.9957179483561679
Energy: 1.066315448545471
Energy: 1.0481243684778534
Energy: 1.0601699138035492
Energy: 1.2464593521797143
Energy: 0.995649580260683
Energy: 1.0618951415692983
Energy: 1.064854622385949
Energy: 0.9384064948618991
Energy: 1.0623811482357057
Energy: 1.2221403654964016
Energy: 0.9187504075407558
Energy: 0.9184381300867274
Energy: 1.2225397328315553
Energy: 0.9184075314527403
Energy: 0.9178833319794384
Energy: 1.0780648301749245
Energy: 0.9189232205418886
Energy: 0.9183066625478108
Energy: 1.0783169577227232
Energy: 0.9199148400324695
Energy: 0.9175550789171021
Energy: 1.0787335215429426
Energy: 0.9588052866124579
Energy: 1.0226552319187732
Energy: 1.0784402589882005
Energy: 0.9981436236815461
Energy: 1.0786927488366993
Energy: 1.0787518681236057
Energy: 0.9774949403045778
Energy: 0.9760557969630629
Energy: 1.0787284599223592
Energy: 0.9757757470261041
Energy: 1.0232031658514047
Energy: 1.2453317260558843
Energy: 1.0634087804084398
Energy: 1.0646053636341164
Energy: 1.0227096122411352
Energy: 1.0646286396591842
Energy: 1.0792469788058232
Energy: 1.0477414312222528
Energy: 1.0643081842345525
Energy: 0.9985881484533168
Energy: 1.0479557059257496
Energy: 1.063731497180459
Energy: 0.9981275214207038
Energy: 1.247025927899772
Energy: 1.0652669330518205
Energy: 1.0646767611251435
Energy: 1.0649942753679773
Energy: 1.0672246577572233
Energy: 1.0643706042194627
Energy: 1.4326288560596012
Energy: 1.0229862380625243
Energy: 1.0229714805700698
Energy: 0.919064113031698
Energy: 1.0227741739312362
Energy: 0.9178809691766754
Energy: 1.4274801533547319
Energy: 1.079400110850996
Energy: 0.9179791029317003
Energy: 0.918062304301306
Energy: 1.078392225228414
Energy: 0.9183997464763483
Energy: 1.245385818260728
Energy: 1.078360227863778
Energy: 1.0784728477200005
Energy: 0.9972983304620663
Energy: 1.0780047088685247
Energy: 1.0223856661997188
Energy: 1.2334019946053438
Energy: 1.0787142748255547
Energy: 1.0789403332675092
Energy: 1.0527727767475574
Energy: 1.078574179639764
Energy: 1.078938158507355
Energy: 1.2336641462935494
Energy: 1.0784758725486445
Energy: 1.0785973166373735
Energy: 1.0520063369529196
Energy: 1.0784867837804375
Energy: 1.0232244803312807
Energy: 1.2463611019881922
Energy: 0.9879251978191802
Energy: 1.062016693379419
Energy: 1.0649382983364648
Energy: 1.0481841292722012
Energy: 1.065686607744325
Energy: 1.23984100461084
Energy: 1.063612324356392
Energy: 1.0642779050950057
Energy: 1.064000610461068
Energy: 1.0634076456977661
Energy: 1.0650438584351654
Energy: 1.2456554083668496
Energy: 0.9964983412699144
Energy: 1.0629961080128365
Energy: 1.0636526667858368
Energy: 0.9589321655094303
Energy: 1.0629339040485148
Energy: 1.222023969992297
Energy: 0.917491024511169
Energy: 0.9171381933367354
Energy: 1.2221222587455893
Energy: 0.9167058278749104
Energy: 0.9164591371451293
Energy: 1.078711297576956
Energy: 0.9592794266664169
Energy: 1.0230734037476348
Energy: 1.0789631041181948
Energy: 0.9192085189951873
Energy: 1.0224673334232057
Energy: 1.0783598006324355
Energy: 0.9588778166086843
Energy: 1.0232476678493796
Energy: 1.0784326128814807
Energy: 0.9589479219622484
Energy: 1.0789204661116054
Energy: 1.222928720760208
Energy: 1.0525365551657353
Energy: 0.9765226835453771
Energy: 1.2221921357955998
Energy: 1.0529672038935143
Energy: 1.0228218551069252
Energy: 1.24530691994281
Energy: 1.0636072707755837
Energy: 1.0638920546765518
Energy: 1.0635101402036293
Energy: 1.0641694714706538
Energy: 1.0631804127122357
Energy: 1.0478473230840635
Energy: 1.0633941567956608
Energy: 1.061139829420928
Energy: 1.047910923224396
Energy: 1.0640738610502483
Energy: 0.9990397165414929
Energy: 1.2196256394424116
Energy: 1.0629956637737883
Energy: 1.0626050131050777
Energy: 0.9380651483338083
Energy: 1.064061504144528
Energy: 1.0612624883968138
Energy: 1.4298359507522607
Energy: 1.0226392159998259
Energy: 0.9178284913546664
Energy: 0.9185548599812713
Energy: 1.022412868329521
Energy: 0.9183546654538417

minimum gb energy = 0.9164591371451293 eV
minimum distance =  2.41031968379529 Angstroms
sigma value = 27


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

Energy: 1.2278427482961962
Energy: 1.0849545523102515
Energy: 1.321444202395334
Energy: 0.9042760742480769
Energy: 1.083840621391784
Energy: 1.3196717108141351
Energy: 1.233381549750851
Energy: 1.0830462624009678
Energy: 1.0830062526836135
Energy: 0.9425389295814677
Energy: 1.0828628397856388
Energy: 0.9407616628566348
Energy: 1.1173402282024212
Energy: 1.0781097693081714
Energy: 1.0778657141504322
Energy: 0.9420159750356918
Energy: 1.0787888357591036
Energy: 1.0210775719828844
Energy: 1.1216264641261613
Energy: 1.0218358416450972
Energy: 1.0222058537642096
Energy: 0.9425889931558751
Energy: 1.1364661865383352
Energy: 0.9444832717671011
Energy: 1.2326830275897627
Energy: 0.8751375724468603
Energy: 0.9400283078740281
Energy: 1.0204584427317418
Energy: 0.8751221642638559
Energy: 0.9400784723727196
Energy: 1.077245447862355
Energy: 0.8753152674488924
Energy: 0.8750166174318027
Energy: 1.07719234634124
Energy: 0.875410505177737
Energy: 0.8751898378913776
Energy: 1.082487357702231
Energy: 0.9405277615884216
Energy: 0.9407890917952593
Energy: 1.0822130046860257
Energy: 0.9430053991216901
Energy: 1.0222295086770545
Energy: 1.0832133703882534
Energy: 0.9497421456464755
Energy: 0.9476292622302833
Energy: 1.0834197071198952
Energy: 0.9516577617762761
Energy: 1.0157003074181523
Energy: 1.118019189644639
Energy: 0.9485951533465016
Energy: 0.9522088233366022
Energy: 1.0832482242787929
Energy: 0.9345216368320616
Energy: 0.9396441939978821
Energy: 0.9962397888144384
Energy: 0.9272209131248585
Energy: 0.9246464382313979
Energy: 0.9906153744550906
Energy: 0.9915637914068258
Energy: 0.9242397151681039
Energy: 1.1174069593080926
Energy: 1.0756170656372248
Energy: 0.9911110962071813
Energy: 0.9910408571950036
Energy: 1.0786541278026889
Energy: 0.9286507841096223
Energy: 1.1190154098951823
Energy: 0.9922973261310813
Energy: 0.9998316317366227
Energy: 0.9321059840492083
Energy: 0.9921925329530918
Energy: 0.9421669334026961

minimum gb energy = 0.8750166174318027 eV
minimum distance =  2.38058629319842 Angstroms
sigma value = 9


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

Energy: 1.9561666007664644
Energy: 0.9322181067780229
Energy: 1.1050736252422486
Energy: 1.0018082606627896
Energy: 0.9322710465102562
Energy: 1.002122613795857
Energy: 0.9409322659203334
Energy: 0.8895522517458895
Energy: 0.8926443816255237
Energy: 0.8944839864348902
Energy: 0.9288232614463097
Energy: 0.9101141202016104
Energy: 0.9422720565576427
Energy: 0.9236572079976046
Energy: 0.885556548120681
Energy: 0.8983696176456952
Energy: 0.9220428832711126
Energy: 0.8716629544396873
Energy: 0.9451852118369037
Energy: 0.8865465630145304
Energy: 0.886430666130945
Energy: 0.8959893802023405
Energy: 0.9404742275904362
Energy: 0.881827383441651
Energy: 0.9971205953085746
Energy: 0.9164978231773522
Energy: 0.8988688094062208
Energy: 0.9379384035021933
Energy: 0.9175756011916432
Energy: 0.9028799232643577
Energy: 0.9690632801129395
Energy: 0.9062173244197188
Energy: 0.8995868969461379
Energy: 0.9691448482874754
Energy: 0.8480390907265817
Energy: 0.9339714855252957
Energy: 0.9710125047889722
Energy: 0.8701067089180704
Energy: 0.8691139658837788
Energy: 0.9700630115651758
Energy: 0.9059442320239876
Energy: 0.9698580047272387
Energy: 0.966982716024082
Energy: 0.930976753402419
Energy: 0.9372058337255802
Energy: 0.9664192285666959
Energy: 0.8949892533824707
Energy: 0.964450368455081
Energy: 0.9203433573235925
Energy: 0.8949526738647604
Energy: 0.8566977625282658
Energy: 0.9343279424569427
Energy: 0.895299691383906
Energy: 0.9332606590558485
Energy: 0.8735214375393027
Energy: 0.9233893805174507
Energy: 0.9239956703612969
Energy: 0.8547631900800828
Energy: 0.9333397840112517
Energy: 0.897966264990639
Energy: 0.8740262980676325
Energy: 0.9669211560827515
Energy: 0.9667772339474534
Energy: 0.8576413656910596
Energy: 0.9665680426257397
Energy: 0.8707244408550954
Energy: 1.0325405453689558
Energy: 0.9707566879054169
Energy: 0.9705135045098747
Energy: 0.8807454170504267
Energy: 0.9712485841272837
Energy: 0.9706511413562239
Energy: 1.714792212691266
Energy: 0.9690044795332534
Energy: 0.9515737748470471
Energy: 0.9362802538953628
Energy: 0.9690174890766876
Energy: 1.0863207762451843
Energy: 1.028408511257622
Energy: 0.9698915916738838
Energy: 0.8852373818412672
Energy: 0.881005053005821
Energy: 0.9705004601762166
Energy: 0.8692078280026817
Energy: 0.9222517845790414
Energy: 0.924915314963229
Energy: 0.9220155105399648
Energy: 0.8840849428540996
Energy: 0.9248071688699117
Energy: 0.882958554983142
Energy: 0.930598194023551
Energy: 0.8487387327236089
Energy: 0.8522655135381928
Energy: 0.9279239214544431
Energy: 0.9277783322532964
Energy: 0.8847021864607306
Energy: 0.928016284770606
Energy: 0.871396295827173
Energy: 0.9027385419254496
Energy: 0.9280084267499293
Energy: 0.8788022167425927
Energy: 0.8780416019715594
Energy: 0.9431712970711532
Energy: 0.8752855535591131
Energy: 0.9576936646210603
Energy: 0.9291058922929928
Energy: 0.8848516436374351
Energy: 0.9134370346745534
Energy: 0.9426616186660918
Energy: 0.8919375463539642
Energy: 0.8509152484884608
Energy: 0.9130031204484219
Energy: 0.9245822520698739
Energy: 0.8522749963043386
Energy: 0.9424064767466859
Energy: 0.8727342662946516
Energy: 0.8682746304929908
Energy: 0.8694167621528369
Energy: 0.9090408760552572
Energy: 0.8388889010761226
Energy: 0.942152072803471
Energy: 0.8712757075852112
Energy: 0.8986624782271524
Energy: 0.8978410531160059
Energy: 0.9118625687580574
Energy: 0.8532083194908007
Energy: 1.006834982170871
Energy: 0.8912312634432885
Energy: 0.9704500463325438
Energy: 0.9532847405610139
Energy: 0.8892613190992318
Energy: 0.9134384909154947
Energy: 1.0008957885297844
Energy: 0.887197196546298
Energy: 0.9081305290447691
Energy: 0.9142523498870535
Energy: 0.9274891918707756
Energy: 0.9040922121388753
Energy: 0.942466689026717
Energy: 0.9228778591681498
Energy: 0.8893162191645798
Energy: 0.9274774060077152
Energy: 0.9229749773918189
Energy: 0.8678126558118113
Energy: 1.2400153846095225
Energy: 0.8839645146104113
Energy: 0.9375926042309451
Energy: 0.9536456374001956
Energy: 0.883204554484377
Energy: 0.9344663957190588
Energy: 0.9417215741656133
Energy: 0.8824843671809521
Energy: 0.86974984838001
Energy: 0.9697461886875094
Energy: 0.881768856039289
Energy: 0.8954694350364315
Energy: 1.0904768199339834
Energy: 0.9384550196319917
Energy: 0.9209816098843917
Energy: 1.0903070180943388
Energy: 0.9585466943963853
Energy: 0.9036628990123483
Energy: 0.9716834722439873
Energy: 0.8693490339326209
Energy: 0.8712223424742321
Energy: 0.9706107116830985
Energy: 0.8822470138499329
Energy: 0.9695852771069587
Energy: 0.9673099010626871
Energy: 0.8901806751871103
Energy: 0.869887109672132
Energy: 0.967472699055492
Energy: 0.8939379256314315
Energy: 0.9749965927024162
Energy: 0.906934946098571
Energy: 0.9312035779748262
Energy: 0.9368992203203921
Energy: 0.9215677345884259
Energy: 0.8946595945367511
Energy: 0.9050134434066768
Energy: 0.8737502511706746
Energy: 0.9419855595473289
Energy: 0.9847256720898122
Energy: 0.8561337165491396
Energy: 0.9438690559676622
Energy: 0.8830159259878186
Energy: 0.8734970316480486
Energy: 0.9667321949856044
Energy: 0.919544409508731
Energy: 0.8560245164786727
Energy: 0.968117415218978
Energy: 0.9204092896906612
Energy: 0.940160529729249
Energy: 0.9702435005232991
Energy: 0.969366727265983
Energy: 0.9331009992905734
Energy: 0.9696846557881613
Energy: 0.98196949172809
Energy: 0.9425298265293259
Energy: 0.9689793462121482
Energy: 0.9689006984640449
Energy: 0.9110521791958517
Energy: 0.9691842029027881
Energy: 0.8906660197591794
Energy: 0.9379537049620492
Energy: 0.9695399528359657
Energy: 0.9707332252726533
Energy: 0.8934792551391252
Energy: 0.9696494299448306
Energy: 0.8715059623688252
Energy: 0.9239439140277428
Energy: 0.9281787366338589
Energy: 0.8638410362630046
Energy: 0.940818155617034
Energy: 0.9310632863272413
Energy: 0.8725239626829427
Energy: 0.9233774439576387
Energy: 0.9004260196606584
Energy: 0.86798047327236
Energy: 0.9216380113152407
Energy: 0.8985113874761456
Energy: 0.887423345361388
Energy: 0.9274896686945194
Energy: 0.8928251437613601
Energy: 0.8861298462315277
Energy: 0.9276004871471465
Energy: 0.8922171517565174
Energy: 0.8916625691533528
Energy: 1.3805256257933842
Energy: 0.973169556506889
Energy: 0.9733963184919157
Energy: 1.3812449158581517
Energy: 0.9480236604876059
Energy: 0.8945300847164553
Energy: 0.9427061522348726
Energy: 0.8922468085377026
Energy: 0.8738373284482092
Energy: 0.9278748915265975
Energy: 0.8901479815470774
Energy: 0.8499386472719023
Energy: 0.9387295717030543
Energy: 0.8748722476569044
Energy: 0.8670922811216348
Energy: 0.9119703559655716
Energy: 0.8717904980501311
Energy: 0.8683045116968015
Energy: 0.9432030507643153
Energy: 0.910311707756132
Energy: 0.8708095233664422
Energy: 0.912705399501817
Energy: 0.9099714983942844
Energy: 0.8571508226730619
Energy: 1.0012292686741706
Energy: 0.8889805149772527
Energy: 0.851305811429016
Energy: 0.9170875115308669
Energy: 0.8881775586749537
Energy: 0.8700480795229452

minimum gb energy = 0.8388889010761226 eV
minimum distance =  2.36531656016902 Angstroms
sigma value = 57


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

Energy: 0.4016078502368432
Energy: 0.457820466157073
Energy: 0.4148550810235543
Energy: 0.4044793418629456
Energy: 0.45893378147063046
Energy: 0.4031466923301707
Energy: 0.5123215953499963
Energy: 0.42513990391904627
Energy: 0.4253431235645209
Energy: 0.45603065685307703
Energy: 0.45786003640891965
Energy: 0.46547286822901013
Energy: 0.5158168477351466
Energy: 0.4595440761885684
Energy: 0.4597852856828903
Energy: 0.45836597428585096
Energy: 0.4586634129728503
Energy: 0.4603114980308123
Energy: 0.5159461294852414
Energy: 0.45953839059245216
Energy: 0.46011068497879304
Energy: 0.4601052534631902
Energy: 0.5158682903458799
Energy: 0.4607385075465712
Energy: 0.511573585024568
Energy: 0.4040123692488546
Energy: 0.4338756364501161
Energy: 0.5133557647412605
Energy: 0.40278135017730887
Energy: 0.4648973568296229
Energy: 0.45799046253855363
Energy: 0.40293536129806923
Energy: 0.4041323028714166
Energy: 0.4266895089071029
Energy: 0.4025859511968347
Energy: 0.4339726689115617
Energy: 0.4530831490605234
Energy: 0.42555734032642156
Energy: 0.42573030320188976
Energy: 0.4545971172668252
Energy: 0.46814101669281455
Energy: 0.46497895268686823
Energy: 0.4584772677709119
Energy: 0.5153995247763584
Energy: 0.5147782048234438
Energy: 0.4585739649009951
Energy: 0.4584636439137688
Energy: 0.45989092735229425
Energy: 0.5118686966169378
Energy: 0.45960622442513743
Energy: 0.4665323593908998
Energy: 0.5180056348674448
Energy: 0.45810870099450457
Energy: 0.4595615642612433
Energy: 0.4021304831768791
Energy: 0.4601487378635201
Energy: 0.4354362019154331
Energy: 0.40235867926061475
Energy: 0.45855277311424225
Energy: 0.4349565784705221
Energy: 0.40220541532987486
Energy: 0.42577058372131443
Energy: 0.4253160093417684
Energy: 0.40235276773860973
Energy: 0.468916115616078
Energy: 0.43873722391995496
Energy: 0.5148170507596129
Energy: 0.4593683342731673
Energy: 0.46698976549487836
Energy: 0.5164847550015791
Energy: 0.45827388268328034
Energy: 0.42670930287139786
Energy: 0.5161481830946147
Energy: 0.515570767247635
Energy: 0.5148926585587938
Energy: 0.5162316734666583
Energy: 0.515406087746594
Energy: 0.5151490611297079
Energy: 0.5133050894197955
Energy: 0.4606475965596996
Energy: 0.4594497558660398
Energy: 0.5155519511880452
Energy: 0.45841755761119174
Energy: 0.4261246798115864
Energy: 0.5162049418675039
Energy: 0.40268051992535353
Energy: 0.4029427174189382
Energy: 0.45909219336296037
Energy: 0.40797527334472616
Energy: 0.40403430470697516
Energy: 0.45638734680783577
Energy: 0.4670142656409399
Energy: 0.46478376940058724
Energy: 0.45772886617282255
Energy: 0.4033839767397067
Energy: 0.4260402189146874
Energy: 0.45793375772526423
Energy: 0.4671739879768027
Energy: 0.4658590204696604
Energy: 0.45821814555083495
Energy: 0.4592008482053815
Energy: 0.45960606097061063
Energy: 0.5152877496506091
Energy: 0.45869967986540255
Energy: 0.5139589148316593
Energy: 0.5155194134057424
Energy: 0.4588607053468332
Energy: 0.4601888149069264
Energy: 0.4022397651429428
Energy: 0.42597867581903176
Energy: 0.4256705921282032
Energy: 0.4025449940666229
Energy: 0.5159710498897847
Energy: 0.4651268658837213

minimum gb energy = 0.4016078502368432 eV
minimum distance =  2.4077143148743 Angstroms
sigma value = 11


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

Energy: 1.6389907044105703
Energy: 0.7539797759043518
Energy: 1.018892034542932
Energy: 0.995276165181218
Energy: 0.7536693159515199
Energy: 1.0206938565367965
Energy: 0.7465710543365685
Energy: 0.7463039033481804
Energy: 0.7921660496206527
Energy: 0.7641749323885119
Energy: 0.7496454132181101
Energy: 0.7543167412790284
Energy: 0.747217326141286
Energy: 0.7673743318822576
Energy: 0.7706283269310935
Energy: 0.7492537941601554
Energy: 0.759064542235602
Energy: 0.7651924575521725
Energy: 0.7485712863692451
Energy: 0.7817509663870246
Energy: 0.7859190687102345
Energy: 0.7482692681398386
Energy: 0.7494265288085121
Energy: 0.7671438644656637
Energy: 0.7460618517124966
Energy: 0.8446220956739923
Energy: 0.7818464429146426
Energy: 0.746341045652407
Energy: 0.9245954631422109
Energy: 0.782805817823527
Energy: 1.0400897771185063
Energy: 0.801126650650396
Energy: 0.8004741535539414
Energy: 0.7772705447744036
Energy: 0.8075727758017197
Energy: 0.7754417663153308
Energy: 1.0114800822085925
Energy: 0.7735488089620315
Energy: 0.7662852359863802
Energy: 0.7471998555114746
Energy: 0.7640479251646646
Energy: 0.7558519025066136
Energy: 0.772440497471986
Energy: 0.8305799279611845
Energy: 0.8312846125578552
Energy: 0.773005899909416
Energy: 0.8302165665784663
Energy: 0.8327229710410575
Energy: 1.041293717836751
Energy: 0.760973377695036
Energy: 0.7911507023823852
Energy: 0.7744947356726257
Energy: 0.8144588366149986
Energy: 0.7805535198442634
Energy: 1.2606170591612809
Energy: 0.8156723825547896
Energy: 0.7971661732112034
Energy: 0.7505313762944056
Energy: 0.8157704737521889
Energy: 0.7886176948078445
Energy: 1.3519519556232706
Energy: 0.8018348439584408
Energy: 0.7857578734434062
Energy: 0.9222223983323422
Energy: 0.7756604249849763
Energy: 0.8007767605600834
Energy: 1.1401462166808012
Energy: 0.7221770719676204
Energy: 0.754660994480699
Energy: 0.8803076076541346
Energy: 0.720332067898552
Energy: 0.7800284323204416
Energy: 0.9399238970033865
Energy: 0.7163742619036116
Energy: 0.8102596673786863
Energy: 0.9396726907007142
Energy: 0.7219163761009936
Energy: 0.7797648495304553
Energy: 0.9239013737631916
Energy: 0.7991809735847757
Energy: 0.849639866842006
Energy: 0.9249385963650114
Energy: 0.796773479451658
Energy: 0.8491354965394741
Energy: 0.9211129421165909
Energy: 0.9705850856190332
Energy: 0.9646783614039743
Energy: 0.921077772949162
Energy: 1.1232618818528535
Energy: 0.9216941261821446
Energy: 1.353615959853261
Energy: 0.8509155305817979
Energy: 0.8501203352807257
Energy: 0.9301992328588099
Energy: 0.9262594645905193
Energy: 0.8479123680597046
Energy: 1.16551585055336
Energy: 1.0317314797058466
Energy: 0.9322439626694528
Energy: 1.0652967492438246
Energy: 1.0076675476929482
Energy: 0.7728733829904878
Energy: 1.3576052638167215
Energy: 0.8830262953802257
Energy: 0.7866223537272546
Energy: 0.9094860443340452
Energy: 0.9210101049415261
Energy: 0.8502048328555796
Energy: 1.3038922076118842
Energy: 0.7777602511333149
Energy: 0.7738269063652132
Energy: 0.8129142761587101
Energy: 0.8557333870390524
Energy: 0.8038805562943263
Energy: 0.9830112260449375
Energy: 1.1203637743916113
Energy: 0.9635687452871206
Energy: 0.9433071359353085
Energy: 0.9339199266329086
Energy: 0.8538926918757259
Energy: 1.113612025252411
Energy: 0.7766369661484969
Energy: 0.8076077746456056
Energy: 0.8168023305848604
Energy: 0.8902969333951452
Energy: 0.7827939679155689
Energy: 1.2487710943807606
Energy: 1.0576651588459913
Energy: 1.0009392726419681
Energy: 1.2483858150486928
Energy: 0.9804761627932439
Energy: 0.839555729130184
Energy: 0.8145024759673691
Energy: 0.7814631802333051
Energy: 0.802391854203532
Energy: 0.8145245982333682
Energy: 0.7725159991257295
Energy: 0.8037457877009637
Energy: 0.8290770627296066
Energy: 0.7615155146897934
Energy: 0.7666572156724363
Energy: 0.8302272633115952
Energy: 0.7527197765351562
Energy: 0.7683710097105508
Energy: 0.8479815642074325
Energy: 0.7559509532542615
Energy: 0.7552161407570303
Energy: 0.8496765615976577
Energy: 0.7494830688726198
Energy: 0.767090414692614
Energy: 1.34581808334415
Energy: 0.7974639575880194
Energy: 0.7769194450770459
Energy: 0.9374391822214085
Energy: 0.7778552970519119
Energy: 0.7510949091014704

minimum gb energy = 0.7163742619036116 eV
minimum distance =  2.37660744624419 Angstroms
sigma value = 41


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

Energy: 1.60150277334459
Energy: 0.8290545033190696
Energy: 0.8683699310637414
Energy: 1.1645157210544868
Energy: 1.0118629342221614
Energy: 1.1616813756756683
Energy: 0.826067151150909
Energy: 0.8324765666996314
Energy: 0.8426139321291063
Energy: 0.8609494299233308
Energy: 0.825816963405399
Energy: 0.8416280753255271
Energy: 0.8279521877030607
Energy: 0.8336605214958589
Energy: 0.8252156527138836
Energy: 0.8290034517808657
Energy: 0.829450262325989
Energy: 0.8207848038213665
Energy: 0.8271231493872397
Energy: 0.8459217639655385
Energy: 0.8425888442987519
Energy: 0.8278279088415487
Energy: 0.8280549355856704
Energy: 0.8222869245458245
Energy: 0.8260257953304772
Energy: 0.9064487610088143
Energy: 0.8698026261782232
Energy: 0.8262419088160471
Energy: 0.8944989742972234
Energy: 0.844319954461277
Energy: 0.9439306881488942
Energy: 0.8425545469842279
Energy: 0.8702999750321827
Energy: 0.8260350585120432
Energy: 0.8468957666812377
Energy: 0.8306432687417027
Energy: 0.9472720349723348
Energy: 0.8292337089791668
Energy: 0.8234000126886363
Energy: 0.8258360029776086
Energy: 0.861333786946412
Energy: 0.8430903248971922
Energy: 0.8690145269137158
Energy: 0.9432715029143631
Energy: 0.8699382001473874
Energy: 0.8740316269700461
Energy: 0.9419908327263785
Energy: 0.7951644087038703
Energy: 0.9435411555224621
Energy: 0.8279287649566298
Energy: 0.8861077631150238
Energy: 0.8654105860633171
Energy: 0.8959714595228216
Energy: 0.8473225159424539
Energy: 1.1702657470124065
Energy: 0.8335217675230356
Energy: 0.852676899242149
Energy: 1.069772524427803
Energy: 0.8335295264237418
Energy: 0.8475790548648096
Energy: 1.197828394403912
Energy: 0.8696563329449167
Energy: 0.8465478761833415
Energy: 0.8247424507304678
Energy: 0.8295458717910936
Energy: 0.8457426244979548
Energy: 1.3781414423027305
Energy: 0.8185152335119724
Energy: 0.7797168892712067
Energy: 0.9989432096869657
Energy: 0.779085646170906
Energy: 0.84343984188745
Energy: 0.833418973618175
Energy: 0.779243165942868
Energy: 0.7804481983991369
Energy: 0.8334462724791779
Energy: 0.7795903610751279
Energy: 0.8946554404415767
Energy: 0.896513787881272
Energy: 0.85649958951741
Energy: 0.8434467535999861
Energy: 0.8963053131731329
Energy: 0.8779660514858982
Energy: 0.8430860089534133
Energy: 0.9653117071825238
Energy: 0.8388508381335291
Energy: 0.970885864549083
Energy: 0.9653955725301978
Energy: 0.838210901820252
Energy: 0.9673658262428898
Energy: 0.8248775590217075
Energy: 0.8302478756385266
Energy: 0.8421532588519197
Energy: 0.8615184772028074
Energy: 0.8259092505155418
Energy: 0.843652646032395
Energy: 1.4717690712881892
Energy: 0.8575553482772555
Energy: 0.7812060846487208
Energy: 1.1797713654437108
Energy: 0.8939505195338887
Energy: 1.0467163359952323
Energy: 0.866877215114558
Energy: 0.8580499604335287
Energy: 0.8452518638437695
Energy: 1.010173641087405
Energy: 0.8262755865891626
Energy: 0.8303548913253563
Energy: 0.8265211454080931
Energy: 0.8326447903664836
Energy: 0.8298158902505489
Energy: 0.8273540723273678
Energy: 0.8288699269908802
Energy: 0.8212044137315652
Energy: 0.8266860029814523
Energy: 0.8263736634958778
Energy: 0.8207765830780853
Energy: 0.8276354658631614
Energy: 0.8295674845966103
Energy: 0.8222825767432237
Energy: 0.825461219225388
Energy: 0.8451394424861347
Energy: 0.8427308734887218
Energy: 0.8256868843432865
Energy: 0.8267800285998036
Energy: 0.8424930622453761
Energy: 0.9598797699706312
Energy: 1.0003341490107809
Energy: 0.9976529823785283
Energy: 0.9607471936050859
Energy: 0.9972993318972292
Energy: 0.998891556244226
Energy: 0.9440078366880854
Energy: 0.8282004943059647
Energy: 0.8432333283542855
Energy: 0.8254502420137826
Energy: 0.8603620812328949
Energy: 0.8421369850287296
Energy: 0.8683880153021408
Energy: 0.9755669258052165
Energy: 0.9927598335705453
Energy: 0.8724322541376114
Energy: 0.9751328871859047
Energy: 0.79573201753979
Energy: 0.9446196498119295
Energy: 0.8274870433661247
Energy: 0.8435932555507784
Energy: 0.8649986900559076
Energy: 0.9037734319903974
Energy: 0.8422283029793127
Energy: 1.1978113966694288
Energy: 0.8337576302022351
Energy: 0.8744793832309629
Energy: 0.8246168204607227
Energy: 0.8337965886583418
Energy: 0.8445154340861881
Energy: 1.1698603691848815
Energy: 0.8335969511166074
Energy: 0.8540790802937114
Energy: 0.8246669216153655
Energy: 0.9993367427320936
Energy: 0.8441873832613523
Energy: 0.9429556844518165
Energy: 0.8039947749811699
Energy: 0.9121379242021481
Energy: 0.8297740381897598
Energy: 0.778916180940899
Energy: 0.8895306140430548
Energy: 0.8338673632660288
Energy: 0.8832150500090704
Energy: 0.8820250561134464
Energy: 0.8337841516208584
Energy: 0.9465357678999706
Energy: 0.8827966267119396
Energy: 0.8956428241832092
Energy: 0.9260452442255097
Energy: 0.9120992051270034
Energy: 0.8961260510412183
Energy: 0.8648163538990903
Energy: 0.9103890180721835
Energy: 0.8319325722435542
Energy: 0.851520084597812
Energy: 0.8321435742902159
Energy: 0.8319859541584106
Energy: 0.827697143158869
Energy: 0.8320159701212559
Energy: 0.8248629089417572
Energy: 0.8299384542430099
Energy: 0.8455356805955192
Energy: 0.8355666587818376
Energy: 0.8268337480913409
Energy: 0.8214475023716205
Energy: 1.4713245077443877
Energy: 0.8815801529422004
Energy: 0.8283514512212962
Energy: 0.7865785125555352
Energy: 0.8275005123800605
Energy: 0.8314649170616522

minimum gb energy = 0.778916180940899 eV
minimum distance =  2.38316148407388 Angstroms
sigma value = 33


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

Energy: 1.1135304066689862
Energy: 0.9587573150982247
Energy: 0.9104169153085203
Energy: 1.109613324868795
Energy: 0.9584403356785287
Energy: 0.9112659504382697
Energy: 0.9152798988173347
Energy: 0.8832901284937638
Energy: 0.9150068544958642
Energy: 0.883969450543519
Energy: 0.9138857535196354
Energy: 0.9153960375786122
Energy: 0.9141486989965869
Energy: 0.8813550493664196
Energy: 0.8804110528856572
Energy: 0.915117861605077
Energy: 0.9308160614205184
Energy: 0.8851351342934876
Energy: 0.91257432530758
Energy: 0.9140699136922132
Energy: 0.8809971838024476
Energy: 0.9131486969798368
Energy: 0.927509173106949
Energy: 0.8797459196456489
Energy: 0.9154340458997656
Energy: 0.9097799953099623
Energy: 0.8508160266399951
Energy: 0.9157633109388542
Energy: 0.9227033501736739
Energy: 0.8521804334988752
Energy: 1.2417821027396174
Energy: 0.8540809908264354
Energy: 0.8538867677713804
Energy: 0.9469991119080187
Energy: 0.9105919235958582
Energy: 0.8533153875388859
Energy: 0.9735877075572247
Energy: 0.8892785304788295
Energy: 0.8806046564405671
Energy: 0.9142036609514925
Energy: 0.890479924746535
Energy: 0.8778259542490165
Energy: 0.9691394940190644
Energy: 0.884483443066768
Energy: 0.8643137385588159
Energy: 0.9963166591462371
Energy: 0.8826992233329938
Energy: 0.8657018761591099
Energy: 0.9720841054564605
Energy: 0.8496376586357884
Energy: 0.8884203380217133
Energy: 1.0133049428721517
Energy: 0.8513588636796506
Energy: 0.8886868654253735
Energy: 0.9716601026582816
Energy: 0.8541167428390899
Energy: 0.8539999776156244
Energy: 0.9145198748348632
Energy: 0.8546309576257428
Energy: 0.8911518756372291
Energy: 0.9716102920314186
Energy: 0.8898361969401223
Energy: 0.8821569013733864
Energy: 0.9179381179135763
Energy: 0.8540467114436664
Energy: 0.8795878338340376
Energy: 1.2077927744319248
Energy: 0.8489940037667606
Energy: 0.8472432691079889
Energy: 0.914521179739905
Energy: 0.8544217828381072
Energy: 0.917770097522287
Energy: 0.9146833344365641
Energy: 0.8485701049812778
Energy: 0.8475937422984976
Energy: 0.9144992247112496
Energy: 0.8589141503039363
Energy: 0.887963286658532
Energy: 0.9138297316750582
Energy: 0.879462737554043
Energy: 0.8787498259406782
Energy: 0.9155106774024813
Energy: 0.9173629386221106
Energy: 0.8779486533877859
Energy: 0.8736288261386356
Energy: 0.8801131907511611
Energy: 0.8833034638315799
Energy: 0.9192071246062816
Energy: 0.8800410765061836
Energy: 0.9022917037229329
Energy: 0.9125183401033284
Energy: 0.9231777234660313
Energy: 0.8783274985265304
Energy: 0.9344107620612431
Energy: 0.9149393987752945
Energy: 0.8785796016029876
Energy: 0.9691172464855392
Energy: 0.9832056597801067
Energy: 1.1524328371988934
Energy: 0.940859406486161
Energy: 0.9529541480413443
Energy: 0.852678464232339
Energy: 0.971596615691599
Energy: 0.9395229817576474
Energy: 0.8507662847049823
Energy: 0.9170698424082485
Energy: 0.9393815801103217
Energy: 0.8502503338579656
Energy: 0.9184573002079011
Energy: 0.9306871285309419
Energy: 0.8519199675914892
Energy: 0.9327512488935422
Energy: 0.9718758504703409
Energy: 0.8823514159883048
Energy: 0.8534737066527509
Energy: 0.9295487573612891
Energy: 0.8489297428432734
Energy: 0.8533782034894771
Energy: 0.9722822530387688
Energy: 0.8841144935847398
Energy: 0.8511984801444675
Energy: 0.8788824554343947
Energy: 0.8895738626511613
Energy: 0.8512059782623141
Energy: 0.9187844075015277
Energy: 0.8878740822690834
Energy: 0.8873151483929564
Energy: 0.8572691929998344
Energy: 0.8569283732097924
Energy: 0.8882147396267631
Energy: 0.8912395501398583
Energy: 0.8877152069138352
Energy: 0.9119349760235154
Energy: 0.9647386447359576
Energy: 0.9153067399775767
Energy: 0.8514676474737386
Energy: 0.9143999062628422
Energy: 0.890878519085842
Energy: 0.9724640353048378
Energy: 0.956306644951318
Energy: 1.1571049118876378
Energy: 0.8503818053537214
Energy: 0.9545453583846669
Energy: 0.8638652718560952
Energy: 0.9718288391268259
Energy: 0.8853085646245036
Energy: 0.917326267306951
Energy: 0.8496292782330334
Energy: 0.9148159176106148
Energy: 0.9192485833018933
Energy: 0.9130759583175665
Energy: 0.9405410110957917
Energy: 0.8796214168990325
Energy: 0.9137181075200771
Energy: 0.9168586230432118
Energy: 0.8863506183666421
Energy: 0.9139872712308046
Energy: 0.8828501011131921
Energy: 0.9124452730547803
Energy: 0.9151905481225443
Energy: 0.9298579020722413
Energy: 0.8815846488765818
Energy: 0.9131574827337772
Energy: 0.8878377314884623
Energy: 0.8512348574175524
Energy: 0.9143955775240359
Energy: 0.920632346819641
Energy: 0.9176659920361924
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Energy: 0.8539821044693173
Energy: 0.8579450118183994
Energy: 0.9484863179571278
Energy: 0.971078059686645
Energy: 0.8594779827698381
Energy: 0.972030123127226
Energy: 0.888271120678403
Energy: 0.8910074463147772
Energy: 0.9121833842697015
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Energy: 0.8793029143120132
Energy: 0.9698928058305913
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Energy: 0.8628919917704423
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Energy: 0.8853962017106719
Energy: 0.8633764826012015
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Energy: 0.8499865301030581
Energy: 0.8886685522153746
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Energy: 0.8527037395754995
Energy: 0.851047926866716
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Energy: 0.8526202641194528
Energy: 0.8894543040832612
Energy: 0.9130673136212514
Energy: 0.8538550817619094
Energy: 0.8829062131684783
Energy: 0.971765741303531
Energy: 0.8915884807435296
Energy: 0.8899514691545473
Energy: 0.9121404201939509
Energy: 0.8555884669773465
Energy: 0.8814924862808525
Energy: 0.973166007735571
Energy: 0.8480418176877518
Energy: 0.8479084896154337
Energy: 0.9143302186014975
Energy: 0.8523169438441599
Energy: 0.8525137896873017
Energy: 0.9156825353880302
Energy: 0.8483129312749381
Energy: 0.8882770858292097
Energy: 0.915978680872494
Energy: 0.8506821079388327
Energy: 0.8491717895987104
Energy: 0.9117497593261431
Energy: 0.8803641603737858
Energy: 0.8800925998857607
Energy: 0.9130545221456852
Energy: 0.929432371090952
Energy: 0.8773001205923646
Energy: 0.8787178381573395
Energy: 0.8791904440912032
Energy: 0.9048629123797043
Energy: 0.881986177765227
Energy: 0.8901175338071523
Energy: 0.9037900325961297
Energy: 0.912032024178504
Energy: 0.928053697629129
Energy: 0.8780084145700516
Energy: 0.9357049649987813
Energy: 0.9168740385806472
Energy: 0.8778955068963155
Energy: 0.9709057254344657
Energy: 0.9819424781236522
Energy: 0.9706968046125373
Energy: 0.91226528415723
Energy: 0.9450958759423657
Energy: 0.8524728771136195
Energy: 0.9711843804669669
Energy: 0.9365850666562214
Energy: 0.9353639601788636
Energy: 0.9202305290489019
Energy: 0.9910844302703669
Energy: 0.8506581948720705
Energy: 0.914507281225206
Energy: 0.9278453017021737
Energy: 0.8507930193269149
Energy: 0.931811089288869
Energy: 0.9694059756156994
Energy: 0.8811413847016282
Energy: 0.8547831554753493
Energy: 0.8479050215366483
Energy: 0.8534329986168399
Energy: 0.8553215568373035
Energy: 0.9783572459055287
Energy: 0.8524731918192192
Energy: 0.8494434617201742
Energy: 0.9309180233566939
Energy: 0.8515359100034497
Energy: 0.8504163262400636
Energy: 0.9568703353764951
Energy: 0.8880869497832692
Energy: 0.8837689628470713
Energy: 0.8574578214938356
Energy: 0.8840376028939956
Energy: 0.8838984795216739
Energy: 0.8932428989466952
Energy: 0.8845643953272069
Energy: 0.9111537837284664
Energy: 0.964453934585994
Energy: 0.9138820945329664
Energy: 0.8896149795632543
Energy: 0.914725340856592
Energy: 0.8811465487308364
Energy: 0.9683591622581357
Energy: 0.9172618709521891
Energy: 0.849205528360789
Energy: 0.8605138428863188
Energy: 1.211548730311294
Energy: 0.8528653528964242

minimum gb energy = 0.8472432691079889 eV
minimum distance =  2.38000541526209 Angstroms
sigma value = 67


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

Energy: 1.3192185815638933
Energy: 0.9909952927916358
Energy: 0.8970453959680041
Energy: 0.9203897492992855
Energy: 0.9906505989527968
Energy: 0.8948583771028347
Energy: 0.9787228281306007
Energy: 0.9244189839707618
Energy: 0.9243906836959113
Energy: 0.9398832140070592
Energy: 0.9818779031277522
Energy: 0.9227047802090712
Energy: 0.9966517747281984
Energy: 0.8618186059333309
Energy: 0.9246770085877499
Energy: 0.9290236983376741
Energy: 0.860751640209047
Energy: 0.9252722743898912
Energy: 0.9963783975752711
Energy: 0.9207656945464889
Energy: 0.9175117560570781
Energy: 0.9966597093923961
Energy: 0.9247361245719321
Energy: 0.9182391371816407
Energy: 0.9790499795751677
Energy: 0.9328538809712309
Energy: 0.9335078511727983
Energy: 0.9794990190999037
Energy: 0.933869623811729
Energy: 0.9339189551696342
Energy: 0.9795603444526122
Energy: 0.8956886342707217
Energy: 0.9392778736385138
Energy: 0.9798345632834984
Energy: 0.8959830325407092
Energy: 0.981256717015897
Energy: 1.0771301611331705
Energy: 0.9336014611478703
Energy: 0.9319507326465835
Energy: 1.0789328622174426
Energy: 0.9819284383641688
Energy: 0.9318587641263361

minimum gb energy = 0.860751640209047 eV
minimum distance =  2.3968678403921 Angstroms
sigma value = 3


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

Energy: 1.7117451698326491
Energy: 1.282643441673812
Energy: 1.115785439590342
Energy: 1.0276843120454242
Energy: 1.2823882535495157
Energy: 1.1190437993809412
Energy: 0.986026129733926
Energy: 0.9910951904292535
Energy: 0.9880587061251873
Energy: 1.048690301571244
Energy: 1.0134360037554035
Energy: 0.9878768712849489
Energy: 1.1782555033551683
Energy: 0.9817430289812243
Energy: 0.9806383495215898
Energy: 0.9940825692118258
Energy: 0.98247230832582
Energy: 0.9888532591756859
Energy: 0.992318108244097
Energy: 0.9884335567077206
Energy: 0.9880341250855763
Energy: 0.9945512520843345
Energy: 0.9799614361967284
Energy: 0.9880826528495273
Energy: 1.0000548234190365
Energy: 0.9898799744851414
Energy: 0.9898015780210183
Energy: 0.9878534193756128
Energy: 1.0667664987956544
Energy: 0.9878817431994046
Energy: 0.9885226611997631
Energy: 0.9886497157062276
Energy: 0.9898745777802611
Energy: 0.9897212248513072
Energy: 1.066966775931064
Energy: 0.9889143578444678
Energy: 0.9866762398964063
Energy: 1.1211541014522244
Energy: 1.0070362191277076
Energy: 1.0649898356130534
Energy: 1.0649479891209246
Energy: 1.0688143450665561
Energy: 1.6017990924803664
Energy: 1.1670896038637948
Energy: 1.0723904701513258
Energy: 0.9892425439480671
Energy: 1.0642406705226717
Energy: 1.0666594232034419
Energy: 0.9891669249903613
Energy: 0.9887664340096718
Energy: 1.0657788754897053
Energy: 1.089931966161288
Energy: 1.0162248620222154
Energy: 1.006788374908776
Energy: 1.3856140873619713
Energy: 0.9921611368742415
Energy: 0.992169024106823
Energy: 1.2973991167616212
Energy: 0.9922939567397253
Energy: 1.0978342979533149
Energy: 1.063287059784161
Energy: 1.0585853677773884
Energy: 0.9794496822698175
Energy: 1.1279206082420137
Energy: 1.100575644155537
Energy: 1.0717685673941706
Energy: 1.063782443518094
Energy: 0.9905262796707924
Energy: 0.9883940352132111
Energy: 1.0639929586732875
Energy: 0.9873163447476991
Energy: 0.9898064270477114
Energy: 1.089234974750222
Energy: 0.987846469838744
Energy: 0.9887743132364067
Energy: 1.1298641358396229
Energy: 0.9876638874388558
Energy: 0.9899572809982796
Energy: 1.1202116528601478
Energy: 0.9897726843737609
Energy: 0.9874557116896516
Energy: 1.015550316138323
Energy: 0.9922719718885461
Energy: 0.9877088939861747
Energy: 1.1568990898241225
Energy: 0.9928554731747471
Energy: 0.9941251008773749
Energy: 1.0669795678975362
Energy: 0.991354801460888
Energy: 0.9980824352538014
Energy: 1.144012897404565
Energy: 0.9867350851757403
Energy: 0.9865828892253753
Energy: 1.0660760829355242
Energy: 0.989432456781863
Energy: 0.9872725634261919
Energy: 1.288341843000612
Energy: 0.9882765085554659
Energy: 1.0448639650333342
Energy: 1.2903364568522377
Energy: 0.9888083450286419
Energy: 1.1530000144972063
Energy: 1.1000976658391266
Energy: 1.0105984717461005
Energy: 1.064091701034755
Energy: 1.1201692567206822
Energy: 1.0708460866400855
Energy: 1.0286690377856413
Energy: 1.1872123795121536
Energy: 0.989392638417024
Energy: 0.9889845973222757
Energy: 0.9919067236563085
Energy: 1.16127429748349
Energy: 0.9931327610665609
Energy: 1.2117953405012423
Energy: 1.0479108930216081
Energy: 0.9896227012921239
Energy: 0.9923555572254379
Energy: 1.0524346370869535
Energy: 0.9933195865535583
Energy: 1.0425647731631393
Energy: 1.0714046463535394
Energy: 1.0643626594885502
Energy: 1.0439509521038572
Energy: 1.054680194361613
Energy: 1.0239207378209951
Energy: 1.044216934903987
Energy: 1.0898497450751023
Energy: 1.0216836880264597
Energy: 1.0652395870354028
Energy: 1.022062854003696
Energy: 1.0194470652408898
Energy: 1.0442256723415362
Energy: 1.0194206268015265
Energy: 1.0722136097098374
Energy: 1.0455736061551286
Energy: 1.0866120790286802
Energy: 1.0676445652720081
Energy: 1.052049899828713
Energy: 0.9905657105786331
Energy: 1.0795685589263062
Energy: 1.0519320203858316
Energy: 0.9909766030252746
Energy: 1.0502967182116265
Energy: 0.9964129449316574
Energy: 0.9859373169327652
Energy: 0.9876086496580455
Energy: 1.1345480363193723
Energy: 1.0117117355564038
Energy: 0.9869922034880401
Energy: 1.3474191737519514
Energy: 1.1013005804705958
Energy: 1.191208441312542
Energy: 0.9810779075443518
Energy: 1.2047670897397178
Energy: 0.979310389919805
Energy: 0.9925458895559943
Energy: 1.0992236463237721
Energy: 1.0197746187533738
Energy: 1.0164264754124979
Energy: 1.157167784167793
Energy: 0.9791604699777124
Energy: 0.9994600385926381
Energy: 0.9878386157989936
Energy: 0.987119099659539
Energy: 1.057255840873067
Energy: 0.9892387393020282
Energy: 0.9872015066600662
Energy: 0.9870240807778571
Energy: 0.9825858071576511
Energy: 0.9813803594402353
Energy: 0.9874362761167091
Energy: 0.9844317000335193
Energy: 0.9900611696047191
Energy: 0.9894341304409652
Energy: 0.987726362326107
Energy: 0.9875307306700265
Energy: 0.9909040358027211
Energy: 1.1177488593048786
Energy: 0.9873303631958127
Energy: 0.9871922314296788
Energy: 0.9935379642550363
Energy: 0.9928601691248677
Energy: 0.9880799127047488
Energy: 0.9932669866795961
Energy: 0.9915865844951572
Energy: 0.9965592463886778
Energy: 1.067398242873037
Energy: 1.0715203937039133
Energy: 1.0426440757119355
Energy: 1.0718955468527
Energy: 0.9895773533363155
Energy: 1.2871319402834434
Energy: 1.151630394964079
Energy: 1.1668708721051055
Energy: 0.9876259357557362
Energy: 1.159398724655302
Energy: 0.990094964237497
Energy: 1.1030289207023567
Energy: 1.083550841364909
Energy: 0.9903933967661762
Energy: 0.9874299274435852
Energy: 1.066077764690184
Energy: 1.0661689283358984
Energy: 0.9868125639121494
Energy: 0.9804353100602391
Energy: 0.9790722752723905
Energy: 1.0306438359284298
Energy: 1.003817568325663
Energy: 0.9892085312738231
Energy: 1.1594021582196434
Energy: 0.9921857410670303
Energy: 0.9919387450587334
Energy: 1.160697449096948
Energy: 0.9922241322691273
Energy: 1.099210754650862
Energy: 1.1213299401223569
Energy: 0.9888233732119063
Energy: 0.9899194726435271
Energy: 1.1236045106876538
Energy: 1.0121387949141396
Energy: 1.0694780105952582
Energy: 1.0903120645595974
Energy: 0.9915181516521867
Energy: 0.9929094577019434
Energy: 0.9950687836855863
Energy: 0.9898942281848931
Energy: 0.9923504662417169
Energy: 1.1246799507336547
Energy: 0.9884989075240075
Energy: 0.9877868768921066
Energy: 1.126513751558046
Energy: 0.9923159398022872
Energy: 0.9881770691381547
Energy: 1.1533134991752765
Energy: 0.9885528332912076
Energy: 0.9891201791155783
Energy: 1.0656316563368107
Energy: 0.9880109058811836
Energy: 0.9894522484514997
Energy: 1.0916441189726867
Energy: 0.9884731604633541
Energy: 0.9881444822986629
Energy: 1.0134657597886119
Energy: 1.0198865025661141
Energy: 0.9884315404888215
Energy: 1.1106371802707884
Energy: 1.0076391074418851
Energy: 1.0643313097183424
Energy: 1.1125877478392627
Energy: 0.9872423746370722
Energy: 1.0205320563218672
Energy: 1.1902908197168631
Energy: 0.9868876525915712
Energy: 0.9899582755270524
Energy: 1.2501263823232687
Energy: 0.9875678037384985
Energy: 1.0927133279587904
Energy: 1.0653734070511396
Energy: 0.99460250614769
Energy: 0.9870273150560287
Energy: 1.0107088735693777
Energy: 0.9889100409827386
Energy: 0.9874864250279864
Energy: 1.494677781806199
Energy: 1.0509028749155167
Energy: 1.0846547538328801
Energy: 1.0251106541058348
Energy: 1.051530730790043
Energy: 1.0851612750391508
Energy: 1.0437242978034795
Energy: 1.0628756557432195
Energy: 1.0668224524354293
Energy: 1.0098091103864835
Energy: 1.0451289562961588
Energy: 1.0680088880126126
Energy: 1.0458336549526817
Energy: 1.0212167589615548
Energy: 1.018801844995303
Energy: 1.0683803425960716
Energy: 1.066892323291329
Energy: 1.018624155521653
Energy: 1.0426082053787875
Energy: 1.025499608796787
Energy: 1.0265571067248844
Energy: 1.0433294896445702
Energy: 1.0642835127495556
Energy: 1.0259705238711267
Energy: 1.0469727081769504
Energy: 0.9864585319967062
Energy: 0.9889520709393371
Energy: 1.048183295428207
Energy: 0.9872564528607151
Energy: 0.9915665192877267
Energy: 1.1794552890617636
Energy: 0.987000461522941
Energy: 0.9870918871747156
Energy: 1.015005596362344
Energy: 0.9880061164605796
Energy: 0.9889782960571637
Energy: 0.9780140038193555
Energy: 0.9869881335388017
Energy: 1.022219117611254
Energy: 1.097838638477587
Energy: 1.0104955535121845
Energy: 1.0686842406395238

minimum gb energy = 0.9780140038193555 eV
minimum distance =  2.35033040262879 Angstroms
sigma value = 81


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

Energy: 1.8906414853759363
Energy: 1.127293051492391
Energy: 1.0486968660943359
Energy: 1.0511352187754248
Energy: 1.1271081107957162
Energy: 1.0491151635070823
Energy: 1.0168798004159612
Energy: 0.9827465345748333
Energy: 1.0656921605439933
Energy: 1.0243438218503425
Energy: 0.9826729590705879
Energy: 1.061374097725556
Energy: 1.0840856010253714
Energy: 1.0055110105909562
Energy: 0.9714731544629174
Energy: 1.0821714353045064
Energy: 1.0416626354553074
Energy: 1.0217599542324958
Energy: 1.018302032136691
Energy: 1.0427472720261792
Energy: 1.05191073274651
Energy: 1.0181639316172577
Energy: 0.9714933757580764
Energy: 1.0185765697358367
Energy: 1.0181205271528888
Energy: 1.0702346309963027
Energy: 1.0166667589923015
Energy: 1.0185128605692513
Energy: 1.0169527581291853
Energy: 1.017979380380937
Energy: 1.0984272326392897
Energy: 1.0650663665851736
Energy: 1.0370955290112625
Energy: 1.1149747952330065
Energy: 1.018541905283539
Energy: 1.0381360963773236
Energy: 1.0614672548308541
Energy: 1.0630509266715369
Energy: 1.0160558689118133
Energy: 1.0350802629019933
Energy: 1.0344958618235478
Energy: 1.0157664073980022
Energy: 1.1999356898214057
Energy: 1.310411682643264
Energy: 1.1483060254773894
Energy: 1.0527812301120139
Energy: 1.2294162199031078
Energy: 1.0904176659813558
Energy: 0.9997043843345996
Energy: 1.0142042304492538
Energy: 1.0160980406962388
Energy: 1.037283795388561
Energy: 1.0077292013991215
Energy: 0.978427553811286
Energy: 1.0896597262344472
Energy: 0.9567376728555427
Energy: 0.9565641035120599
Energy: 1.090299121413359
Energy: 0.9569408991305869
Energy: 0.9562509457353416
Energy: 1.0433427775350592
Energy: 0.9540026360965141
Energy: 0.953210092934917
Energy: 1.0390530424878357
Energy: 0.9910346912290896
Energy: 0.978237599300435
Energy: 1.0377412493203964
Energy: 1.0647558252990696
Energy: 0.9779671607338434
Energy: 0.9699985201480569
Energy: 1.0088785135242235
Energy: 1.0213596189310203
Energy: 1.0168548021911357
Energy: 1.0359986746456462
Energy: 1.0500316529698257
Energy: 0.9719950693496126
Energy: 1.0357066192290305
Energy: 1.0089820670969698
Energy: 1.0390886788744371
Energy: 0.9784570726189338
Energy: 1.0538242860172777
Energy: 1.0301637035363158
Energy: 0.9785141569785402
Energy: 1.0619125959198978
Energy: 1.2257006822016276
Energy: 1.1376252730144016
Energy: 1.1359445524696496
Energy: 1.0680189762919958
Energy: 1.0664121767392931
Energy: 1.0549430838102687
Energy: 1.0389877384229027
Energy: 1.0542783289716224
Energy: 1.0540538499322467
Energy: 1.0396896979956762
Energy: 1.032359537785688
Energy: 1.064517869855957
Energy: 1.2192040587604225
Energy: 0.9712809689725838
Energy: 1.0254405751904385
Energy: 1.219330279222225
Energy: 1.0521203516598165
Energy: 1.0245288690645273
Energy: 0.9848615909535746
Energy: 0.9849324344778456
Energy: 1.0229916747561676
Energy: 1.0091695909523206
Energy: 1.0467677123527184
Energy: 1.0240898120066904
Energy: 0.9534642999475709
Energy: 0.9860508028781806
Energy: 0.9542702706499451
Energy: 0.9538981094811795
Energy: 1.091131465429083
Energy: 0.9539786002321153
Energy: 0.9535720040921362
Energy: 0.9863787203501773
Energy: 0.9549585171312075
Energy: 0.9548929964261177
Energy: 1.0305937232609608
Energy: 0.9546091337943545
Energy: 0.9850197834764086
Energy: 0.9846883160053835
Energy: 1.0225745181502668
Energy: 1.0090827442544335
Energy: 1.0470756635768876
Energy: 1.0215857013922292
Energy: 1.0363870966026403
Energy: 0.970072309341154
Energy: 1.092560368414775
Energy: 1.0356269338024529
Energy: 1.0050769200657435
Energy: 1.0711709290321074
Energy: 1.0320093471587308
Energy: 1.0638065840730169
Energy: 1.064167758373374
Energy: 1.0335158120483365
Energy: 1.0329506140956455
Energy: 1.0547302584252307
Energy: 1.036132408604561
Energy: 1.1000120449909534
Energy: 1.05681225415901
Energy: 1.0579777275391737
Energy: 1.1020650890191832
Energy: 1.0568545391150386
Energy: 1.0345575062603467
Energy: 1.013758876098321
Energy: 1.0631253994829786
Energy: 1.0356791789635065
Energy: 0.9814649243609331
Energy: 1.054084193795812
Energy: 1.1983750683491683
Energy: 1.1508680929416941
Energy: 1.0975556801703523
Energy: 1.0098981337516613
Energy: 1.218771405345962
Energy: 1.01501272731939
Energy: 1.0260973641477822
Energy: 1.0980258048396296
Energy: 1.0148445005079767
Energy: 1.0084573203012892
Energy: 1.2144122937328656
Energy: 1.0157078152241474
Energy: 1.0381275773154626
Energy: 0.9536521202578051
Energy: 0.9772492312432765
Energy: 1.0389456271057584
Energy: 1.0388892851153766
Energy: 0.9779643093990585
Energy: 1.006981326182089
Energy: 0.9577868860679839
Energy: 0.9572835276942766
Energy: 1.0072229069710752
Energy: 0.9576053783081656
Energy: 0.9576993186264943
Energy: 1.0048242115848478
Energy: 0.9805560477351809
Energy: 1.014436791100981
Energy: 1.036430876181994
Energy: 1.0078813990985565
Energy: 0.979034298186994
Energy: 1.0164376756431384
Energy: 1.15661122852324
Energy: 1.1090234216563972
Energy: 1.0420605386104518
Energy: 1.086572914716629
Energy: 1.0063414960297001
Energy: 1.0632442071524741
Energy: 0.9764917505548439
Energy: 0.9767220305612457
Energy: 1.0367686059393708
Energy: 1.0289138104301407
Energy: 0.977176163980241
Energy: 1.0263285925822796
Energy: 0.9791064131591697
Energy: 1.0520112869444749
Energy: 1.0611128137506165
Energy: 0.9793755276572165
Energy: 1.0582487017583035
Energy: 1.024912543471347
Energy: 1.0443452491316563
Energy: 1.0444612812207874
Energy: 1.0281156152351973
Energy: 0.9855366192088765
Energy: 1.0415408444179524
Energy: 1.0274195372763413
Energy: 1.0581709370842394
Energy: 1.0550252623152097
Energy: 1.0253982091388414
Energy: 1.007202413078133
Energy: 1.055588893357925
Energy: 1.219883213282885
Energy: 0.9714271271400798
Energy: 0.9703142597879683
Energy: 1.2201565476555005
Energy: 1.0508779081885942
Energy: 1.138084408569868
Energy: 1.0176290350038788
Energy: 0.9826635816452735
Energy: 1.064193126105767
Energy: 1.0239436438869791
Energy: 0.9827653663845648
Energy: 1.0548445897062626
Energy: 1.1764591595577794
Energy: 1.0677489020936188
Energy: 1.0483776269191964
Energy: 1.0281932235614548
Energy: 1.0848802546807905
Energy: 1.048642258279945

minimum gb energy = 0.953210092934917 eV
minimum distance =  2.36402779643228 Angstroms
sigma value = 43


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

Energy: 1.853380564656381
Energy: 1.2977054367065204
Energy: 1.1639560755348781
Energy: 1.0621918978868
Energy: 1.2978658942013965
Energy: 1.0611845835159102
Energy: 1.0021747656084212
Energy: 1.009092438230854
Energy: 1.054887571987173
Energy: 1.065281116187239
Energy: 0.992634269828022
Energy: 1.0023041093883305
Energy: 1.0040360661459227
Energy: 0.9711363391744742
Energy: 0.9715013647303629
Energy: 1.0327552995322926
Energy: 0.9698013294401898
Energy: 1.0038270841021302
Energy: 1.003834925552898
Energy: 0.9701756804243686
Energy: 1.001742603510013
Energy: 1.0029479223295388
Energy: 0.9648107292116314
Energy: 1.0016469349927293
Energy: 1.002408531417182
Energy: 1.0845082177659207
Energy: 1.053872056534086
Energy: 1.0029545594967688
Energy: 1.0054936794139027
Energy: 1.0527700099826645
Energy: 1.004739448705258
Energy: 1.0036372300134888
Energy: 1.0491874673168917
Energy: 1.005818402050536
Energy: 1.0033362086798032
Energy: 1.0515132800822158
Energy: 0.9901688673678765
Energy: 1.0003320099381565
Energy: 1.0003894455749518
Energy: 0.9902006692197708
Energy: 1.0010574744520768
Energy: 1.0011523788733248
Energy: 1.0507364596084157
Energy: 1.0053958058843613
Energy: 1.004745557960448
Energy: 0.9675116201286951
Energy: 1.0064327621657314
Energy: 1.0034180518766667
Energy: 0.9908271296665777
Energy: 1.0017985958414826
Energy: 1.0015419492007724
Energy: 0.9908049121555941
Energy: 1.0031506114063642
Energy: 1.0018220189197324
Energy: 1.2981346416399233
Energy: 1.0007737701867399
Energy: 1.0005265767163205
Energy: 1.2989582205658148
Energy: 1.0009060842196402
Energy: 1.0003938694098873
Energy: 0.9687196143024545
Energy: 0.9702101036257724
Energy: 1.0180127627662148
Energy: 0.9916766537355912
Energy: 1.045623315726739
Energy: 1.0513439006748564
Energy: 1.0055511155184984
Energy: 1.00304515735108
Energy: 1.002015853359207
Energy: 0.9689204169182353
Energy: 1.0022204993868924
Energy: 1.001770766729125
Energy: 1.0079959090566994
Energy: 1.0049496382416616
Energy: 1.0303573212932633
Energy: 0.9718337320654087
Energy: 1.094420695835145
Energy: 1.0304302420975238
Energy: 0.9694447411413095
Energy: 1.0020225773283253
Energy: 1.120665844999092
Energy: 0.9910647524518833
Energy: 1.002703819546973
Energy: 1.0548477383779933
Energy: 0.9700840394848729
Energy: 1.0456929717043904
Energy: 1.0038187259690863
Energy: 0.9702987436648434
Energy: 0.9739956339728473
Energy: 1.0040143924395382
Energy: 0.9684588042994051
Energy: 1.0026371529597207
Energy: 0.9678682961820585
Energy: 0.9693393568754605
Energy: 1.077978254582798
Energy: 0.9677500359667126
Energy: 0.9703549549901068
Energy: 0.9726305766170904
Energy: 0.9728272565613998
Energy: 0.9704948238051341
Energy: 0.967229514237457
Energy: 0.9725676462255921
Energy: 0.9703594408388246
Energy: 0.9698506312449522
Energy: 0.9695253076935084
Energy: 1.0534983248213958
Energy: 0.969834038995319
Energy: 0.9687073298279485
Energy: 0.9878709206809196
Energy: 0.9699295016902788
Energy: 0.9703730471104544
Energy: 1.0461938535897695
Energy: 1.0022122587523374
Energy: 1.000351454224147
Energy: 0.9885221868908292
Energy: 0.970332742821566
Energy: 0.970159612756627
Energy: 1.1186446158873078
Energy: 1.0658010266181517
Energy: 1.0006256376793512
Energy: 0.970177108391527
Energy: 0.9703493694256173
Energy: 1.019426038631186
Energy: 1.0531616071187133
Energy: 1.0077086417516867
Energy: 0.9695108550313578
Energy: 1.2143123893008088
Energy: 1.030923708925112
Energy: 1.0715185634013267
Energy: 1.2144733739355462
Energy: 0.9681091019476818
Energy: 1.1541185558281868
Energy: 1.0540288922628651
Energy: 0.969037941138669
Energy: 0.9712912256385393
Energy: 1.0006136783129072
Energy: 1.0007225208927157
Energy: 0.9695412989829588
Energy: 1.0936715780165303
Energy: 1.0285912414857137
Energy: 0.9715580617212771
Energy: 0.9648060887320228
Energy: 0.9683521065963407
Energy: 0.9715249053680383
Energy: 1.0547451779236086
Energy: 0.9688225797009874
Energy: 0.9687404619142275
Energy: 0.9994273513992545
Energy: 0.9691852912033535
Energy: 0.9688760587410946
Energy: 1.0641213604462223
Energy: 0.9692952389756226
Energy: 0.9694278978213645
Energy: 1.0045388828607806
Energy: 0.9688988581251198
Energy: 1.0027117852657497
Energy: 1.0641323004536887
Energy: 1.0093023369480032
Energy: 0.9692482257363909
Energy: 1.0032129866564767
Energy: 1.0130381747879516
Energy: 0.9694070315414958
Energy: 1.0622770194095492
Energy: 1.0536146540308122
Energy: 1.004741145948358
Energy: 1.0018533596249293
Energy: 0.9912882025835202
Energy: 1.001604918628844
Energy: 1.0965468700114733
Energy: 1.0016704450986285
Energy: 1.0019763953746597
Energy: 1.0965130463886577
Energy: 0.9651243425688485
Energy: 1.0023235238992416
Energy: 1.0044043899414359
Energy: 1.0076904026448796
Energy: 1.1202119829572827
Energy: 1.065190697230146
Energy: 0.991101418558466
Energy: 1.0020406397292225
Energy: 1.1583822299445898
Energy: 1.2791420290888424
Energy: 1.1599395562794796
Energy: 1.0293622425061153
Energy: 1.2213974847558344
Energy: 0.9702332725099643

minimum gb energy = 0.9648060887320228 eV
minimum distance =  2.38419351071937 Angstroms
sigma value = 57


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

Energy: 1.1845396271913295
Energy: 1.1199013675461975
Energy: 1.078333628884594
Energy: 0.9559093546833533
Energy: 1.1197299004129424
Energy: 1.078721688698013
Energy: 0.9883698524992074
Energy: 1.001768464587501
Energy: 0.988949110634573
Energy: 0.9973562547356246
Energy: 1.000557343359216
Energy: 0.9882593261288717
Energy: 1.0275959018931655
Energy: 0.900059545298323
Energy: 0.8997870483830224
Energy: 1.0178556581708755
Energy: 0.8986401797411442
Energy: 0.8997035093371849
Energy: 0.9891498273114928
Energy: 0.8983917233371587
Energy: 0.8984792357763424
Energy: 0.9893628001180946
Energy: 1.0265159990845312
Energy: 0.9881712512692539
Energy: 0.988962000627913
Energy: 0.9381850411462009
Energy: 0.9419885905839016
Energy: 0.9882653453393254
Energy: 0.9384547833829873
Energy: 0.9425399200697893
Energy: 0.899774219689797
Energy: 0.9392834141099353
Energy: 0.9381152424981353
Energy: 0.9396328071471207
Energy: 0.9897275636709041
Energy: 0.9390875145177361
Energy: 0.9973344706543513
Energy: 0.9874620932552625
Energy: 0.9869400540576951
Energy: 0.996452724557436
Energy: 0.9896638532524299
Energy: 0.9870096662067976
Energy: 0.9850860171369559
Energy: 0.9865174937601625
Energy: 0.994574184108908
Energy: 0.9372460588591506
Energy: 0.9906161844842739
Energy: 0.9918799158015893
Energy: 0.9973182311064557
Energy: 0.9894261583251021
Energy: 0.9891593080246935
Energy: 0.9973294115494948
Energy: 0.9983055439517453
Energy: 0.9897385067820453
Energy: 1.1195722861024997
Energy: 0.9850200775647894
Energy: 0.9846436237187555
Energy: 1.119176507344908
Energy: 0.9851622979243978
Energy: 0.9841883810486667
Energy: 1.0275736328586536
Energy: 0.9396368336453506
Energy: 1.1230514728147736
Energy: 1.0053683189157308
Energy: 0.9866397163183784
Energy: 0.9888802966538717
Energy: 0.8975635375923693
Energy: 1.005018485355262
Energy: 0.9887756334399137
Energy: 0.9005233680636909
Energy: 1.0043443663463631
Energy: 1.064441939946182
Energy: 0.8972066745846055
Energy: 0.9963589412472511
Energy: 1.065132478459676
Energy: 1.0082329289653136
Energy: 1.0037332329073956
Energy: 1.0650264624135044
Energy: 0.9911733551499686
Energy: 0.9969549789923406
Energy: 0.9402633705097188
Energy: 1.000013165170064
Energy: 0.9961417662949852
Energy: 0.9887294990035033
Energy: 0.9903481716776906
Energy: 0.8995703916561173
Energy: 0.8985599286021067
Energy: 0.9905795515804582
Energy: 0.8988534279074027
Energy: 0.9532626892666142
Energy: 0.9866999477212163
Energy: 0.9883410839055706
Energy: 0.9902762049207641
Energy: 0.9887371872482887
Energy: 0.9391830200338237
Energy: 0.9923852686675223
Energy: 0.9897940610222284
Energy: 0.9392841861514022
Energy: 0.9387788124371289
Energy: 0.9891118145253436
Energy: 0.937808711353588
Energy: 0.9384063799658595
Energy: 0.9895725226135254
Energy: 0.9890339646554812
Energy: 0.9397633415792034
Energy: 0.9895650215120707
Energy: 0.9895325725198635
Energy: 0.9400177839104834
Energy: 0.9964376047237383
Energy: 0.9874561096681705
Energy: 0.9874695250423129
Energy: 0.9966308791706384
Energy: 0.9907159404938478
Energy: 0.9884369595602707
Energy: 0.9963225292161544
Energy: 0.9885571147407383
Energy: 0.9883871242817351
Energy: 0.9964616489415374
Energy: 0.9928838666338242
Energy: 0.9891790662462366
Energy: 1.003936506759559
Energy: 0.9885383527350794
Energy: 1.0466814430495004
Energy: 1.0032900882467566
Energy: 0.9959867055096641
Energy: 0.9971748720266208
Energy: 1.1258749970652662
Energy: 0.9865400180582755
Energy: 0.9873810539725489
Energy: 1.1259765980219296
Energy: 0.986068771419102
Energy: 1.0134911770705612
Energy: 0.9912416454199255
Energy: 0.9970697057740882
Energy: 0.9882943170899541
Energy: 0.9990390545883016
Energy: 0.9966022075552735
Energy: 0.9904119174846091
Energy: 0.8971944107444456
Energy: 0.9950617784516291
Energy: 1.0653834652949477
Energy: 1.008754425622242
Energy: 1.0374195938862605
Energy: 1.0650975584994693

minimum gb energy = 0.8971944107444456 eV
minimum distance =  2.37167888145391 Angstroms
sigma value = 17


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

Energy: 1.6380518567247853
Energy: 1.0181929192348504
Energy: 1.190978019250036
Energy: 0.9665262092249332
Energy: 1.047133468172108
Energy: 0.9670775384051287
Energy: 1.13654978520313
Energy: 1.030586197304882
Energy: 1.0302634230137464
Energy: 1.0926087965171873
Energy: 1.0320282386503723
Energy: 0.958610189453212
Energy: 1.2888270418065537
Energy: 0.9150058081805946
Energy: 0.9148288853082426
Energy: 1.031244720791983
Energy: 0.9153788535218956
Energy: 0.914882572236312
Energy: 1.0303017898652482
Energy: 0.914464101809707
Energy: 0.9145563776283274
Energy: 1.0302814036206096
Energy: 0.8485339303287197
Energy: 1.0306409069583997
Energy: 0.8975746402173288
Energy: 0.8860482055952484
Energy: 0.8848808749973114
Energy: 0.8976715786570392
Energy: 0.8847769109091952
Energy: 0.8827618771819251
Energy: 0.9165233520096734
Energy: 0.8847524395603101
Energy: 0.8842705739205767
Energy: 0.8492060738155222
Energy: 0.8848296318143833
Energy: 0.850059993703187
Energy: 0.8836478931641539
Energy: 0.882249364330339
Energy: 0.882372850619537
Energy: 0.8836081024107517
Energy: 0.8832772472290461
Energy: 0.9579016230559133
Energy: 0.8845616140369467
Energy: 0.9216425125918329
Energy: 0.9196075831329795
Energy: 0.9849815783494306
Energy: 0.957613862943873
Energy: 0.9185970338684311
Energy: 0.8857150880357002
Energy: 0.958978405673202
Energy: 0.9579209090639553
Energy: 0.8864609834925804
Energy: 0.8836480647854408
Energy: 0.8830503289511347
Energy: 0.8841416547313539
Energy: 0.9813917291329243
Energy: 0.9816477432003837
Energy: 0.8841314652939563
Energy: 0.8844249678614436
Energy: 0.8838511259644151
Energy: 1.0607134611347164
Energy: 0.9570741111636225
Energy: 0.9798945998388922
Energy: 0.8840587987056332
Energy: 1.0326999576342315
Energy: 0.9798064785881839
Energy: 1.024898248309302
Energy: 1.0310256301443872
Energy: 1.030911921524157
Energy: 1.02438737715121
Energy: 1.0315296222569361
Energy: 1.0311896689621989
Energy: 1.0296468931432061
Energy: 1.0320932270082543
Energy: 1.0324090544599083
Energy: 0.9548239643372115
Energy: 1.0317869486204965
Energy: 1.03239029707123
Energy: 1.0462468008921761
Energy: 1.0311169130260445
Energy: 1.032176581834894
Energy: 1.031491349426953
Energy: 1.0314147440758683
Energy: 0.9581719921879792
Energy: 1.0440969197028647
Energy: 1.0314053507811418
Energy: 1.0511429014357203
Energy: 1.0465456370510429
Energy: 1.0317083819515256
Energy: 1.026712512428159
Energy: 1.1772912991790707
Energy: 1.0916711875733445
Energy: 0.9598014366251434
Energy: 1.0317101862705413
Energy: 1.0447458510948167
Energy: 1.030344190690147
Energy: 1.0060368209486623
Energy: 1.032052448155522
Energy: 1.1441170844455844
Energy: 1.0058258482249405
Energy: 1.0442897860377276
Energy: 1.143696969516339

minimum gb energy = 0.8485339303287197 eV
minimum distance =  2.35574009990994 Angstroms
sigma value = 17


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

Energy: 1.7404399475444463
Energy: 1.040831111611425
Energy: 0.9635181882155452
Energy: 0.9221867617627366
Energy: 1.0405378611363045
Energy: 0.9672108987212962
Energy: 1.1006027725015257
Energy: 1.0255769387385747
Energy: 0.8758002855326121
Energy: 1.0200693799622786
Energy: 1.030055178621256
Energy: 0.9764599115838017
Energy: 1.2405236548704663
Energy: 0.822727047761494
Energy: 0.9213832869512841
Energy: 1.0263851444544065
Energy: 0.8231245905751622
Energy: 0.9209605323683792
Energy: 1.0301092242857364
Energy: 0.920300299716294
Energy: 0.9203993595535238
Energy: 1.0308248547194734
Energy: 0.8302760168007405
Energy: 0.9202728977190971
Energy: 0.8879848181287757
Energy: 0.8737303964941517
Energy: 0.8736537988129026
Energy: 0.8883362089538592
Energy: 0.8767738870947002
Energy: 0.9449638225138731
Energy: 0.921233277459312
Energy: 0.8741889232442359
Energy: 0.8240691744162267
Energy: 0.825098162342682
Energy: 0.8742412518696012
Energy: 0.8235444296677393
Energy: 0.8091830107776561
Energy: 0.8736239282033035
Energy: 0.8739481126476218
Energy: 0.8598423175518639
Energy: 0.8767550624744108
Energy: 0.9114730724494039
Energy: 0.8106363360789013
Energy: 0.7952781424847412
Energy: 0.8112929927945213
Energy: 0.8146703772311094
Energy: 0.9446474348434899
Energy: 0.8108547617532977
Energy: 0.8124529515290482
Energy: 0.890217597785522
Energy: 0.8097849124404011
Energy: 0.81230349739785
Energy: 0.8271910769102299
Energy: 0.8104457074759222
Energy: 0.8107932355016105
Energy: 0.8846442215127758
Energy: 0.8873793670815933
Energy: 0.8107393474910554
Energy: 0.8867767005148119
Energy: 0.8850909009493603
Energy: 0.8292609304670695
Energy: 0.8104483882282429
Energy: 0.8873738622957513
Energy: 0.8999618071269169
Energy: 0.8108746682950079
Energy: 0.9461520902801644
Energy: 0.8138240973218198
Energy: 0.8102180184065575
Energy: 0.8106507184870514
Energy: 0.8150816959015246
Energy: 0.8156203142179481
Energy: 0.8096694733809312
Energy: 0.9129383271894891
Energy: 0.8104382488959334
Energy: 0.8122692786224192
Energy: 0.8735966234135355
Energy: 0.813673670104417
Energy: 0.8107175527870351
Energy: 0.8745339176513219
Energy: 0.8976628752869629
Energy: 0.856087450730668
Energy: 0.8760492664630358
Energy: 0.8263790692340386
Energy: 0.8730102221336422
Energy: 0.8735638745431077
Energy: 0.8925331629051692
Energy: 0.8111906926319606
Energy: 0.8734204849207929
Energy: 0.89642793611555
Energy: 0.8758162345572504
Energy: 1.0260089756091326
Energy: 0.9384229471379454
Energy: 0.9456594717620264
Energy: 0.8755197380148877
Energy: 0.8889706345350578
Energy: 0.9462409696974285
Energy: 0.8105333627167522
Energy: 1.0268068076056156
Energy: 1.026415653503236
Energy: 0.8123283803094675
Energy: 1.0262807060724546
Energy: 0.8723373316939322
Energy: 0.8904776870539387
Energy: 1.0261584172797094
Energy: 1.0261325739822944
Energy: 0.8916291106109561
Energy: 1.0257856451257854
Energy: 0.8726592508211835
Energy: 1.02666749505156
Energy: 1.0199975579220029
Energy: 0.957633135838566
Energy: 0.8908114512157906
Energy: 0.8876780679184728
Energy: 0.8746674684352248
Energy: 1.241589097849662
Energy: 0.8815256185617262
Energy: 0.8805111434582384
Energy: 1.0342708873070943
Energy: 0.8740324697945968
Energy: 1.0141786625745424
Energy: 1.2104108384175372
Energy: 1.0201297674395313
Energy: 1.0195991497053551
Energy: 1.0296044215806466
Energy: 1.020923941739371
Energy: 1.018662548939641
Energy: 0.8236081071436823
Energy: 1.0270395900350013
Energy: 1.1290529019549975
Energy: 0.9487078226470291
Energy: 1.0263237361893873
Energy: 0.9209868207030152
Energy: 0.8286595864566363
Energy: 1.026231202085675
Energy: 1.0258114976320514
Energy: 0.8300424287263912
Energy: 1.0325267980657058
Energy: 1.130424950786165
Energy: 1.2414293534662613
Energy: 0.8248257920089973
Energy: 0.8754973318238651
Energy: 1.0278899782132191
Energy: 0.8221943385778001
Energy: 1.0263497071253378
Energy: 1.0272980533903249
Energy: 0.823053115984583
Energy: 0.9217721563581568
Energy: 1.0274460467158615
Energy: 0.8239047281112709
Energy: 0.9216112522457734
Energy: 0.8901819801209465
Energy: 0.8745201969462988
Energy: 0.8752094185436247
Energy: 0.8909303586670209
Energy: 0.87525047077003
Energy: 0.9538854796661899
Energy: 0.8749270030447642
Energy: 0.8741439429112393
Energy: 0.8752872767534066
Energy: 0.8244022225201676
Energy: 0.8786461611441172
Energy: 0.8247301440726043
Energy: 0.9042267108231047
Energy: 0.8732801479376552
Energy: 0.8736501079016761
Energy: 0.87447221929828
Energy: 0.8753765118872636
Energy: 0.873562525467787
Energy: 0.8127204967790863
Energy: 0.951961739900785
Energy: 0.9517157631247257
Energy: 0.8125601951710292
Energy: 0.8259891604831769
Energy: 0.952507354247402
Energy: 0.8104796477587621
Energy: 0.8821877017663329
Energy: 0.85591169786942
Energy: 0.8107856074899557
Energy: 0.9458631320244281
Energy: 0.8117207141892645
Energy: 0.8162546734092584
Energy: 0.9490404401543343
Energy: 0.8882459864294773
Energy: 0.8175461929686124
Energy: 0.9496662222389727
Energy: 0.8112174908943246
Energy: 0.8133568265945875
Energy: 0.9496237903133704
Energy: 0.8833306408398257
Energy: 0.8854416257377489
Energy: 0.8877884502678278
Energy: 0.887425741126133
Energy: 0.8238727341547214
Energy: 0.8098903863967338
Energy: 0.8100507419725187
Energy: 0.8243907290190124
Energy: 0.8122314273280953
Energy: 0.8100604266153119
Energy: 0.8745824394760442
Energy: 0.891052851088686
Energy: 0.9662174694212637
Energy: 0.9348524559256908
Energy: 0.8097033315482696
Energy: 0.957018544485047
Energy: 0.8821831017127875
Energy: 0.8959153450575752
Energy: 0.8974206219663158
Energy: 0.8733985439946371
Energy: 0.8968293788295865
Energy: 0.9596517936575096
Energy: 0.8730738901092265
Energy: 0.8910115743100016
Energy: 0.8741674389561387
Energy: 0.8732805217751538
Energy: 0.890428929955833
Energy: 0.873506154326701
Energy: 1.136054063222768
Energy: 0.946556216717751
Energy: 0.946384208895833
Energy: 0.8806823834939455
Energy: 0.8149028206204538
Energy: 0.8752591635236492
Energy: 0.8189475569501784
Energy: 1.0260938086816846
Energy: 1.0255637467012497
Energy: 0.9224464675794309
Energy: 1.0294790206988986
Energy: 0.9450319190245463
Energy: 0.8875745367631196
Energy: 1.0267508061715744
Energy: 0.8732098917552323
Energy: 0.8740817926785235
Energy: 1.0258202069391016
Energy: 0.8736309699933221
Energy: 1.0184361740651522
Energy: 1.0259618125637477
Energy: 1.0192666311623013
Energy: 0.8896058798807812
Energy: 1.030488997285288
Energy: 0.9538338461364488
Energy: 1.150900307486781
Energy: 0.8727648812675116
Energy: 1.0110788889486564
Energy: 1.028008783162248
Energy: 0.8732694798614263
Energy: 1.0109751110910075
Energy: 1.2405854218301522
Energy: 0.9597895755949253
Energy: 0.8739450556940488
Energy: 1.0306264114099124
Energy: 0.8884525624018487
Energy: 1.0265924438822736
Energy: 0.8300022960990847
Energy: 1.0258118349245258
Energy: 1.0256998504578896
Energy: 0.8320073921595034
Energy: 1.0313153256519876
Energy: 0.9803688389269172

minimum gb energy = 0.7952781424847412 eV
minimum distance =  2.34011880491728 Angstroms
sigma value = 57


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

Energy: 0.9698472960033966
Energy: 1.3232723240571005
Energy: 0.9434448847608591
Energy: 0.9174158152157187
Energy: 1.3220155223736116
Energy: 0.9478279991988078
Energy: 1.0537111784262674
Energy: 0.8645821588295296
Energy: 0.8717148853367106
Energy: 1.0020301934864233
Energy: 1.002940441834359
Energy: 0.9232004799650799
Energy: 1.1789129550709796
Energy: 0.9075206869312844
Energy: 0.8088170384252038
Energy: 1.0093522757191093
Energy: 0.8625798987423031
Energy: 0.907132799047549
Energy: 0.9859675224808587
Energy: 0.8627640409535134
Energy: 0.9066387501175697
Energy: 0.8655683692749419
Energy: 0.8511306304187044
Energy: 0.9067257206539172
Energy: 0.8470627234139859
Energy: 0.8677554116319998
Energy: 0.8584920703356206
Energy: 0.8481968508126945
Energy: 0.8632094542888098
Energy: 0.9202808443210295
Energy: 0.8090727618980742
Energy: 0.8593811706577761
Energy: 0.8087697642040539
Energy: 0.7601514717886879
Energy: 0.859092903025765
Energy: 0.810065425838174
Energy: 1.0300510708042088
Energy: 0.8669920820150633
Energy: 0.8590448878420058
Energy: 0.8050398819539086
Energy: 0.8649155746646316
Energy: 0.8755812986242355
Energy: 1.0416222073481038
Energy: 0.8833856023760324
Energy: 0.7604652154337174
Energy: 0.7895403484079472
Energy: 0.8834667900641204
Energy: 0.7869024695195905
Energy: 0.7885212474267279
Energy: 0.7855066522456179
Energy: 0.7846550192014208
Energy: 0.7903806009006651
Energy: 0.7932509453279564
Energy: 0.7849086386601157
Energy: 0.7850659172243568
Energy: 0.9057339016609779
Energy: 0.8815451893285693
Energy: 0.7853216420715794
Energy: 0.9029976775336278
Energy: 0.8818963700788733
Energy: 0.7746587755888125
Energy: 0.7537748599292634
Energy: 0.7577772703961578
Energy: 0.8768810545516941
Energy: 0.7534568651374404
Energy: 0.8761993782087582
Energy: 0.7901229421601447
Energy: 0.7622832607729333
Energy: 0.7536093659849659
Energy: 0.7915184468025646
Energy: 0.7643523007483888
Energy: 0.8218761572664856
Energy: 0.7521459910748768
Energy: 0.9103846618624886
Energy: 0.9118359001637892
Energy: 0.8359516457493217
Energy: 0.8496031942595924
Energy: 0.9138671549866788
Energy: 0.753368926634555
Energy: 0.8729670512731562
Energy: 0.7534207072068316
Energy: 0.7556041477198744
Energy: 0.7934428629005056
Energy: 0.7529075266079129
Energy: 0.7531080706427412
Energy: 0.8770864657580266
Energy: 0.8743357009349725
Energy: 0.7532311415507729
Energy: 0.849544701695675
Energy: 0.8210542642507995
Energy: 0.8058658956713924
Energy: 0.7856386148363487
Energy: 0.8965782763307252
Energy: 0.9149235839737898
Energy: 0.798951023048567
Energy: 0.8800467934530103
Energy: 0.8025160079130289
Energy: 0.7847353821137623
Energy: 0.7851028099515739
Energy: 0.7915632892515628
Energy: 0.7933636569629982
Energy: 0.786576098031173
Energy: 0.7579334456645166
Energy: 0.7976553580468565
Energy: 0.7867724332711032
Energy: 0.7583406839085842
Energy: 0.7953212287622681
Energy: 0.8962592027821574
Energy: 0.858254511785574
Energy: 0.8642382428573891
Energy: 0.8581521579807212
Energy: 0.8602173013786579
Energy: 0.803885941982371
Energy: 0.8583089212303554
Energy: 0.9826595313998833
Energy: 0.8529576979061944
Energy: 0.852248678440332
Energy: 0.8612003904564618
Energy: 0.7889630007498865
Energy: 0.918986917419877
Energy: 1.1288829150365223
Energy: 0.873509530351053
Energy: 0.9125988544620556
Energy: 0.8619420328391639
Energy: 0.869058929331856
Energy: 0.9134268883216905
Energy: 0.8456199527746845
Energy: 0.9990695513226047
Energy: 0.8585322020359962
Energy: 0.8965923839899654
Energy: 1.0115951039748714
Energy: 0.857991879556747
Energy: 0.7912429674130421
Energy: 1.0082240556461615
Energy: 1.0003257361211224
Energy: 0.7912367013988116
Energy: 1.0059245913141444
Energy: 1.0109087860633503
Energy: 1.0840623108118757
Energy: 0.8571422661520063
Energy: 0.9119831708549787
Energy: 0.8661232413703627
Energy: 0.9032925830330566
Energy: 0.8605546076946128
Energy: 1.1868323468112483
Energy: 0.8594733197439589
Energy: 0.8606910621868705
Energy: 0.9995417251943199
Energy: 0.8588801326945968
Energy: 0.9803247306181045
Energy: 1.1537484708687762
Energy: 1.003616036949462
Energy: 0.9913956853627975
Energy: 0.9986053843651013
Energy: 0.9985814718388564
Energy: 0.8607333546142062
Energy: 0.8540889227569097
Energy: 0.9999482144259555
Energy: 0.9075459929484181
Energy: 0.8097749559675587
Energy: 0.9984660504751987
Energy: 0.9072636792525612

minimum gb energy = 0.7521459910748768 eV
minimum distance =  2.34231682870726 Angstroms
sigma value = 43


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

Energy: 0.7957140290200263
Energy: 0.8938994690493496
Energy: 0.87630692680211
Energy: 0.7740377048500126
Energy: 0.9812553104834817
Energy: 0.8542740312127644
Energy: 0.9337238570581354
Energy: 0.7870448244840647
Energy: 0.8065824012609712
Energy: 0.8915676770860671
Energy: 0.787010056806252
Energy: 0.793245833537387
Energy: 1.0340784728387564
Energy: 0.7623961026163953
Energy: 0.7890270587268475
Energy: 0.8972810589470592
Energy: 0.7613636760697222
Energy: 0.7441956801113851
Energy: 0.8828235600406015
Energy: 0.7888682268214686
Energy: 0.7676888166921274
Energy: 0.7880484882482833
Energy: 0.7309790795394007
Energy: 0.8253190665808996
Energy: 0.8466244529230461
Energy: 0.7848445174960669
Energy: 0.8059044612528912
Energy: 0.8484479251584424
Energy: 0.7885045070195328
Energy: 0.7925488808942028
Energy: 0.6956300886642046
Energy: 0.7852561455328972
Energy: 0.7443362896038602
Energy: 0.7683119057244693
Energy: 0.784970775280307
Energy: 0.7313549643309728
Energy: 0.9855872775868852
Energy: 0.7847254956914943
Energy: 0.7845792982430022
Energy: 0.7512672528571923
Energy: 0.7853931267419331
Energy: 0.7733675659261738
Energy: 0.9319623185308256
Energy: 0.7400565916369922
Energy: 0.7531701428907911
Energy: 0.7206581206919772
Energy: 0.7401340054290123
Energy: 0.7547656693396818
Energy: 0.7213826978068955
Energy: 0.752023863961382
Energy: 0.7183547425036673
Energy: 0.7234761210019026
Energy: 0.6624720257617499
Energy: 0.718966814792438
Energy: 0.6953982025791137
Energy: 0.7193527160349893
Energy: 0.7448692907578399
Energy: 0.7045623342485593
Energy: 0.6809469629517115
Energy: 0.7441638487769587
Energy: 0.7127649735494793
Energy: 0.6790691940842213
Energy: 0.680228296149058
Energy: 0.7311610834802835
Energy: 0.6793459023124212
Energy: 0.7378816176050825
Energy: 0.7190552275585097
Energy: 0.6786418176148048
Energy: 0.6786807763329616
Energy: 0.6840032413411612
Energy: 0.6786216966358871
Energy: 0.740826032812491
Energy: 0.8820652724645246
Energy: 0.7279935898356942
Energy: 0.7648948064205242
Energy: 0.7002771848128608
Energy: 0.7323499102239446
Energy: 0.7906057517937686
Energy: 0.6563238437504557
Energy: 0.7781394572582636
Energy: 0.65527590305842
Energy: 0.6574866103497252
Energy: 0.6457193866901093
Energy: 0.6556286969064786
Energy: 0.6555265810281683
Energy: 0.7316709868367118
Energy: 0.7317634736271024
Energy: 0.6555129304334123
Energy: 0.7315756340188636
Energy: 0.7308519055630648
Energy: 0.6465394930445615
Energy: 0.645535622149162
Energy: 0.6455162145373028
Energy: 0.7150746070767823
Energy: 0.6454362555576632
Energy: 0.7333337332399067
Energy: 0.6598190432287817
Energy: 0.6453096653909449
Energy: 0.644990103355341
Energy: 0.6609217642645104
Energy: 0.6452637084616869
Energy: 0.7339134481700347
Energy: 0.645446322738396
Energy: 0.7338437910063472
Energy: 0.736221284753687
Energy: 0.6456002049436678
Energy: 0.7305635549250562
Energy: 0.7366109708529575
Energy: 0.6452365947657861
Energy: 0.7670161578274173
Energy: 0.6447416203590246
Energy: 0.6476041826357503
Energy: 0.7848502872403248
Energy: 0.6449822074134108
Energy: 0.6476896873200102
Energy: 0.7433475862035142
Energy: 0.7427032031731086
Energy: 0.6478784830786036
Energy: 0.7617429186293997
Energy: 0.7427736418931932
Energy: 0.682514186192867
Energy: 0.6557297676911066
Energy: 0.6556119042100393
Energy: 0.7283258071394272
Energy: 0.6555809101375096
Energy: 0.7426338941641449
Energy: 0.6499500988815559
Energy: 0.6564793523881322
Energy: 0.6559349839539104
Energy: 0.6508778252099254
Energy: 0.6564389188608478
Energy: 0.7292019371153472
Energy: 0.6783415114622725
Energy: 0.7035261437056355
Energy: 0.7344940128442835
Energy: 0.678510067233908
Energy: 0.7238048646919483
Energy: 0.7337358491875883
Energy: 0.6790031591743668
Energy: 0.7843109983771841
Energy: 0.6785734279429099
Energy: 0.680948998833957
Energy: 0.6558878534397076
Energy: 0.6789592708831179
Energy: 0.9003437268408087
Energy: 0.7576998879480596
Energy: 0.7445218120910515
Energy: 0.6810736337274798
Energy: 0.7336159212089844
Energy: 0.6796492684469445
Energy: 0.7871219206415639
Energy: 0.7185826219923671
Energy: 0.7186327475148279
Energy: 0.7207334190011198
Energy: 0.718505261775058
Energy: 0.7550749413149325
Energy: 0.6959066385620294
Energy: 0.7189568261242909
Energy: 0.7189870905518315
Energy: 0.7557492982766849
Energy: 0.7190375853862706
Energy: 0.7474928764528921
Energy: 0.6785358040019159
Energy: 0.7203834050585737
Energy: 0.768692248794893
Energy: 0.6784043632925562
Energy: 0.7231466720558289
Energy: 0.7666495764789724
Energy: 0.788284652068475
Energy: 0.748561003837214
Energy: 0.7845791495217515
Energy: 0.7903882540229143
Energy: 0.6778788022809178
Energy: 0.7848860410814879
Energy: 0.9776143900165414
Energy: 0.751357987901829
Energy: 0.7718251116354209
Energy: 0.7849705411193549
Energy: 0.750931472302298
Energy: 0.75252562772151
Energy: 0.9587735857013195
Energy: 0.7865846508237669
Energy: 0.8056553412081547
Energy: 0.7852405321529313
Energy: 0.7892642383487231
Energy: 0.8162236746801229
Energy: 0.7774143248073848
Energy: 0.8627077874339474
Energy: 0.7845751053863254
Energy: 0.7276242950205307
Energy: 0.8970654188015161
Energy: 0.7597287807891366
Energy: 0.8067903408655399
Energy: 0.8965181301645871
Energy: 0.8745711478366996
Energy: 0.8567043164238325
Energy: 0.9020797896381738
Energy: 0.8510636060539782
Energy: 0.9583071126559368
Energy: 0.8013436027508172
Energy: 0.7856581974344812
Energy: 0.7886225984135891
Energy: 0.7722100800705609
Energy: 0.8952070853104479
Energy: 1.0332884595744602
Energy: 0.7580272848530317
Energy: 0.8103703629277337
Energy: 0.8971731011111241
Energy: 0.7573701695900152
Energy: 0.7862143631513036
Energy: 0.9780231129482787
Energy: 0.8966226747810747
Energy: 0.8551313793463126
Energy: 0.8914793749831468
Energy: 0.8969970287456401
Energy: 0.7775171072635702

minimum gb energy = 0.6447416203590246 eV
minimum distance =  2.34682874639684 Angstroms
sigma value = 81


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

Energy: 0.34669812502800235
Energy: 0.5846009930275836
Energy: 0.08517100519844509
Energy: 0.08704298148102001
Energy: 0.5854941580603852
Energy: 0.3474007010065238
Energy: 0.6347775759928694
Energy: 0.5844252974073747
Energy: 0.584636078064096
Energy: 0.6365148082989384
Energy: 0.5845773865968329
Energy: 0.5826339155831317
Energy: 0.6270028800716725
Energy: 0.08500598290237181
Energy: 0.08492753042944527
Energy: 0.6361499679172894
Energy: 0.08474913226886424
Energy: 0.13330570873589406
Energy: 0.60081750208695
Energy: 0.08480077409275272
Energy: 0.08498552078218992
Energy: 0.606497988216963
Energy: 0.08493731638322245
Energy: 0.13246172432297132
Energy: 0.13183394671213122
Energy: 0.6538299099834471
Energy: 0.6537723189735807
Energy: 0.13297553567098008
Energy: 0.6541276173453119
Energy: 0.6539177392041285
Energy: 0.08557939197932368
Energy: 0.6079775414166858
Energy: 0.08474024747191268
Energy: 0.08739938978557889
Energy: 0.6082973652684837
Energy: 0.08488654843029139
Energy: 0.6453170847572122
Energy: 0.6079700324556306
Energy: 0.6081420417810385
Energy: 0.6529386350785467
Energy: 0.6079025596745906
Energy: 0.6082595371150398
Energy: 0.6428911972028301
Energy: 0.08495010479456604
Energy: 0.08492091847453663
Energy: 0.6517073826904188
Energy: 0.08460158852304112
Energy: 0.08484951562633858
Energy: 0.5855095858744003
Energy: 0.08499611366146466
Energy: 0.1337542285005214
Energy: 0.5929568651961088
Energy: 0.08485798353847959
Energy: 0.13423049555377792
Energy: 0.3474538721008268
Energy: 0.6336801240418968
Energy: 0.6284817112060438
Energy: 0.08510588389825802
Energy: 0.6286778948381627
Energy: 0.6261692853030274

minimum gb energy = 0.08460158852304112 eV
minimum distance =  2.42177034774739 Angstroms
sigma value = 3


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

Energy: 0.8471637754964159
Energy: 0.87463780863105
Energy: 0.9193578933252801
Energy: 0.7732045110720818
Energy: 0.874550690927723
Energy: 0.7897743979831289
Energy: 0.8254884557576154
Energy: 0.8579613444429112
Energy: 0.8573262322328237
Energy: 0.8659443571148252
Energy: 0.8608943907317126
Energy: 0.8761011375508594
Energy: 0.8829928665208658
Energy: 0.8069241084531985
Energy: 0.7943291562150949
Energy: 0.8552594892918659
Energy: 0.806269289333866
Energy: 0.8699395483143871
Energy: 0.7947964657292412
Energy: 0.8370372707403207
Energy: 0.8372626843064077
Energy: 0.794399659878394
Energy: 0.7110491723918071
Energy: 0.8642636942173841
Energy: 0.7172535633931911
Energy: 0.858003261584521
Energy: 0.7930902367214085
Energy: 0.7172703433950861
Energy: 0.8619943617352682
Energy: 0.8729481174877819
Energy: 0.6627497833811661
Energy: 0.7952481097439085
Energy: 0.7860735588870407
Energy: 0.7718744856363886
Energy: 0.7941715693484401
Energy: 0.717242589469496
Energy: 0.7910084031456461
Energy: 0.7254795664627768
Energy: 0.7254481526418619
Energy: 0.7928096302372802
Energy: 0.725997751002917
Energy: 0.8012003808542391
Energy: 0.7922783084960864
Energy: 0.6663803020451601
Energy: 0.7232467414217382
Energy: 0.7926611085454635
Energy: 0.6328033698602129
Energy: 0.7205443666959005
Energy: 0.6734225917865861
Energy: 0.8210907440662545
Energy: 0.8492958915319697
Energy: 0.8514047591617045
Energy: 0.6656130738102376
Energy: 0.8485130383389671
Energy: 0.6704309113408978
Energy: 0.7272324956760287
Energy: 0.7266492801028749
Energy: 0.6705647253677964
Energy: 0.7291053647278715
Energy: 0.7263716406713719
Energy: 0.633729826423005
Energy: 0.7713376230809532
Energy: 0.727434859780144
Energy: 0.735910662417606
Energy: 0.6372983395291603
Energy: 0.6690483762354378
Energy: 0.670351323089365
Energy: 0.8315864430676673
Energy: 0.8276866235686847
Energy: 0.6703149466427895
Energy: 0.71780872224277
Energy: 0.6701643502044857
Energy: 0.6727965689569684
Energy: 0.6570048137848115
Energy: 0.6725524859206213
Energy: 0.673829774779146
Energy: 0.7134459409785595
Energy: 0.6768588063012186
Energy: 0.6159488218294465
Energy: 0.6345353217656515
Energy: 0.80471686840342
Energy: 0.7652126901924073
Energy: 0.6340126074153443
Energy: 0.8046724392585707
Energy: 0.6185853680503326
Energy: 0.6350481067913991
Energy: 0.6348807422021846
Energy: 0.6208432529564297
Energy: 0.6363942062113921
Energy: 0.6347600174437816
Energy: 0.6184229347499614
Energy: 0.7842364290874912
Energy: 0.6366211198579363
Energy: 0.6220964445705551
Energy: 0.7331527331545331
Energy: 0.6381402985749532
Energy: 0.6161540201355007
Energy: 0.7971744223870375
Energy: 0.7906975747061421
Energy: 0.6162330093794248
Energy: 0.7311736495711751
Energy: 0.616694553039983
Energy: 0.6159765517555066
Energy: 0.7969215630426093
Energy: 0.6186038991459397
Energy: 0.6163980279321366
Energy: 0.7138769039587499
Energy: 0.6182868437926732
Energy: 0.8011592021428503
Energy: 0.6186741462792718
Energy: 0.7223139399450926
Energy: 0.7163178375731171
Energy: 0.6187461200709433
Energy: 0.7185424109693965
Energy: 0.8027712246556588
Energy: 0.6164078744824733
Energy: 0.6163241483792985
Energy: 0.8041306704217582
Energy: 0.6186229745857964
Energy: 0.6163008212093403
Energy: 0.7948390281628112
Energy: 0.6378956825980343
Energy: 0.6375944006118162
Energy: 0.7966404414132303
Energy: 0.7205445714635587
Energy: 0.7885239941074752
Energy: 0.645716039538436
Energy: 0.6383789188983545
Energy: 0.6361594883058634
Energy: 0.6355268099529284
Energy: 0.6377852123958798
Energy: 0.6355670473485446
Energy: 0.6332511944689859
Energy: 0.8028542264573701
Energy: 0.8052807428080022
Energy: 0.6333909162511918
Energy: 0.8048711879119631
Energy: 0.8084118576315855
Energy: 0.6234051777999423
Energy: 0.6753492210950128
Energy: 0.673374469032651
Energy: 0.7192433039795892
Energy: 0.6751721659001592
Energy: 0.6481606716629335
Energy: 0.6371303879623352
Energy: 0.6709259336783522
Energy: 0.6704467802974646
Energy: 0.6390442958734532
Energy: 0.673213518268867
Energy: 0.6703387936820582
Energy: 0.6345841006212171
Energy: 0.647002989117626
Energy: 0.6958750342460442
Energy: 0.6383704716413647
Energy: 0.716857300838127
Energy: 0.769042754326041
Energy: 0.728024036024587
Energy: 0.7551745617785818
Energy: 0.7550579639712995
Energy: 0.7277681320569895
Energy: 0.6466426433705234
Energy: 0.7274075198711021
Energy: 0.6903036719018829
Energy: 0.7709922333677003
Energy: 0.7695356269930195
Energy: 0.6903448218715725
Energy: 0.769952568115628
Energy: 0.8506162231889275
Energy: 0.6432110503103209
Energy: 0.7943443090585244
Energy: 0.7578032929910763
Energy: 0.7481461911596272
Energy: 0.7932761788150139
Energy: 0.7045790277370823
Energy: 0.7251215098131754
Energy: 0.7269770470679586
Energy: 0.8061420320693944
Energy: 0.725148618960665
Energy: 0.79549397108403
Energy: 0.8040057824594591
Energy: 0.8100168171344528
Energy: 0.686353800133734
Energy: 0.7467658467620968
Energy: 0.809816567094395
Energy: 0.7413612703752701
Energy: 0.7480586645629789
Energy: 0.886335303951508
Energy: 0.8325522646625625
Energy: 0.8517966716019143
Energy: 0.8623933389684059
Energy: 0.6852568069428125
Energy: 0.806613764153372
Energy: 0.7435893496476035
Energy: 0.7937116623369758
Energy: 0.792525757541612
Energy: 0.743643405040032
Energy: 0.795451421191883
Energy: 0.8194639875082496

minimum gb energy = 0.6159488218294465 eV
minimum distance =  2.34475110011006 Angstroms
sigma value = 67


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

Energy: 0.8981236648150889
Energy: 1.0261596981728769
Energy: 0.9792744539426488
Energy: 0.9165579215603338
Energy: 1.0241407733164403
Energy: 0.9797169464460835
Energy: 1.0362857946106165
Energy: 1.0031931864318357
Energy: 0.9952475750915512
Energy: 0.9989715918077191
Energy: 1.0013320284269425
Energy: 0.9951402238257729
Energy: 1.0112052660245356
Energy: 0.9015260547627542
Energy: 1.0096775749217552
Energy: 1.0025609945400749
Energy: 0.8756808389193305
Energy: 0.9887464505897264
Energy: 0.9096241533740682
Energy: 1.0261897227218177
Energy: 1.0036637145345102
Energy: 0.9107685485607044
Energy: 0.8102536708503479
Energy: 1.0038859657439283
Energy: 0.9041132288222872
Energy: 1.002413419149241
Energy: 1.0077937843551044
Energy: 0.9040522449178177
Energy: 0.9992168319001693
Energy: 1.0098461754271812
Energy: 0.7672744199218813
Energy: 1.008276215385057
Energy: 0.9605834486098689
Energy: 0.8823337936951442
Energy: 0.9077036588007233
Energy: 0.9094009113506512
Energy: 0.9161952729365777
Energy: 0.9236279246083499
Energy: 0.9189029941110071
Energy: 0.9056522512697307
Energy: 0.8199405397699528
Energy: 0.9192871450040657
Energy: 0.936344310936473
Energy: 0.769634441899256
Energy: 0.8174919957408381
Energy: 0.9386528296119775
Energy: 0.7675317213646847
Energy: 0.909370609020063
Energy: 0.9818008100645337
Energy: 0.9775982110095623
Energy: 0.9797591140885074
Energy: 0.9785994570958967
Energy: 0.8139399144428402
Energy: 0.9775249125384592
Energy: 0.7639387053932388
Energy: 0.8199176981886285
Energy: 0.8152904756449216
Energy: 0.7641401758099108
Energy: 0.8181104693477184
Energy: 0.814149069728917
Energy: 0.7652310169120478
Energy: 0.9613549140583453
Energy: 0.8825433461926357
Energy: 0.8988723186841875
Energy: 0.9001136236117239
Energy: 0.8177649367608633
Energy: 0.7696664388464559
Energy: 0.9608481777642475
Energy: 0.8759108803465601
Energy: 0.7699360222766014
Energy: 0.9375724643300715
Energy: 0.765629677553474
Energy: 0.7714997699083262
Energy: 0.9589386808972823
Energy: 0.7685494503386555
Energy: 0.7725602656061685
Energy: 0.8300296149261585
Energy: 0.766475015162762
Energy: 0.7669454948434763
Energy: 0.8804373440043739
Energy: 0.8768313005474938
Energy: 0.8923651110220662
Energy: 0.7671589301618054
Energy: 0.878047303663382
Energy: 0.8649722185248006
Energy: 0.7696582249757019
Energy: 0.7649428125939807
Energy: 0.8650416343288047
Energy: 0.7672029347009978
Energy: 0.7653418333725361
Energy: 0.9602085773756389
Energy: 0.9944749481664678
Energy: 0.9859056895978859
Energy: 0.8750151214740193
Energy: 0.7648760318822064
Energy: 0.9633778739340506
Energy: 0.8258875165733869
Energy: 0.7563014256708406
Energy: 0.7790886328980452
Energy: 0.8261144610626331
Energy: 0.7555751023679091
Energy: 0.8212012329262435
Energy: 0.8156886990858297
Energy: 0.9797640468284412
Energy: 0.9836593013225781
Energy: 0.8156510216465658
Energy: 0.8769306350233071
Energy: 0.8139345154671085
Energy: 0.7502547605140191
Energy: 0.9496082364966337
Energy: 0.9122004105164055
Energy: 0.9142582527908988
Energy: 0.8606711520740714
Energy: 0.8619049064253959
Energy: 0.8133712601301238
Energy: 0.9107005155741544
Energy: 0.9191072896548135
Energy: 0.8135517707874597
Energy: 0.9077537198815278
Energy: 0.9196146996071141
Energy: 0.9287125920515097
Energy: 0.9771768336131881
Energy: 0.9793342707519317
Energy: 0.928380667817592
Energy: 0.7742881220694148
Energy: 0.980164690497487
Energy: 1.0099706003813353
Energy: 0.773827651370828
Energy: 0.9803508138011662
Energy: 1.0036248371049066
Energy: 0.7796417792136464
Energy: 0.9699850864188444
Energy: 0.9562717375142982
Energy: 0.9089734240514084
Energy: 0.9051653377195024
Energy: 0.9569806287074248
Energy: 0.9097893931282507
Energy: 0.9056705597681874

minimum gb energy = 0.7502547605140191 eV
minimum distance =  2.3387060060327 Angstroms
sigma value = 33


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

Energy: 1.0479178041939963
Energy: 1.0675924562854964
Energy: 1.1624140184749197
Energy: 0.8899585467882798
Energy: 1.0668038209668853
Energy: 1.0568590064281815
Energy: 1.1384391121202728
Energy: 1.0760456824573543
Energy: 1.0759726945140853
Energy: 1.0799868719536199
Energy: 1.0797768365143419
Energy: 1.0760799623751094
Energy: 1.148574285493285
Energy: 0.9597776242901721
Energy: 1.032757745805783
Energy: 1.14530101295736
Energy: 1.0164870998176452
Energy: 1.078097486104955
Energy: 1.0841005801775412
Energy: 1.0290549797236832
Energy: 1.0809544492767689
Energy: 1.0849404461973686
Energy: 0.957513906637306
Energy: 1.0821914908627577
Energy: 0.9626005015820585
Energy: 1.0767662638695592
Energy: 1.0758175249317432
Energy: 0.9629289970552445
Energy: 1.080002587478445
Energy: 1.0859369206668508
Energy: 0.8607462915798058
Energy: 1.0911451517393436
Energy: 0.9778077524630862
Energy: 0.8653009803923223
Energy: 1.09110709193967
Energy: 1.0581371006870215
Energy: 0.9633116955510634
Energy: 0.9791450295722447
Energy: 0.9770347853829889
Energy: 0.9629397181784932
Energy: 0.9818861644491568
Energy: 0.9784580591745106
Energy: 0.9705321782171483
Energy: 0.8611390211604418
Energy: 0.9205275332233369
Energy: 0.9717008268429146
Energy: 0.8627240831870909
Energy: 0.9687943926642612
Energy: 1.0664848709148698
Energy: 0.9843482450489562
Energy: 1.0820211775150586
Energy: 0.8742887224663054
Energy: 0.8627620052799368
Energy: 0.9821626438470371
Energy: 1.0593920666126226
Energy: 0.8633315663609558
Energy: 0.8630964088854575
Energy: 1.0620376758179833
Energy: 0.8644328522648828
Energy: 0.8625712876945173
Energy: 0.9551333076043702
Energy: 0.9744280273351782
Energy: 1.0685772527315056
Energy: 0.8669863630160417
Energy: 0.8622007183938512
Energy: 0.8648912270164001
Energy: 0.8623442700577699
Energy: 0.8659228971299077
Energy: 0.8623476831279809
Energy: 0.8623016273395548
Energy: 1.0561239045176505
Energy: 0.8619857825781833
Energy: 0.8613971493328573
Energy: 0.9800614355072118
Energy: 0.8623656382371409
Energy: 0.8615199503945654
Energy: 0.9803417816899777
Energy: 0.8625958821400053
Energy: 1.0678598321470951
Energy: 1.0073808512171083
Energy: 0.9790195890504284
Energy: 0.8390220585691945
Energy: 1.0259127794397593
Energy: 0.8886895821992323
Energy: 0.8343325260050114
Energy: 0.9625994804023945
Energy: 0.9632538874688191
Energy: 0.8351153318890854
Energy: 0.9657206368601818
Energy: 0.9774325667804815
Energy: 0.9798851784936197
Energy: 1.060373546123247
Energy: 1.0614641353085583
Energy: 0.9823404788539585
Energy: 0.8871785931706718
Energy: 0.996288393139328
Energy: 1.1456821001013626
Energy: 0.8856702501492156
Energy: 0.8882180323606399
Energy: 1.1465157924258884
Energy: 0.8930351156387213
Energy: 1.05012005419372
Energy: 1.1385795064317619
Energy: 0.9622939196585706
Energy: 0.9633055147073605
Energy: 1.078913551142638
Energy: 0.9627168584437605
Energy: 1.0845859638820183
Energy: 0.8850625083212496
Energy: 1.0846648143148574
Energy: 1.0028474144688833
Energy: 0.8913481389642616
Energy: 1.0848367202492637
Energy: 1.041360769697164
Energy: 1.030482308148115
Energy: 1.075941146185521
Energy: 1.0759853105672121
Energy: 1.0308514062499008
Energy: 1.0806361907511068
Energy: 1.0757998885140094
Energy: 1.100019625198748
Energy: 1.030964471872569
Energy: 1.0797874599768298
Energy: 1.0881035383548794
Energy: 1.0609319242909823
Energy: 1.0673977539178094
Energy: 1.0885941079436148
Energy: 0.9638988330631588
Energy: 1.08147362718001
Energy: 1.0887867103081637
Energy: 1.0981839563416507
Energy: 1.0806730334880825
Energy: 0.9629405539142393
Energy: 1.0766594634529048
Energy: 1.0774135629055688
Energy: 0.9631147177994454
Energy: 1.0793956971301402
Energy: 1.105243329212581
Energy: 0.8600790154911627
Energy: 0.9876245519725153
Energy: 0.982944811135178
Energy: 0.8619564548277056
Energy: 0.9861672829800544
Energy: 0.9808813675030582
Energy: 0.9629073461453537
Energy: 0.9928685128484048
Energy: 1.1041488607211387
Energy: 0.9627705881950076
Energy: 0.9800668347510125
Energy: 1.0383159680074039
Energy: 0.971218934579745
Energy: 0.861907502119076
Energy: 0.9190793656716401
Energy: 0.9704897445852273
Energy: 0.8640349329054375
Energy: 0.9687590109280054
Energy: 0.9187796612777916
Energy: 0.862516682282325
Energy: 1.0789618619416008
Energy: 1.007952604535671
Energy: 0.8618668960318938
Energy: 1.093138451285417
Energy: 1.0588108968145014
Energy: 0.8635998510366119
Energy: 0.8635916449083276
Energy: 0.9571265001744632
Energy: 0.8651291559735036
Energy: 0.8629713653904442
Energy: 0.956684421144745
Energy: 0.8625295159782852
Energy: 0.8813661742933987
Energy: 0.8620232226600595
Energy: 0.861801767767087
Energy: 1.0720185401257125
Energy: 0.8610401804827151
Energy: 0.8663093797057871
Energy: 0.8615403615930574
Energy: 0.8609982006082952
Energy: 1.045302564607868
Energy: 0.8620052668259215
Energy: 0.862824476750179
Energy: 1.0677017041442005
Energy: 0.8624976477472774
Energy: 0.8627871986336302
Energy: 0.9801447550215697
Energy: 0.862508704893428
Energy: 0.8346545845138965
Energy: 1.0640365182727942
Energy: 1.0629440235652938
Energy: 0.8383608620724885
Energy: 1.007559590643053
Energy: 0.8868853657948491
Energy: 0.8342827067484913
Energy: 0.9638573147608359
Energy: 0.9629909445898621
Energy: 0.8351490691252279
Energy: 0.9685428837762987
Energy: 0.9776033406258556
Energy: 0.9762350704666476
Energy: 0.8909691468035267
Energy: 0.9965319989263007
Energy: 0.9775746076031863
Energy: 0.887029994734894
Energy: 0.9960781196554394
Energy: 1.1445598037982896
Energy: 0.8853334769232422
Energy: 0.9914846595742876
Energy: 1.1456083497241454
Energy: 0.8410312181731143
Energy: 1.0504312731872283
Energy: 1.138914982889946
Energy: 0.9620521251220506
Energy: 0.9623768343059895
Energy: 1.0789670943060785
Energy: 0.9617333521711326
Energy: 1.0877153411491378
Energy: 0.8852575491367162
Energy: 1.0844478217225126
Energy: 1.1080369709800506
Energy: 0.8891040396944893
Energy: 1.084664173785955
Energy: 1.0402249198457696

minimum gb energy = 0.8342827067484913 eV
minimum distance =  2.3461685618997 Angstroms
sigma value = 41


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

Energy: 1.4176367347024157
Energy: 1.1385918644321333
Energy: 1.260032981498688
Energy: 1.0740633830661972
Energy: 1.1360559230659293
Energy: 1.263318197121269
Energy: 1.2339700536678953
Energy: 1.1378265690702312
Energy: 1.1361157834573326
Energy: 1.1365228266919032
Energy: 1.1387503653759943
Energy: 1.1373809409489632
Energy: 1.190218121766755
Energy: 1.0066890509691662
Energy: 1.1313253075753396
Energy: 1.18926472234626
Energy: 1.0100791292582196
Energy: 1.130274692060265
Energy: 1.1357656067668356
Energy: 1.0887282566271284
Energy: 1.0896986852845514
Energy: 1.137526034250243
Energy: 1.0038453920211465
Energy: 1.0101873013849454
Energy: 1.0067414056824362
Energy: 1.137238156688041
Energy: 1.1365629954021745
Energy: 1.0072031448249166
Energy: 1.1371466713371061
Energy: 1.09322655910322
Energy: 1.1917114067217287
Energy: 1.1656199712133588
Energy: 1.1648413161771456
Energy: 1.0649586055144387
Energy: 1.1635719428729157
Energy: 1.1370957748686867
Energy: 1.0070452703918653
Energy: 1.0949453992425289
Energy: 1.0962418870938482
Energy: 1.0062722692617787
Energy: 1.0923279018988612
Energy: 1.0070914979013394
Energy: 1.0084580010776218
Energy: 0.970720648167747
Energy: 1.0065098792492109
Energy: 1.0098600632263106
Energy: 0.9695966521752216
Energy: 1.0079137222535257
Energy: 1.1583235137993215
Energy: 1.1003424015400478
Energy: 1.192990022995009
Energy: 1.1686003795812558
Energy: 1.007279030909626
Energy: 0.9896624492454266
Energy: 1.0709445273413853
Energy: 1.0144595966895078
Energy: 1.0072438389159968
Energy: 1.0735823213059326
Energy: 1.0084734271444482
Energy: 1.00925840102124
Energy: 1.1756024307657889
Energy: 1.0075307763622294
Energy: 1.0974222798780244
Energy: 1.1844520411254758
Energy: 0.9423499574224934
Energy: 1.0975579176271797
Energy: 1.1898378619473131
Energy: 1.0695926737296668
Energy: 1.138538103906688
Energy: 1.1907928491142696
Energy: 0.942092822819552
Energy: 1.0764530301045694
Energy: 1.210647259860057
Energy: 1.1346927204597126
Energy: 1.039414928464806
Energy: 1.1401891639615287
Energy: 1.1342239939935137
Energy: 1.136148163360647
Energy: 1.173298965834306
Energy: 1.1346480266759655
Energy: 1.1783523703887573
Energy: 0.9504653402506532
Energy: 1.1343353581386788
Energy: 1.1792861190637367

minimum gb energy = 0.942092822819552 eV
minimum distance =  2.37815421826025 Angstroms
sigma value = 11


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

Energy: 1.7800069096892996
Energy: 1.5331253019121622
Energy: 1.2861086491519533
Energy: 1.3648717804305315
Energy: 1.4187621889349142
Energy: 1.40181928220984
Energy: 1.4420640098265247
Energy: 1.1202192633684542
Energy: 1.1207157141498998
Energy: 1.2074459917668878
Energy: 1.120632020950576
Energy: 1.1224623253550572
Energy: 1.3485175326856313
Energy: 1.1929833701451682
Energy: 1.1921381251882317
Energy: 1.3505290003787365
Energy: 1.1922229602576515
Energy: 1.1956779310344963
Energy: 1.2047781297792444
Energy: 1.123909638175985
Energy: 1.1511687996633768
Energy: 1.2048419384636626
Energy: 1.1649474677030076
Energy: 1.1586655263238503
Energy: 1.204446420410842
Energy: 1.1210289781671559
Energy: 1.121068554364597
Energy: 1.2050772561721397
Energy: 1.1230811992340406
Energy: 1.1214061915506826
Energy: 1.2209523715718438
Energy: 1.1346768470770143
Energy: 1.1358064926267069
Energy: 1.1269123933913303
Energy: 1.1345760669928622
Energy: 1.135444858909074
Energy: 1.1347864659864182
Energy: 1.1443736379489797
Energy: 1.1357932480696915
Energy: 1.1348461916824768
Energy: 1.2101888985483862
Energy: 1.1355408277223347
Energy: 1.134873240971916
Energy: 1.211579216856254
Energy: 1.1210926138350217
Energy: 1.1210327974072172
Energy: 1.2051383275567105
Energy: 1.1214115375213107
Energy: 1.110857672174717
Energy: 1.2060685549050323
Energy: 1.1961822051688176
Energy: 1.1806444737445887
Energy: 1.2072971087559867
Energy: 1.1908686648091522
Energy: 1.12980200158483
Energy: 1.2516455760098448
Energy: 1.1975521105279885
Energy: 1.1810553920829687
Energy: 1.3602418002552406
Energy: 1.1908918526697225
Energy: 1.1343904359884451
Energy: 1.1576897976896332
Energy: 1.1221507741499164
Energy: 1.124426566693988
Energy: 1.1561652771623603
Energy: 1.1208794503419153
Energy: 1.125287272209819
Energy: 1.187533555139107
Energy: 1.2255522983780602
Energy: 1.1264226743112091
Energy: 1.189323940573786
Energy: 1.2826734950675562
Energy: 1.1204472688147549
Energy: 1.2045087287148109
Energy: 1.2044863776283476
Energy: 1.1204129738446555
Energy: 1.2088019288937326
Energy: 1.121618343370105
Energy: 1.1825164243010786
Energy: 1.353316022264463
Energy: 1.2389515584624147
Energy: 1.1736601709548529
Energy: 1.350756522116024
Energy: 1.25185331455399
Energy: 1.098045491516214
Energy: 1.2050048461610474
Energy: 1.218014606040475
Energy: 1.0983923781424438
Energy: 1.2066668513907692
Energy: 1.0974728625499581
Energy: 1.098239409224299
Energy: 1.2000425440997384
Energy: 1.0979643944632624
Energy: 1.10017691269853
Energy: 1.2147679775644207
Energy: 1.0973758306447754
Energy: 1.0972633959451474
Energy: 1.2229510363291118
Energy: 1.193262575322259
Energy: 1.0972226274752397
Energy: 1.2002780532715296
Energy: 1.0978711677317403
Energy: 1.4136259465353394
Energy: 1.231826324053663
Energy: 1.232438618656276
Energy: 1.180459049617493
Energy: 1.2351831977637464
Energy: 1.1659240293091213
Energy: 1.1582038088090623
Energy: 1.157873336161108
Energy: 1.1576822005636085
Energy: 1.1582926910805345
Energy: 1.1605595636864696
Energy: 1.1582225754776916
Energy: 1.2041392274243086
Energy: 1.1892674003339054
Energy: 1.189584444029791
Energy: 1.2061744354677688
Energy: 1.188251621645253
Energy: 1.190137762114387
Energy: 1.2331421087390826
Energy: 1.186415430192711
Energy: 1.1901318559870493
Energy: 1.2177839236094326
Energy: 1.1682626571678638
Energy: 1.172327357664014
Energy: 1.1502572054877023
Energy: 1.1576902686442145
Energy: 1.173706721364247
Energy: 1.117680426035481
Energy: 1.1590157951876243
Energy: 1.1746372792703712
Energy: 1.183566538888091
Energy: 1.1732818571520665
Energy: 1.2306228557992114
Energy: 1.1931146082420974
Energy: 1.157586378537143
Energy: 1.2303337774959187
Energy: 1.2548214073953157
Energy: 1.159223546576643
Energy: 1.180967739724505
Energy: 1.1619159109813606
Energy: 1.1592596400420345
Energy: 1.157913467948624
Energy: 1.2301961683582991
Energy: 1.1735948487152432
Energy: 1.1543993228816896
Energy: 1.2321565159535701
Energy: 1.1426714442886152
Energy: 1.2237155314737864
Energy: 1.2567152027616337
Energy: 1.0992605802979887
Energy: 1.0971233181542972
Energy: 1.2002722448952243
Energy: 1.0975529173583742
Energy: 1.1830840268863367
Energy: 1.246863278557162
Energy: 1.0978324846603535
Energy: 1.0973954764148004
Energy: 1.2420180063079518
Energy: 1.100794673167255
Energy: 1.0975692278936442
Energy: 1.2389667670826578
Energy: 1.0986355119535254
Energy: 1.2721867563535247
Energy: 1.2059071467475853
Energy: 1.098235073984633
Energy: 1.216611329281701
Energy: 1.3488554905851187
Energy: 1.1864084770640804
Energy: 1.1985649585802713
Energy: 1.3495133200615592
Energy: 1.1312871422578707
Energy: 1.2788544386792355
Energy: 1.449365838009854
Energy: 1.120765559528386
Energy: 1.1211349431631912
Energy: 1.2077597300907894
Energy: 1.1207191927736553
Energy: 1.204595030330336
Energy: 1.2370553607314712
Energy: 1.1259258312878282
Energy: 1.2474536563339236
Energy: 1.1889663202998948
Energy: 1.1275017260279079
Energy: 1.1738132254178038

minimum gb energy = 1.0971233181542972 eV
minimum distance =  2.34570990324223 Angstroms
sigma value = 57


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

Energy: 1.5815200677746126
Energy: 1.5276353086096304
Energy: 1.3084100926036784
Energy: 1.3093826291031199
Energy: 1.7118114576089989
Energy: 1.3087273837439213
Energy: 1.288420985440848
Energy: 1.1222630604692179
Energy: 1.1317828642228112
Energy: 1.1365206394629022
Energy: 1.1208968054374717
Energy: 1.107043767952581
Energy: 1.2061341563186425
Energy: 1.2444471333394245
Energy: 1.1843819941390354
Energy: 1.2076046747839768
Energy: 1.246006471290056
Energy: 1.1952870991686448
Energy: 1.1202229596314253
Energy: 1.131737545918924
Energy: 1.106135358364232
Energy: 1.1217306106520861
Energy: 1.1135336652049146
Energy: 1.1060151176627218
Energy: 1.1208854999248776
Energy: 1.123898431960234
Energy: 1.1263134468884428
Energy: 1.1201884375532587
Energy: 1.2048139955724602
Energy: 1.1080964218439624
Energy: 1.1195352787380615
Energy: 1.205009517656686
Energy: 1.2064459240825844
Energy: 1.1254375617856198
Energy: 1.2046796741312116
Energy: 1.1966032910907556
Energy: 1.2074560559513987
Energy: 1.1646073030604551
Energy: 1.1790916403854197
Energy: 1.2092718936213265
Energy: 1.163356260798337
Energy: 1.2054995349793411
Energy: 1.2879328000913985
Energy: 1.1250073279179182
Energy: 1.1095222678280448
Energy: 1.1238368990130565
Energy: 1.1372989636690058
Energy: 1.1064957809648819
Energy: 1.0728347042281097
Energy: 1.203701666657324
Energy: 1.303243322541218
Energy: 1.073537849961481
Energy: 1.197240115362773
Energy: 1.2294628918118489
Energy: 1.0727197977683758
Energy: 1.2047967760332154
Energy: 1.3042761278929578
Energy: 1.0904110581165742
Energy: 1.203689358612802
Energy: 1.1524879119930158
Energy: 1.2886620679357577
Energy: 1.1222665064426376
Energy: 1.1088312033608163
Energy: 1.1237096860174693
Energy: 1.1380554112106733
Energy: 1.1061796802493062
Energy: 1.1965028472070607
Energy: 1.2548643127069155
Energy: 1.2527960491542718
Energy: 1.197900216183142
Energy: 1.2558623643974762
Energy: 1.1951123054357686
Energy: 1.1189737192451343
Energy: 1.1224964139735056
Energy: 1.1242626040099213
Energy: 1.1198076518328592
Energy: 1.1188064552963732
Energy: 1.1232105555028264
Energy: 1.1200618431118707
Energy: 1.2039903984624793
Energy: 1.2048897648456818
Energy: 1.195879637557284
Energy: 1.2067918087884624
Energy: 1.1956369508467064
Energy: 1.1375961589223746
Energy: 1.1561870682499586
Energy: 1.1316136706613904
Energy: 1.1188459962557311
Energy: 1.1496516523560851
Energy: 1.1090592051202073
Energy: 1.2067176248309321
Energy: 1.15632334490005
Energy: 1.1315190748112127
Energy: 1.2100718176423833
Energy: 1.1503748933049138
Energy: 1.1950186207219302
Energy: 1.0728157091721433
Energy: 1.1229517562056393
Energy: 1.1292016478098532
Energy: 1.0733040477319327
Energy: 1.1200522559643158
Energy: 1.16889300271407

minimum gb energy = 1.0727197977683758 eV
minimum distance =  2.35776879744441 Angstroms
sigma value = 9


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

Energy: 1.9094099464745278
Energy: 1.3060605186838112
Energy: 1.3387657813814056
Energy: 1.3396926403458675
Energy: 1.262782314037915
Energy: 1.3357053691338208
Energy: 1.3279125337921245
Energy: 1.21779198996908
Energy: 1.2379949005485638
Energy: 1.2671889932157943
Energy: 1.2163272475923799
Energy: 1.2301002231045455
Energy: 1.3245557619176112
Energy: 1.2405621410132814
Energy: 1.2429271256953718
Energy: 1.3259787843000976
Energy: 1.2304000565371394
Energy: 1.2753606776676725
Energy: 1.2307108807256317
Energy: 1.2144852294103878
Energy: 1.2181918624223809
Energy: 1.2310683985685973
Energy: 1.214037932363471
Energy: 1.2149910876970547
Energy: 1.2365447404000134
Energy: 1.2019565209873913
Energy: 1.1777647390070998
Energy: 1.240337331909198
Energy: 1.2308165301603005
Energy: 1.178734648210464
Energy: 1.209407995983742
Energy: 1.2195084574142678
Energy: 1.2158566034986984
Energy: 1.2111880265561843
Energy: 1.2160063017302394
Energy: 1.2152016520484465
Energy: 1.2474074330894527
Energy: 1.2200351939461873
Energy: 1.3507082776456854
Energy: 1.2481836026674862
Energy: 1.2098834802321594
Energy: 1.3499553247558322
Energy: 1.2299397627857451
Energy: 1.212268352392449
Energy: 1.2191953014311994
Energy: 1.229893242152213
Energy: 1.2138100169828838
Energy: 1.2202027109601388
Energy: 1.4228713137344668
Energy: 1.2397719342936222
Energy: 1.234387521497361
Energy: 1.240781706517388
Energy: 1.2588723366639334
Energy: 1.2366736866470405
Energy: 1.236170707061061
Energy: 1.2045651913837565
Energy: 1.1968876654848777
Energy: 1.2390648347745798
Energy: 1.200704014696851
Energy: 1.1824189754563508
Energy: 1.2302541693992974
Energy: 1.245022557987268
Energy: 1.182802724560864
Energy: 1.2309526839949185
Energy: 1.2486449775436184
Energy: 1.1825760830002814
Energy: 1.2300951582293878
Energy: 1.240055772683174
Energy: 1.2462561618692578
Energy: 1.2171913833336874
Energy: 1.2336067013472785
Energy: 1.2140816658400757
Energy: 1.452957504116028
Energy: 1.295081336850947
Energy: 1.2413204970831564
Energy: 1.208605170707471
Energy: 1.290733482235787
Energy: 1.2110560107018262
Energy: 1.2470403690447653
Energy: 1.2317827907154733
Energy: 1.214279974627357
Energy: 1.2303352245237247
Energy: 1.2209065087556175
Energy: 1.216272775213801
Energy: 1.2411382956234551
Energy: 1.241220989180484
Energy: 1.2335033122542722
Energy: 1.2425032478316267
Energy: 1.2456090224988556
Energy: 1.2029802882910143
Energy: 1.230835289625266
Energy: 1.2260001614753704
Energy: 1.2493336116107967
Energy: 1.2315075667231141
Energy: 1.2244240661118744
Energy: 1.2492405091546495
Energy: 1.2247880044971182
Energy: 1.2147996260509741
Energy: 1.2341233946888162
Energy: 1.2273867093313513
Energy: 1.1845676335150785
Energy: 1.249816941410755
Energy: 1.34507655767356
Energy: 1.2921533251469397
Energy: 1.180891431606802
Energy: 1.2311671055965872
Energy: 1.2896401227636944
Energy: 1.2161470680197202
Energy: 1.2875367105641526
Energy: 1.2141443364474838
Energy: 1.2178298545949717
Energy: 1.2877093084960847
Energy: 1.2641523910734302
Energy: 1.2158942398014334
Energy: 1.216616937170205
Energy: 1.2439555853413475
Energy: 1.2168540009541764
Energy: 1.217262209687001
Energy: 1.2421562096231586
Energy: 1.2162902033674656
Energy: 1.2119023618055202
Energy: 1.2164288093388076
Energy: 1.24166928144022
Energy: 1.2130819075224633
Energy: 1.2216789597376139
Energy: 1.214630171898159

minimum gb energy = 1.1777647390070998 eV
minimum distance =  2.32984291761887 Angstroms
sigma value = 27


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

Energy: 1.7097151175651442
Energy: 1.750559960655478
Energy: 1.2733881748029092
Energy: 1.1972149175636833
Energy: 1.744038501960708
Energy: 1.2774981588086816
Energy: 1.296370352027307
Energy: 1.2234092722295702
Energy: 1.2329228245711732
Energy: 1.2157600945577494
Energy: 1.2243038857772632
Energy: 1.2119599965356838
Energy: 1.186613912397016
Energy: 1.2025580635057342
Energy: 1.2021741963930557
Energy: 1.187590286552533
Energy: 1.1699501439087898
Energy: 1.242747222918083
Energy: 1.2015360158592712
Energy: 1.1864879119360892
Energy: 1.2061633647227947
Energy: 1.2026283752751399
Energy: 1.1761883579874561
Energy: 1.220280501519168
Energy: 1.176416298485168
Energy: 1.2177136016693917
Energy: 1.2204144216423873
Energy: 1.1780794501603251
Energy: 1.215217962465481
Energy: 1.1880067914805517
Energy: 1.1898751775512568
Energy: 1.202012937490945
Energy: 1.2148653864709409
Energy: 1.1912940196429453
Energy: 1.2140577414973412
Energy: 1.2143327023089558
Energy: 1.2252713395043233
Energy: 1.2105691417600628
Energy: 1.2125164116166782
Energy: 1.2260415180783975
Energy: 1.2256872655021365
Energy: 1.2375689103703644
Energy: 1.253627795546334
Energy: 1.2298384529906115
Energy: 1.237896746740499
Energy: 1.2551220646113173
Energy: 1.2271907507239246
Energy: 1.2380152971650316
Energy: 1.2444539396817538
Energy: 1.2123898395626087
Energy: 1.2041821997752284
Energy: 1.1905743121641372
Energy: 1.207919919734016
Energy: 1.2158527412387166
Energy: 1.2467680448159217
Energy: 1.2095456072840813
Energy: 1.2113206558641934
Energy: 1.1826813726148175
Energy: 1.2041329009264132
Energy: 1.219956401179156
Energy: 1.2499306533204455
Energy: 1.220613133682873
Energy: 1.2291926849512307
Energy: 1.2514568065487361
Energy: 1.171016543647866
Energy: 1.230330488986933
Energy: 1.237218152134126
Energy: 1.2197443447373342
Energy: 1.232238166222952
Energy: 1.2369708811395244
Energy: 1.195910351905735
Energy: 1.240482465038006
Energy: 1.286201681648585
Energy: 1.2168537820078311
Energy: 1.2202661933191377
Energy: 1.2298448383304899
Energy: 1.2651428026424711
Energy: 1.2234948384893398
Energy: 1.2882806321133367
Energy: 1.226671984907066
Energy: 1.2369324383186624
Energy: 1.232420177751064
Energy: 1.224739861553196
Energy: 1.230168108729109
Energy: 1.2245695205263716
Energy: 1.2265416395227957
Energy: 1.2220939922758414
Energy: 1.2260406505347983
Energy: 1.2002060228091194
Energy: 1.2105295177152824
Energy: 1.209637401120766
Energy: 1.213849244765609
Energy: 1.212127325972396
Energy: 1.210139986389292
Energy: 1.2145213144692877
Energy: 1.2102304425981174
Energy: 1.1856466453296113
Energy: 1.2629300814953766
Energy: 1.2252132530407946
Energy: 1.1713320870343487
Energy: 1.2649240901053183
Energy: 1.226132960557757
Energy: 1.2100000462392861
Energy: 1.2226322775139782
Energy: 1.2074196847475982
Energy: 1.211456815920916
Energy: 1.2186826583223234
Energy: 1.1896778885454933
Energy: 1.207654639760854
Energy: 1.2101387860854473
Energy: 1.2123642710062512
Energy: 1.2084811875462307
Energy: 1.2278550119996563
Energy: 1.2129327206900464
Energy: 1.232800421555841
Energy: 1.2332233631410114
Energy: 1.2122273313700223
Energy: 1.2342209410668643
Energy: 1.2048148226561666
Energy: 1.21128569858583
Energy: 1.387046814892252
Energy: 1.2166564416810897
Energy: 1.183240062635763
Energy: 1.206281568733444
Energy: 1.2166122308437308
Energy: 1.1813912817760204
Energy: 1.167298689432197
Energy: 1.2384857541724852
Energy: 1.2433169707138607
Energy: 1.1681289974511089
Energy: 1.2349741929235984
Energy: 1.185801465349644
Energy: 1.2307464594256436
Energy: 1.1955858948153837
Energy: 1.2748056761538489
Energy: 1.2318459365242937
Energy: 1.1958005388376909
Energy: 1.2344959096739376
Energy: 1.193807725165253
Energy: 1.192603910343186
Energy: 1.2036476540591534
Energy: 1.1952331548954171
Energy: 1.1835496703550936
Energy: 1.2108936668918138
Energy: 1.2810664969343306
Energy: 1.2206298428253892
Energy: 1.2257481580104195
Energy: 1.183282075391527
Energy: 1.2143951724066575
Energy: 1.240293241265231

minimum gb energy = 1.167298689432197 eV
minimum distance =  2.31064104961643 Angstroms
sigma value = 19


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

Energy: 1.8260039887186645
Energy: 1.1626815030120075
Energy: 1.2042535444770464
Energy: 1.187115217925802
Energy: 1.1925941955544221
Energy: 1.1883672313272982
Energy: 1.361896851430741
Energy: 1.2095122311881554
Energy: 1.2034990732124957
Energy: 1.2180884226215634
Energy: 1.2096021607669394
Energy: 1.1886018636130309
Energy: 1.236933074550744
Energy: 1.1909578904525575
Energy: 1.203437984372206
Energy: 1.2298494361440406
Energy: 1.1729812989010333
Energy: 1.192454755064139
Energy: 1.2442641462760378
Energy: 1.1909588206836008
Energy: 1.197152425036912
Energy: 1.2100566560860648
Energy: 1.2087816898979806
Energy: 1.203308701401358
Energy: 1.1708164069189182
Energy: 1.2295336979597715
Energy: 1.2158670292914688
Energy: 1.176989378288984
Energy: 1.2292743524460816
Energy: 1.1987524540898193
Energy: 1.2676029879163135
Energy: 1.2262362474701303
Energy: 1.2612631410119572
Energy: 1.2685782519643813
Energy: 1.2136777771126062
Energy: 1.260686812079268
Energy: 1.1730068765546358
Energy: 1.1465303422641886
Energy: 1.2059305713831696
Energy: 1.1744263003881301
Energy: 1.1475585467117315
Energy: 1.2070470735768364
Energy: 1.2476491665950975
Energy: 1.1890414482385163
Energy: 1.234878066501218
Energy: 1.2491535558244162
Energy: 1.1791063424919637
Energy: 1.24743971543796
Energy: 1.1523420188668831
Energy: 1.2076130177754536
Energy: 1.2039258739384238
Energy: 1.1539751089260182
Energy: 1.2245437639747574
Energy: 1.1940672732245565
Energy: 1.1523646482973864
Energy: 1.2286094981511053
Energy: 1.2063040792042463
Energy: 1.1728224035275445
Energy: 1.2450964818132146
Energy: 1.2047422480647134
Energy: 1.2886759080170327
Energy: 1.178953329513928
Energy: 1.1773246162028355
Energy: 1.2901681438345627
Energy: 1.1790009369440364
Energy: 1.2000540048551476
Energy: 1.2435539445058013
Energy: 1.1513170234772296
Energy: 1.1785547421892184
Energy: 1.2439909398994107
Energy: 1.1710705859077515
Energy: 1.1718940979675372
Energy: 1.2133739433120172
Energy: 1.1857172446939654
Energy: 1.2091146691632817
Energy: 1.149375275001621
Energy: 1.1824561344089388
Energy: 1.209465173450481
Energy: 1.2768053828159998
Energy: 1.2130533988776506
Energy: 1.2158922035943205
Energy: 1.1898821154133161
Energy: 1.195751524818682
Energy: 1.2069848657048858
Energy: 1.208854192212449
Energy: 1.1372343476202884
Energy: 1.1649411985543443
Energy: 1.2087552884691126
Energy: 1.1277326847446423
Energy: 1.1815356325687532
Energy: 1.2078055358509785
Energy: 1.1480422121075728
Energy: 1.1820770169547268
Energy: 1.2087622563588682
Energy: 1.1298805934386014
Energy: 1.1896217005238778
Energy: 1.1737209993014117
Energy: 1.2284369677338292
Energy: 1.2129072323147592
Energy: 1.1325497337105317
Energy: 1.225832429844252
Energy: 1.2151957128955901
Energy: 1.234372146027763
Energy: 1.1934482139154312
Energy: 1.1804489709865287
Energy: 1.1574915653372495
Energy: 1.232150481773092
Energy: 1.1893577306507754
Energy: 1.2444726284774617
Energy: 1.1683998402160447
Energy: 1.1889378806708082
Energy: 1.2469829352150517
Energy: 1.195063074483912
Energy: 1.1756947516487024
Energy: 1.2194898159900456
Energy: 1.1926051576545549
Energy: 1.198028312648418
Energy: 1.220672720802406
Energy: 1.195046093878005
Energy: 1.2002316499614625
Energy: 1.126825734733257
Energy: 1.1586655880985675
Energy: 1.1922699023093688
Energy: 1.1272482993432271
Energy: 1.2096432672709483
Energy: 1.1818780278091348
Energy: 1.1482042634075915
Energy: 1.1492566524373564
Energy: 1.172158812453275
Energy: 1.148655521396923
Energy: 1.2014740419436882
Energy: 1.1786107312590959
Energy: 1.2202303086011352
Energy: 1.190360302117869
Energy: 1.2135582384673207
Energy: 1.2051809223479923
Energy: 1.1863271033728238
Energy: 1.1959018472107612
Energy: 1.2429878745977956
Energy: 1.1853320756535555
Energy: 1.1882616011932314
Energy: 1.2452961484757639
Energy: 1.2645981392395371
Energy: 1.1985383486860726
Energy: 1.2102815241112914
Energy: 1.1957367413908824
Energy: 1.1620415877081478
Energy: 1.17071046752902
Energy: 1.2403476475942472
Energy: 1.1745232086022075
Energy: 1.1765722769665419
Energy: 1.1999824323023447
Energy: 1.191171317173432
Energy: 1.1499603756091117
Energy: 1.2011904411932477
Energy: 1.2049558730974248
Energy: 1.2377918825184229
Energy: 1.1880285665090247
Energy: 1.202018605713676
Energy: 1.237171386581559
Energy: 1.1688308239678806
Energy: 1.2051444146112986
Energy: 1.2352051505736799
Energy: 1.175438001070847
Energy: 1.1924363842162575
Energy: 1.220797356061157
Energy: 1.167020842112913
Energy: 1.1973467723242543
Energy: 1.2323529493558898
Energy: 1.238469752347319
Energy: 1.2391763570368006
Energy: 1.1743002525409487
Energy: 1.238764085118296
Energy: 1.190042614918598

minimum gb energy = 1.126825734733257 eV
minimum distance =  2.35080225131505 Angstroms
sigma value = 101


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

Energy: 1.6636012942777219
Energy: 1.220632730870031
Energy: 1.1498103399277675
Energy: 1.1632985766187882
Energy: 1.2225027824858987
Energy: 1.1626848605322146
Energy: 1.3104659822945055
Energy: 1.1468514307334754
Energy: 1.1200413008048997
Energy: 1.272569560521398
Energy: 1.1726809311824111
Energy: 1.1216451013710564
Energy: 1.228784978988675
Energy: 1.158161420070877
Energy: 1.1807243677268546
Energy: 1.2100040923016668
Energy: 1.1101039116948084
Energy: 1.1931942578638453
Energy: 1.20406824193974
Energy: 1.1200594877790637
Energy: 1.1226954491488623
Energy: 1.1611481337379437
Energy: 1.169996270454881
Energy: 1.1228242747877877
Energy: 1.1196512733893098
Energy: 1.1963081091182826
Energy: 1.1899634529131657
Energy: 1.124698757599833
Energy: 1.2077044007562354
Energy: 1.1628819245946527
Energy: 1.1719867197938416
Energy: 1.2263281829492332
Energy: 1.1681900127166824
Energy: 1.172506192655688
Energy: 1.2745325170804354
Energy: 1.1215969537707253
Energy: 1.1962382843182051
Energy: 1.1484055770592836
Energy: 1.1705090004649532
Energy: 1.2303143059625243
Energy: 1.0968262543173781
Energy: 1.1873139564598874
Energy: 1.0985030348136693
Energy: 1.174180610213393
Energy: 1.1733095312789288
Energy: 1.0979163774822527
Energy: 1.2148229132105846
Energy: 1.1772471892118215
Energy: 1.100762317696666
Energy: 1.1652100829452812
Energy: 1.1203752966030474
Energy: 1.1025378030741786
Energy: 1.1942028815168688
Energy: 1.1199950787039246
Energy: 1.0967778877159982
Energy: 1.1196554620329846
Energy: 1.1220453367088898
Energy: 1.0977533628876208
Energy: 1.207153815239435
Energy: 1.1226416725454136
Energy: 1.2233671318026453
Energy: 1.1573697331048411
Energy: 1.1572514297239271
Energy: 1.2104805713959337
Energy: 1.1573849592495025
Energy: 1.1660798068353873
Energy: 1.2353339071428695
Energy: 1.1192042213910973
Energy: 1.1219963917927092
Energy: 1.1926309886675934
Energy: 1.2196020357961148
Energy: 1.1235530234156978
Energy: 1.1312651620432883
Energy: 1.2033945735585847
Energy: 1.171521669581866
Energy: 1.0963336231010448
Energy: 1.200559871403952
Energy: 1.1606151786719574
Energy: 1.1310909198653767
Energy: 1.1369343742152036
Energy: 1.1282709991586952
Energy: 1.131305364013088
Energy: 1.1387782951466061
Energy: 1.1276899191587708
Energy: 1.2264955528159982
Energy: 1.1225595334412835
Energy: 1.1185383025479227
Energy: 1.227120007241243
Energy: 1.117056267035399
Energy: 1.1191219203010285
Energy: 1.2263901748079409
Energy: 1.1242631559151448
Energy: 1.1193944282076937
Energy: 1.2006973666700549
Energy: 1.1323982714725798
Energy: 1.1220006984007478
Energy: 1.135029355433076
Energy: 1.298772806485357
Energy: 1.1833662994907441
Energy: 1.0627932873364314
Energy: 1.1961896878300422
Energy: 1.1548005658075216
Energy: 1.277292131575677
Energy: 1.164528085279567
Energy: 1.114193684743481
Energy: 1.279680084936602
Energy: 1.1456326791029852
Energy: 1.1491633139509299
Energy: 1.2281249376804055
Energy: 1.1197622581396451
Energy: 1.1212664916349926
Energy: 1.1972286163568624
Energy: 1.1186327569423633
Energy: 1.159935062845674
Energy: 1.2285149550270915
Energy: 1.121517017139286
Energy: 1.1212734514243254
Energy: 1.2325055284186228
Energy: 1.1186183752440075
Energy: 1.1201046485589878
Energy: 1.1242683110349327
Energy: 1.16372434154965
Energy: 1.179980899887999
Energy: 1.1254968519760047
Energy: 1.1908977868794035
Energy: 1.123784526443764
Energy: 1.1721434829757917
Energy: 1.1623153841314973
Energy: 1.11872199441076
Energy: 1.1739201013678724
Energy: 1.200762770587775
Energy: 1.12370518771147
Energy: 1.1357857739522064
Energy: 1.095169847474891
Energy: 1.095294348595725
Energy: 1.136153220345279
Energy: 1.09480383274817
Energy: 1.1540518834582552
Energy: 1.0975323619599788
Energy: 1.1606912870323067
Energy: 1.1262404625608295
Energy: 1.097844432299056
Energy: 1.0963115407951847
Energy: 1.186591236138557
Energy: 1.096387676539731
Energy: 1.1618195032506071
Energy: 1.1220003508291183
Energy: 1.0968159760349074
Energy: 1.2002541686754786
Energy: 1.1237753130178352
Energy: 1.1001130297817932
Energy: 1.1205065031517385
Energy: 1.1215934483223697
Energy: 1.101710087819954
Energy: 1.192663186869952
Energy: 1.122119858322898
Energy: 1.2201175239925535
Energy: 1.0663784551293432
Energy: 1.0661013343197037
Energy: 1.221183905922082
Energy: 1.0736887225591059
Energy: 1.1388699207096216
Energy: 1.2321649580362373
Energy: 1.0683164645549186
Energy: 1.069969488071622
Energy: 1.2341151735077844
Energy: 1.0674079937102725
Energy: 1.1219685838698474
Energy: 1.1312662660110209
Energy: 1.1767557537616822
Energy: 1.1624832031800238
Energy: 1.092730077462087
Energy: 1.1964836105142636
Energy: 1.1267816479424733
Energy: 1.1336997177229289
Energy: 1.1809468620447676
Energy: 1.1941805858833558
Energy: 1.0932258730867705
Energy: 1.1828616157611944
Energy: 1.1197033606356146
Energy: 1.2321052404257171
Energy: 1.1146964869750102
Energy: 1.1191053154434123
Energy: 1.228758173889736
Energy: 1.112116541842771
Energy: 1.1220276749825646
Energy: 1.2266734268036947
Energy: 1.1203424564822686
Energy: 1.1229438066242965
Energy: 1.2013288591765736
Energy: 1.0984964281671432
Energy: 1.1215275835039182
Energy: 1.1362345506350242
Energy: 1.101297003509085
Energy: 1.109378702357477
Energy: 1.068185251377342
Energy: 1.0995379042089322
Energy: 1.2318016092159196

minimum gb energy = 1.0627932873364314 eV
minimum distance =  2.34796214139806 Angstroms
sigma value = 33


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

Energy: 0.0204452277408999
Energy: 0.918716424604032
Energy: 0.02149486798819976
Energy: 0.023409225548267885
Energy: 0.9225819943376335
Energy: 0.021018207539864782
Energy: 0.7316519707001155
Energy: 0.15110049285995222
Energy: 0.15050680248375642
Energy: 0.14954581005071893
Energy: 0.14975165136140192
Energy: 0.1500734742029668
Energy: 1.51421633851783
Energy: 0.9217914799961191
Energy: 0.9191598283639965
Energy: 0.9166277442985891
Energy: 0.9211590974883122
Energy: 0.9187731173858938
Energy: 0.02215645872321747
Energy: 0.15110049286088645
Energy: 0.1505068024832893
Energy: 0.14954581004983658
Energy: 0.1497516513604677
Energy: 0.15007347420115022

minimum gb energy = 0.0204452277408999 eV
minimum distance =  2.46223133822402 Angstroms
sigma value = 1