Model name: model_name=EAM_Dynamo_AcklandVitek_1990_Cu__MO_642748370624_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.615000702440739
cohesive_energy=3.5182750832796934
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.028240113638618e-19, 1.82494327319136e-19, 2.37373683563538e-19, 2.822234140791e-19, 3.2109542357320795e-19, 3.55710449750778e-19, 3.86577984781422e-19, 4.1270467915205993e-19, 4.352633261587799e-19, 4.5539467556499e-19, 4.7345120623017e-19, 4.8946015515709795e-19, 5.035112442372779e-19, 5.15723034541626e-19, 5.26225302377496e-19, 5.351494262288759e-19, 5.42618773696584e-19, 5.487503036749019e-19, 5.53660975058112e-19, 5.574709510937639e-19, 5.60284373263068e-19, 5.62198974340698e-19, 5.63294863158354e-19, 5.636457398411999e-19, 5.6319713038368e-19, 5.614523600292539e-19, 5.577561385346159e-19, 5.5180885886920795e-19, 5.43836427938424e-19, 5.34160883245698e-19, 5.231939841859679e-19, 5.11405168512996e-19, 4.98839297172534e-19, 4.8519516095739e-19, 4.700946461819399e-19, 4.53066712915788e-19, 4.3352656668752394e-19, 4.10745217128678e-19, 3.8378699308499396e-19, 3.50618732407926e-19, 3.08518336996308e-19, 2.57174984583144e-19, 1.96894690905528e-19, 1.262761922793636e-19, 4.213676482120979e-20, -6.41724613745922e-20, -2.0289324022322398e-19, -3.6783091598698797e-19, -5.685243676917299e-19, -8.3774772056255395e-19, -1.2402433302027658e-18, -1.8455472647046e-18, -3.70445668253676e-18, -1.269122564030616e-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: 0.013568464013648408
Energy: 0.013770138341284195
Energy: 0.7617584719735387
Energy: 0.1051421500897725
Energy: 0.013770138341911412
Energy: 1.0792622224941637
Energy: 0.1051421500897725
Energy: 1.0792622247677872
Energy: 0.7617584719729464
Energy: 0.10514215008914529
Energy: 0.013568464013648408
Energy: 0.013770138341284195
Energy: 0.1051421500897725
Energy: 1.079262224644574
Energy: 0.013770138341284195
Energy: 1.079262222187037

minimum gb energy = 0.013568464013648408 eV
minimum distance =  2.47335725143403 Angstroms
sigma value = 1


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

Energy: 1.4156389646439358
Energy: 0.9334619128938166
Energy: 0.9702663662486012
Energy: 0.9691355655538514
Energy: 0.9968244870147861
Energy: 1.0226049432781794
Energy: 0.9756849501582026
Energy: 1.022604943277419
Energy: 0.9689245198027125
Energy: 0.9698251102798767
Energy: 0.9980856189010882
Energy: 0.9698251102798767
Energy: 1.0011976260630877
Energy: 0.9426598946121699
Energy: 0.9563941374464107
Energy: 0.9426598946121699
Energy: 1.0013331404668386
Energy: 0.9429061690416543
Energy: 0.9435317133455594
Energy: 0.9429061690408935
Energy: 0.9877104162237579
Energy: 0.9876940760335075
Energy: 0.9568800735512599
Energy: 0.9876940760327467
Energy: 0.9802297716611834
Energy: 1.033100449166457
Energy: 1.001494321005233
Energy: 1.033100449165731
Energy: 0.989720116905478
Energy: 0.9882706065246261
Energy: 0.998798065814776
Energy: 0.9882706065253867
Energy: 0.9971450586490099
Energy: 1.1129461091176378
Energy: 0.9984726442118065
Energy: 1.1129461091161166
Energy: 1.0027174969606811
Energy: 1.0752933900356254
Energy: 0.9958359791535226
Energy: 1.075293390034865
Energy: 0.998984058315324
Energy: 1.1128033383564353
Energy: 0.9989996915398247
Energy: 1.1128033383564353
Energy: 0.9992624666178943
Energy: 1.1139478680056316
Energy: 0.9989042042779852
Energy: 1.1139478680041104
Energy: 0.9843642681589599
Energy: 1.033369673891251
Energy: 0.9989140761483245
Energy: 1.0333696738942937
Energy: 0.9882421242271062
Energy: 1.0331430988198713
Energy: 0.9890945300180022
Energy: 1.0331430988191106
Energy: 0.9984569932311506
Energy: 0.9426089360730977
Energy: 0.9434417821073732
Energy: 0.9426089360723371
Energy: 0.9624945351270472
Energy: 0.9427647115945106
Energy: 0.9569851559074819
Energy: 0.9427647115960319
Energy: 0.9699784430211027
Energy: 0.9691389358933651
Energy: 0.9938766636879435
Energy: 0.9691389358941257
Energy: 0.9770936778679271
Energy: 0.9566098525050164
Energy: 0.9979504535596027
Energy: 0.9566098525050164
Energy: 0.9986610373645127
Energy: 0.9698401991458079
Energy: 0.9701928106096619
Energy: 0.9698401991458079
Energy: 1.0009255741629817
Energy: 0.956423034158892
Energy: 0.9706282712772856
Energy: 0.956423034158892
Energy: 0.9428957373801151
Energy: 0.9435104846380421
Energy: 1.001514472024367
Energy: 0.9435104846365207
Energy: 0.9568647300299851
Energy: 0.9439409080452967
Energy: 0.9879461510469649
Energy: 0.9439409080468181
Energy: 1.0015372318688551
Energy: 1.0328495878093167
Energy: 0.9791868917591298
Energy: 1.0328495878077952
Energy: 0.9981513398030046
Energy: 1.0326522367022541
Energy: 0.9884249170874799
Energy: 1.0326522367007327
Energy: 0.9983173671662983
Energy: 1.113503691172408
Energy: 0.9969511065348783
Energy: 1.1135036911708867
Energy: 0.9985968744149798
Energy: 1.1122988019224374
Energy: 1.0025102459761963
Energy: 1.1122988019231976
Energy: 0.9985383958886358
Energy: 1.1132932531024935
Energy: 0.9991707758198155
Energy: 1.1132932531024935
Energy: 1.0002342028377722
Energy: 1.11321379288563
Energy: 0.9992749888792679
Energy: 1.11321379288563
Energy: 0.9988292888051507
Energy: 1.0332746901265848
Energy: 1.0078729546420948
Energy: 1.0332746901265848
Energy: 0.9891635105677481
Energy: 1.0341241934417782
Energy: 0.9897539061080731
Energy: 1.0341241934417782
Energy: 0.9427228230263025
Energy: 0.9425674022605514
Energy: 0.9986415962710642
Energy: 0.9425674022590299
Energy: 0.9568569212586973
Energy: 0.9425184937343491
Energy: 0.9928964351221459
Energy: 0.9425184937335885
Energy: 0.9927382277178426
Energy: 0.9717322064737254
Energy: 0.9725259485406964
Energy: 0.9717322064729648

minimum gb energy = 0.9334619128938166 eV
minimum distance =  2.24534931568986 Angstroms
sigma value = 1


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

Energy: 1.193387763757288
Energy: 0.9728643822577382
Energy: 1.016157194170482
Energy: 1.014375420714813
Energy: 1.0502123397143752
Energy: 1.0701920808853038
Energy: 1.0237110861373155
Energy: 1.0701920808818346
Energy: 1.0141098936098951
Energy: 1.0144359243789773
Energy: 1.0532972012598987
Energy: 1.01443592437811
Energy: 1.0147288275547652
Energy: 0.9865828240473338
Energy: 1.003274575098712
Energy: 0.9865828240473338
Energy: 1.0531796854983968
Energy: 0.9870033187489822
Energy: 0.9874440691158829
Energy: 0.9870033187481149
Energy: 1.0421480985921676
Energy: 0.9879578820585063
Energy: 1.0033825958200426
Energy: 0.987957882057639
Energy: 1.0350363489007102
Energy: 1.0951237966521326
Energy: 1.0541435993669221
Energy: 1.0951237966556018
Energy: 1.0460776615926732
Energy: 1.1114969452365069
Energy: 1.0557339329687436
Energy: 1.1114969452434451
Energy: 1.0552535438256136
Energy: 1.1730673309211737
Energy: 1.048809764983985
Energy: 1.1730673309211737
Energy: 1.0543528273962592
Energy: 1.1355464235704391
Energy: 1.0567236779040154
Energy: 1.135546423567837
Energy: 1.0547198886714992
Energy: 1.0953973050862902
Energy: 1.0347593385997564
Energy: 1.0953973050836883
Energy: 1.0442765539317225
Energy: 1.0970103713548724
Energy: 1.041953772284998
Energy: 1.0970103713557398
Energy: 0.9879619277769176
Energy: 0.9868045510874979
Energy: 1.0539069373321268
Energy: 0.9868045510883652
Energy: 0.9866558126460261
Energy: 0.9869738602844343
Energy: 1.0085109182374463
Energy: 0.9869738602844343
Energy: 1.0468286176091137
Energy: 1.01441581092346
Energy: 1.0150417347147354
Energy: 1.014415810920858
Energy: 1.0507085907953344
Energy: 1.002204987130566
Energy: 1.023516257967815
Energy: 1.0022049871340355
Energy: 1.0153417960634579
Energy: 1.0143034627196237
Energy: 1.0537275416400083
Energy: 1.0143034627187566
Energy: 1.0155273394550244
Energy: 1.002913884380531
Energy: 1.053176412868918
Energy: 1.002913884380531
Energy: 1.0531648880667506
Energy: 0.9864124085863437
Energy: 0.9869285208505628
Energy: 0.9864124085837419
Energy: 1.042931150084674
Energy: 0.9865688640917287
Energy: 1.0035721076752033
Energy: 0.9865688640891267
Energy: 1.034446241688116
Energy: 1.0952535871492388
Energy: 1.0534607461194117
Energy: 1.095253587147504
Energy: 1.042359307778012
Energy: 1.0953159642817567
Energy: 1.0543364365516423
Energy: 1.0953159642808894
Energy: 1.0553047024703792
Energy: 1.1743852931728498
Energy: 1.0489890010222411
Energy: 1.1743852931719827
Energy: 1.0550214394278172
Energy: 1.1733738272825018
Energy: 1.0565433806893618
Energy: 1.1733738272833691
Energy: 1.0546838920758304
Energy: 1.0955906122853099
Energy: 1.035322404333149
Energy: 1.0955906122827477
Energy: 1.044744900687001
Energy: 1.0962258728246832
Energy: 1.0423873842837412
Energy: 1.0962258728255505
Energy: 0.9871546385266771
Energy: 0.9867147442070091
Energy: 1.053921956572456
Energy: 0.9867147442078764
Energy: 1.0033021063735335
Energy: 0.9868150799560529
Energy: 1.0464781060608057
Energy: 0.9868150799638586
Energy: 1.0467091912785844
Energy: 1.0170867832936188
Energy: 1.0182625463368566
Energy: 1.0170867832910169

minimum gb energy = 0.9728643822577382 eV
minimum distance =  2.24600426445193 Angstroms
sigma value = 25


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

Energy: 1.2379871191168257
Energy: 1.0137625443978644
Energy: 1.0629716103653903
Energy: 1.0625263460133654
Energy: 1.1127055632377478
Energy: 1.1205298245433561
Energy: 1.075834335253394
Energy: 1.1205298245443645
Energy: 1.06240879652649
Energy: 1.0623390368683685
Energy: 1.1046829707828278
Energy: 1.0623390368683685
Energy: 1.0631155630450975
Energy: 1.0366841514580492
Energy: 1.03745504250845
Energy: 1.0366841514590575
Energy: 1.112724869145381
Energy: 1.0363560511904588
Energy: 1.0364142089028427
Energy: 1.0363560511904588
Energy: 1.1078771332810813
Energy: 1.0372710644767487
Energy: 1.036603718133032
Energy: 1.0372710644767487
Energy: 1.1039562833142067
Energy: 1.1697122481579207
Energy: 1.0993839228711233
Energy: 1.1697122481579207
Energy: 1.1095842954227495
Energy: 1.1844454892938738
Energy: 1.1147335159126182
Energy: 1.1844454892938738
Energy: 1.1021345888245695
Energy: 1.1700728315585227
Energy: 1.1045771978748695
Energy: 1.1700728315575142
Energy: 1.109510703918005
Energy: 1.1718485573810893
Energy: 1.0899287345858253
Energy: 1.1718485573810893
Energy: 1.108396212836791
Energy: 1.0362029803701196
Energy: 1.036185287240501
Energy: 1.0362029803701196
Energy: 1.0590523133791543
Energy: 1.036324023408602
Energy: 1.036419534656311
Energy: 1.0363240234075939
Energy: 1.0619848021009848
Energy: 1.062552447504538
Energy: 1.1083023457160448
Energy: 1.06255244750353
Energy: 1.0760197856295828
Energy: 1.0554769653195228
Energy: 1.1127312775486622
Energy: 1.0554769653205311
Energy: 1.1039534954604824
Energy: 1.0622661026789553
Energy: 1.0632947210814117
Energy: 1.0622661026799634
Energy: 1.113748647985457
Energy: 1.0546996348504774
Energy: 1.0628419001848863
Energy: 1.0546996348504774
Energy: 1.0368356211996543
Energy: 1.0361872669181886
Energy: 1.1126696776218201
Energy: 1.0361872669181886
Energy: 1.0365164013707318
Energy: 1.0366595088767485
Energy: 1.1091062287279894
Energy: 1.0366595088767485
Energy: 1.0995117842708704
Energy: 1.1698756741780338
Energy: 1.110042254211313
Energy: 1.1698756741780338
Energy: 1.1165505467198138
Energy: 1.1704754086654097
Energy: 1.1085185829276996
Energy: 1.1704754086654097
Energy: 1.108454245690903
Energy: 1.1701197571877335
Energy: 1.1025669523526687
Energy: 1.1701197571867255
Energy: 1.1096429440245854
Energy: 1.1709685103425587
Energy: 1.1109356230596943
Energy: 1.1709685103425587
Energy: 1.0356371366993828
Energy: 1.0367490474035075
Energy: 1.1083828405827096
Energy: 1.0367490474035075
Energy: 1.0368595528680848
Energy: 1.0366020145857684
Energy: 1.0595321283684456
Energy: 1.0366020145867765
Energy: 1.0593642787423108
Energy: 1.0655572101657895
Energy: 1.0649791259292314
Energy: 1.0655572101657895

minimum gb energy = 1.0137625443978644 eV
minimum distance =  2.2419886229868 Angstroms
sigma value = 9


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

Energy: 1.4107437383303278
Energy: 1.055702463513339
Energy: 1.1129600605995014
Energy: 1.1124421717409771
Energy: 1.185527004919993
Energy: 1.1734646457922207
Energy: 1.1120083370970448
Energy: 1.1734646457934232
Energy: 1.1129320483426308
Energy: 1.1124468051569905
Energy: 1.1124648993124913
Energy: 1.1124468051605987
Energy: 1.1123450985678582
Energy: 1.1463494345413767
Energy: 1.0962134830917636
Energy: 1.1463494345401741
Energy: 1.1034131128594795
Energy: 1.0959008067658051
Energy: 1.115681689563822
Energy: 1.0959008067658051
Energy: 1.1186294275804676
Energy: 1.0957120945869727
Energy: 1.0962569108991782
Energy: 1.0957120945893781
Energy: 1.139931849058147
Energy: 1.2350983743034314
Energy: 1.107104827789152
Energy: 1.2350983743058366
Energy: 1.1183664829813134
Energy: 1.2366199573142627
Energy: 1.1822810752703685
Energy: 1.2366199573154657
Energy: 1.0955898615162087
Energy: 1.095404651706242
Energy: 1.0448174771073688
Energy: 1.095404651706242
Energy: 1.095967497835493
Energy: 1.0959529707154687
Energy: 1.0567638723640265
Energy: 1.0959529707154687
Energy: 1.0447480636752333
Energy: 1.1124197082780198
Energy: 1.1126099333670023
Energy: 1.1124197082780198
Energy: 1.1856410309224905
Energy: 1.118113756202509
Energy: 1.1120662178076475
Energy: 1.118113756202509
Energy: 1.1121895351190207
Energy: 1.1122928028855659
Energy: 1.1123504033700047
Energy: 1.1122928028855659
Energy: 1.1130054567922008
Energy: 1.1185864743679905
Energy: 1.1131604659209469
Energy: 1.1185864743668152
Energy: 1.1026442730301114
Energy: 1.095656169468987
Energy: 1.0956208027054404
Energy: 1.095656169468987
Energy: 1.1555357841528917
Energy: 1.096080663558217
Energy: 1.0964827195846583
Energy: 1.0960806635606226
Energy: 1.1766402792558357
Energy: 1.2339724608960652
Energy: 1.1071323713551031
Energy: 1.2339724608972678
Energy: 1.1779120841856503
Energy: 1.234929128992812
Energy: 1.1785115403247348
Energy: 1.234929128992812
Energy: 1.0945616273570895
Energy: 1.0955984049609426
Energy: 1.0445423072441566
Energy: 1.0955984049597398
Energy: 1.0952639173756504
Energy: 1.095385505514922
Energy: 1.044750340467524
Energy: 1.0953855055161246
Energy: 1.056624949785031
Energy: 1.1144420053672632
Energy: 1.115072634857934
Energy: 1.1144420053696686

minimum gb energy = 1.0445423072441566 eV
minimum distance =  2.23794394181057 Angstroms
sigma value = 25


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

Energy: 1.2490455628244341
Energy: 1.0905994108546946
Energy: 1.166013497002734
Energy: 1.164767672400715
Energy: 1.1609958084861176
Energy: 1.1743255951822384
Energy: 1.1653399598457626
Energy: 1.1743255951822384
Energy: 1.1652873687695768
Energy: 1.1644826485402497
Energy: 1.2587337748828153
Energy: 1.1644826485402497
Energy: 1.1654959919045131
Energy: 1.1739218559790077
Energy: 1.111661867363215
Energy: 1.1739218559804951
Energy: 1.1640589129006091
Energy: 1.1690479669667206
Energy: 1.11187845222917
Energy: 1.1690479669682081
Energy: 1.0838616027109034
Energy: 1.167712059237765
Energy: 1.1115241497754975
Energy: 1.1677120592392523
Energy: 1.272446881599446
Energy: 1.1705423976691105
Energy: 1.1679201093422042
Energy: 1.1705423976691105
Energy: 1.0776866961729703
Energy: 1.174463760383491
Energy: 1.1126053222694647
Energy: 1.1744637603820038
Energy: 1.16491384182452
Energy: 1.164129689941229
Energy: 1.2420065246808354
Energy: 1.164129689941229
Energy: 1.165086847140191
Energy: 1.0837346468746298
Energy: 1.1597780772277069
Energy: 1.0837346468731421
Energy: 1.2597725928059518
Energy: 1.1644759845402104
Energy: 1.1641207350533866
Energy: 1.1644759845402104
Energy: 1.1663505184513507
Energy: 1.0841693711078955
Energy: 1.165235819485088
Energy: 1.0841693711078955
Energy: 1.1127517063007304
Energy: 1.2456055732799258
Energy: 1.1641207808085177
Energy: 1.2456055732799258
Energy: 1.1121537438328992
Energy: 1.1684939191464245
Energy: 1.086643218812277
Energy: 1.1684939191464245
Energy: 1.1664781074616861
Energy: 1.1691461060613075
Energy: 1.0774975180259716
Energy: 1.1691461060598203
Energy: 1.1125986343356242
Energy: 1.2420357110868185
Energy: 1.0778772119778357
Energy: 1.242035711085331
Energy: 1.2401526956507676
Energy: 1.1662023584570786
Energy: 1.1660846105963805
Energy: 1.1662023584570786

minimum gb energy = 1.0774975180259716 eV
minimum distance =  2.22910345260025 Angstroms
sigma value = 17


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

Energy: 1.665382958100349
Energy: 1.1924912836583992
Energy: 1.2392021330934098
Energy: 1.2385124644979706
Energy: 1.1598808871938586
Energy: 1.143575394149346
Energy: 1.2582149261845004
Energy: 1.143575394149346
Energy: 1.1434620488733116
Energy: 1.1434477175864093
Energy: 1.2397023469699346
Energy: 1.1434477175855668
Energy: 1.1425203192563134
Energy: 1.1436927177103122
Energy: 1.1424788967489976
Energy: 1.1436927177094698
Energy: 1.209327104942506
Energy: 1.2594679044761987
Energy: 1.1932302001841673
Energy: 1.2594679044761987
Energy: 1.1428704878717457
Energy: 1.2592506397352268
Energy: 1.1424171572032586
Energy: 1.2592506397352268
Energy: 1.1851327747986005
Energy: 1.143018860564255
Energy: 1.1432038531909114
Energy: 1.1430188605634124
Energy: 1.2896734414880002
Energy: 1.1435375865572577
Energy: 1.1426500918756817
Energy: 1.1435375865564152
Energy: 1.241321758166573
Energy: 1.2385394934419676
Energy: 1.2518730771572084
Energy: 1.2385394934419676
Energy: 1.2494868710752445
Energy: 1.1840083635750953
Energy: 1.1976451647485407
Energy: 1.1840083635767804
Energy: 1.2065625869503462
Energy: 1.1488318314069788
Energy: 1.1246772144286927
Energy: 1.1488318314069788
Energy: 1.1850417913469495
Energy: 1.149507441211816
Energy: 1.1497335145758496
Energy: 1.1495074412101693
Energy: 1.1821421264386238
Energy: 1.148800525703522
Energy: 1.147031248047063
Energy: 1.1488005257026799
Energy: 1.1822206869892629
Energy: 1.1444008929070226
Energy: 1.124746020913643
Energy: 1.1444008929070226
Energy: 1.2403728777393122
Energy: 1.2398433001996467
Energy: 1.289389520102325
Energy: 1.239843300197962
Energy: 1.2376295159018507
Energy: 1.2385601468748464
Energy: 1.2916504310173857
Energy: 1.2385601468731617
Energy: 1.2401236741639288
Energy: 1.1435555782355864
Energy: 1.1426113818870645
Energy: 1.1435555782347442
Energy: 1.2397324412441257
Energy: 1.1436597056603972
Energy: 1.141911974916251
Energy: 1.1436597056595548
Energy: 1.1427817294374965
Energy: 1.2556999294279223
Energy: 1.2083750795898045
Energy: 1.2556999294279223
Energy: 1.1922233130700852
Energy: 1.2587951742155836
Energy: 1.1426889523827222
Energy: 1.2587951742164258
Energy: 1.1437371876075284
Energy: 1.142718070482767
Energy: 1.182447571950553
Energy: 1.142718070482767
Energy: 1.1431663698310217
Energy: 1.1445551209781775
Energy: 1.390167512140595
Energy: 1.1445551209789815
Energy: 1.2023139535489353
Energy: 1.1837559137411429
Energy: 1.237155932362588
Energy: 1.1837559137403004
Energy: 1.2416301469114275
Energy: 1.2386683007182218
Energy: 1.2370540760316657
Energy: 1.2386683007199064
Energy: 1.1500600122933842
Energy: 1.1480340078743434
Energy: 1.2489371799412554
Energy: 1.148034007873501
Energy: 1.1497084323192035
Energy: 1.1489764745480324
Energy: 1.2077243988952784
Energy: 1.14897647454719
Energy: 1.1240358139686766
Energy: 1.1490641497012979
Energy: 1.1850654059039587
Energy: 1.1490641497012979
Energy: 1.1490741007055973
Energy: 1.1490163740083204
Energy: 1.182136122135532
Energy: 1.1490163740074781
Energy: 1.1482726743526765
Energy: 1.1485221479160703
Energy: 1.1825615688098636
Energy: 1.1485221479160703
Energy: 1.2927533691979025
Energy: 1.237668040675453
Energy: 1.2376788681443098
Energy: 1.237668040675453

minimum gb energy = 1.1240358139686766 eV
minimum distance =  2.2136465304576 Angstroms
sigma value = 53


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

Energy: 1.5149913054412614
Energy: 1.0557737675879435
Energy: 1.1705636537204942
Energy: 1.1719636946973617
Energy: 1.2898115321571906
Energy: 1.1252398889092752
Energy: 1.1691537027670063
Energy: 1.1252398889092752
Energy: 1.170017085481502
Energy: 1.1705475826544152
Energy: 1.2721421262209949
Energy: 1.1705475826544152
Energy: 1.169397293751237
Energy: 1.1234497858023211
Energy: 1.1686288008796637
Energy: 1.1234497858023211
Energy: 1.169556027570064
Energy: 1.1230256307653852
Energy: 1.0350684808852484
Energy: 1.123025630763446
Energy: 1.1715583900001127
Energy: 1.1258440020061635
Energy: 1.0356954318763711
Energy: 1.1258440020081029
Energy: 1.2818784747694898
Energy: 1.1688810012503588
Energy: 1.1687344667292785
Energy: 1.1688810012522983
Energy: 1.2828986308801813
Energy: 1.1730437255558774
Energy: 1.1729453957752851
Energy: 1.1730437255558774
Energy: 1.171116017443037
Energy: 1.169831186967659
Energy: 1.2734539518235874
Energy: 1.1698311869657194
Energy: 1.1685300027879
Energy: 1.1711500007473936
Energy: 1.1688916711845816
Energy: 1.171150000749333
Energy: 1.1705115743077978
Energy: 1.1253863880431587
Energy: 1.0568758452431268
Energy: 1.1253863880470376
Energy: 1.1701730636084893
Energy: 1.122716977694203
Energy: 1.0349407391790044
Energy: 1.1227169776883852
Energy: 1.2826639210709492
Energy: 1.1740644897528556
Energy: 1.1724886821982963
Energy: 1.1740644897489771

minimum gb energy = 1.0349407391790044 eV
minimum distance =  2.24976471550301 Angstroms
sigma value = 9


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

Energy: 1.4664633860100482
Energy: 1.2383354143816228
Energy: 1.2916460502332334
Energy: 1.2893044295661122
Energy: 1.127136958120879
Energy: 1.1303313606050587
Energy: 1.2971383822765337
Energy: 1.1303313606064942
Energy: 1.1310519748093457
Energy: 1.1313559378321985
Energy: 1.3253512993829373
Energy: 1.1313559378321985
Energy: 1.1306576058672146
Energy: 1.130732109716563
Energy: 1.3173953178450297
Energy: 1.1307321097172804
Energy: 1.1301034111993573
Energy: 1.1298619890118655
Energy: 1.3499875159698291
Energy: 1.129861989009712
Energy: 1.1457650323815123
Energy: 1.1298551084150545
Energy: 1.3497251150484615
Energy: 1.129855108415772
Energy: 1.2904030521026706
Energy: 1.2867485100610254
Energy: 1.2974367693273279
Energy: 1.286748510062461
Energy: 1.2915082843152248
Energy: 1.2860850924194065
Energy: 1.2859543836613379
Energy: 1.2860850924186886
Energy: 1.180045707091579
Energy: 1.261754837464766
Energy: 1.207244309430675
Energy: 1.2617548374669194
Energy: 1.125202967851573
Energy: 1.2060939743635257
Energy: 1.2893238026310272
Energy: 1.206093974365679
Energy: 1.1774163785495064
Energy: 1.177234462845393
Energy: 1.2241499307484578
Energy: 1.1772344628468285
Energy: 1.1778956890175731
Energy: 1.256091575324889
Energy: 1.3509866981849705
Energy: 1.2560915753241713
Energy: 1.2944591123040532
Energy: 1.1775543408784512
Energy: 1.1877968085702058
Energy: 1.1775543408777334
Energy: 1.2938102627818115
Energy: 1.178458449159034
Energy: 1.1798078500560383
Energy: 1.1784584491583163
Energy: 1.2851402822654485
Energy: 1.2082420774676514
Energy: 1.185812179403662
Energy: 1.2082420774698046
Energy: 1.286689031439226
Energy: 1.261434962389841
Energy: 1.187248634165632
Energy: 1.2614349623905585
Energy: 1.2920792918882822
Energy: 1.2346766289001885
Energy: 1.1790070136033348
Energy: 1.2346766289030597
Energy: 1.2895792528610446
Energy: 1.287262224239156
Energy: 1.4669713032176952
Energy: 1.2872622242384384
Energy: 1.2970195438470813
Energy: 1.2342622176667861
Energy: 1.1264510875153118
Energy: 1.234262217664633
Energy: 1.3752700326292258
Energy: 1.1317737881611245
Energy: 1.1314050947104868
Energy: 1.1317737881611245
Energy: 1.2974041107679233
Energy: 1.130435780937185
Energy: 1.131291393296922
Energy: 1.1304357809378376
Energy: 1.3499229371216612
Energy: 1.1295877699671304
Energy: 1.1310797481929575
Energy: 1.1295877699671304
Energy: 1.3501068824858824
Energy: 1.1298390136315448
Energy: 1.1445324172174052
Energy: 1.129839013628674
Energy: 1.2995517398905825
Energy: 1.2864121495105905
Energy: 1.2904062280449506
Energy: 1.2864121495105905
Energy: 1.2859256436727395
Energy: 1.285769705939283
Energy: 1.2915379639707947
Energy: 1.285769705940001
Energy: 1.2066517205630205
Energy: 1.2617526805973887
Energy: 1.1790940293915595
Energy: 1.2617526805981065
Energy: 1.2885584510279395
Energy: 1.2060678783390557
Energy: 1.1245229899518707
Energy: 1.206067878336902
Energy: 1.2244806129849355
Energy: 1.1779495216991378
Energy: 1.1785623419304367
Energy: 1.1779495216998557
Energy: 1.351252765556296
Energy: 1.193830475725966
Energy: 1.177787003038418
Energy: 1.1938304757274016
Energy: 1.1888379905491913
Energy: 1.1776692268891695
Energy: 1.295790087700964
Energy: 1.177669226887734
Energy: 1.1786155691578781
Energy: 1.17839425897665
Energy: 1.3263816243729563
Energy: 1.1783942589795215
Energy: 1.178741377535585
Energy: 1.2086007556738794
Energy: 1.2861796502605514
Energy: 1.2086007556738794
Energy: 1.1889549594132027
Energy: 1.262017971878267
Energy: 1.2858521502327704
Energy: 1.2620179718797024
Energy: 1.1779300356572566
Energy: 1.258991869057191
Energy: 1.2221975746143225
Energy: 1.2589918690564736
Energy: 1.4682112896706976
Energy: 1.2865942115762339
Energy: 1.2881296455688045
Energy: 1.2865942115740803

minimum gb energy = 1.1245229899518707 eV
minimum distance =  2.22149749173306 Angstroms
sigma value = 73


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

Energy: 1.5368387876079812
Energy: 1.215308958465576
Energy: 1.248982432338715
Energy: 1.2485820474399394
Energy: 1.1558184766700161
Energy: 1.151896096228426
Energy: 1.24670962515398
Energy: 1.1518960962261482
Energy: 1.1528436722108317
Energy: 1.1522871185098404
Energy: 1.3306881883257888
Energy: 1.1522871185109793
Energy: 1.1529799738820488
Energy: 1.1658193728913868
Energy: 1.341399675772572
Energy: 1.1658193728936643
Energy: 1.1569328650576411
Energy: 1.1570122783388153
Energy: 1.3443259586540721
Energy: 1.1570122783376764
Energy: 1.217117966257352
Energy: 1.1571177543190585
Energy: 1.3542648980120169
Energy: 1.1571177543190585
Energy: 1.2753615808723353
Energy: 1.2742045961470858
Energy: 1.2958570646325278
Energy: 1.274204596145947
Energy: 1.236315294920298
Energy: 1.2729390873733706
Energy: 1.2723273375088533
Energy: 1.2729390873733706
Energy: 1.209180893135054
Energy: 1.335262065723782
Energy: 1.2738914046273457
Energy: 1.335262065722643
Energy: 1.1970771150630584
Energy: 1.3154451097400965
Energy: 1.2729735063962624
Energy: 1.3154451097400965
Energy: 1.2094096561384589
Energy: 1.1389301216522492
Energy: 1.1388460471281805
Energy: 1.1389301216522492
Energy: 1.2027142417825585
Energy: 1.1389346718961257
Energy: 1.3976519499430844
Energy: 1.1389346718995423
Energy: 1.2915921894043543
Energy: 1.23040391725056
Energy: 1.193731144155604
Energy: 1.23040391725056
Energy: 1.3092838713827455
Energy: 1.2038699787359746
Energy: 1.1952466109130198
Energy: 1.2038699787371134
Energy: 1.3091575186334856
Energy: 1.174406726812035
Energy: 1.1753877838869562
Energy: 1.1744067268108962
Energy: 1.3434564912831848
Energy: 1.1748731988270227
Energy: 1.1747300584135811
Energy: 1.1748731988270227
Energy: 1.3025291270680763
Energy: 1.1746367155856208
Energy: 1.1932047072617162
Energy: 1.1746367155856208
Energy: 1.275133571344208
Energy: 1.2760333841794316
Energy: 1.3474662034726865
Energy: 1.2760333841782927
Energy: 1.2566190370715986
Energy: 1.2558054441272055
Energy: 1.1978754063397654
Energy: 1.2558054441260667
Energy: 1.2812837816186027
Energy: 1.2430547031828854
Energy: 1.2583256390384192
Energy: 1.2430547031840242
Energy: 1.2559296534060609
Energy: 1.2842008418998392
Energy: 1.2033119309438745
Energy: 1.2842008419021167
Energy: 1.3601734244556962
Energy: 1.24873702100291
Energy: 1.2492990505376251
Energy: 1.24873702100291

minimum gb energy = 1.1388460471281805 eV
minimum distance =  2.22249297112011 Angstroms
sigma value = 7


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

Energy: 1.7399567427630827
Energy: 1.2002964148003508
Energy: 1.2736299049652149
Energy: 1.2734311234391864
Energy: 1.1438195001371578
Energy: 1.147781026343201
Energy: 1.3540348883757058
Energy: 1.1477810263480328
Energy: 1.170152464986721
Energy: 1.1491560903388047
Energy: 1.2460993367752833
Energy: 1.1491560903379996
Energy: 1.149074197627472
Energy: 1.1491955640367286
Energy: 1.270351485939122
Energy: 1.1491955640383393
Energy: 1.1625714622531762
Energy: 1.1616183301831395
Energy: 1.3322553962721195
Energy: 1.16161833018475
Energy: 1.1706800899036975
Energy: 1.1611137649486591
Energy: 1.330689870270921
Energy: 1.1611137649583223
Energy: 1.33475449788691
Energy: 1.1620793703096124
Energy: 1.1742734295307744
Energy: 1.1620793703096124
Energy: 1.321497373380206
Energy: 1.1609271186085657
Energy: 1.158892102793455
Energy: 1.1609271186109817
Energy: 1.3526277612053983
Energy: 1.1479641705236816
Energy: 1.146527645603164
Energy: 1.1479641705260974
Energy: 1.3404269085635385
Energy: 1.311226386856057
Energy: 1.1623211074615962
Energy: 1.3112263868584728
Energy: 1.269583874267737
Energy: 1.251071260205255
Energy: 1.2362356545379556
Energy: 1.2510712602044496
Energy: 1.252005948279534
Energy: 1.2527764630944154
Energy: 1.328469788957066
Energy: 1.2527764630919995
Energy: 1.2520525426592872
Energy: 1.2495014502022195
Energy: 1.2537407073304014
Energy: 1.2495014502062458
Energy: 1.2464600169542166
Energy: 1.2189198986648433
Energy: 1.1528482863689566
Energy: 1.2189198986632328
Energy: 1.2520603644334074
Energy: 1.2501533684557011
Energy: 1.175074016935033
Energy: 1.2501533684565065
Energy: 1.3233626520758877
Energy: 1.2524027316497326
Energy: 1.2509001448966008
Energy: 1.2524027316465118
Energy: 1.3865939731802184
Energy: 1.2504265146070517
Energy: 1.2697390572806508
Energy: 1.2504265146159095
Energy: 1.171841901023396
Energy: 1.3106280932632777
Energy: 1.2451553187156033
Energy: 1.3106280932616672
Energy: 1.1461485577325077
Energy: 1.1481254303736272
Energy: 1.3528735249945445
Energy: 1.1481254303720168
Energy: 1.1614378396817993
Energy: 1.1603670370329173
Energy: 1.3242011374278064
Energy: 1.1603670370329173
Energy: 1.1745458060078025
Energy: 1.1621619734856676
Energy: 1.335494587637364
Energy: 1.1621619734896942
Energy: 1.3254911848437405
Energy: 1.1608301236574174
Energy: 1.1712879439212813
Energy: 1.1608301236525858
Energy: 1.3287880777794883
Energy: 1.1618138288940105
Energy: 1.162381466000965
Energy: 1.1618138288899844
Energy: 1.2590925312436687
Energy: 1.1489258696668982
Energy: 1.1488909191000676
Energy: 1.1489258696660933
Energy: 1.3229135091055486
Energy: 1.1496349564859996
Energy: 1.1484658763143325
Energy: 1.1496349564787522
Energy: 1.3200869866181333
Energy: 1.2967567663201076
Energy: 1.1610906574822955
Energy: 1.296756766320913
Energy: 1.2526915316103742
Energy: 1.2510180508803854
Energy: 1.5377550249395482
Energy: 1.251018050882801
Energy: 1.2503022374856063
Energy: 1.251018575729862
Energy: 1.1646848800901035
Energy: 1.251018575729862
Energy: 1.2458822419951014
Energy: 1.2205726127987941
Energy: 1.2466255208137382
Energy: 1.2205726127939625
Energy: 1.2492429292041383
Energy: 1.249847726090499
Energy: 1.152687172414069
Energy: 1.2498477260977465
Energy: 1.3281239783149943
Energy: 1.2511828254152038
Energy: 1.2517665920013368
Energy: 1.2511828254224513

minimum gb energy = 1.1438195001371578 eV
minimum distance =  2.22411962144102 Angstroms
sigma value = 29


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

Energy: 1.0587581772366885
Energy: 1.059105058417763
Energy: 1.2023902114680671
Energy: 1.2506118670366893
Energy: 1.1379887119309702
Energy: 1.1122198320587504
Energy: 1.1172530989552114
Energy: 1.112219832058189
Energy: 1.119280301741214
Energy: 1.1601175964466497
Energy: 1.0626841743541282
Energy: 1.1601175964469304
Energy: 1.0603199824281206
Energy: 1.0989485120134894
Energy: 1.1198545108838112
Energy: 1.09894851201405
Energy: 1.1082127841638698
Energy: 1.1002436959113109
Energy: 1.0611032424155153
Energy: 1.1002436959118718
Energy: 1.1066966831352354
Energy: 1.1589480719420326
Energy: 1.0609296557258467
Energy: 1.1589480719417522
Energy: 1.0628101918524029
Energy: 1.160492339186239
Energy: 1.1193005574709174
Energy: 1.1604923391859585
Energy: 1.116902609739471
Energy: 1.1181146322579154
Energy: 1.060298184876285
Energy: 1.1181146322579154
Energy: 1.1384577472634925
Energy: 1.102190540593167
Energy: 1.1145428283460206
Energy: 1.1021905405948187

minimum gb energy = 1.0587581772366885 eV
minimum distance =  2.16997103164494 Angstroms
sigma value = 5


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

Energy: 1.3877051539448126
Energy: 1.0514443700231149
Energy: 1.2051780158314709
Energy: 1.2031453035071629
Energy: 1.0678034649990698
Energy: 1.0723029090907612
Energy: 1.2186375463676824
Energy: 1.072302909091522
Energy: 1.2178120081956934
Energy: 1.149873605846412
Energy: 1.2402001086863859
Energy: 1.149873605846412
Energy: 1.0860994468382945
Energy: 1.067857864482071
Energy: 1.2407523601902741
Energy: 1.067857864483558
Energy: 1.069795689819321
Energy: 1.068730952651794
Energy: 1.2366543731645796
Energy: 1.0687309526525546
Energy: 1.1030666924342254
Energy: 1.102322737330288
Energy: 1.2334162122378043
Energy: 1.1023227373310487
Energy: 1.0702288566672407
Energy: 1.0683697212387757
Energy: 1.2396740069894616
Energy: 1.0683697212395362
Energy: 1.0704374104077157
Energy: 1.0720675611832886
Energy: 1.3912935581702743
Energy: 1.0720675611825277
Energy: 1.116769750028247
Energy: 1.1141464872952231
Energy: 1.3768119982000824
Energy: 1.1141464872952231
Energy: 1.2347766837086602
Energy: 1.057140788092656
Energy: 1.0597164441034792
Energy: 1.0571407880911348
Energy: 1.119868832919044
Energy: 1.0541467753493063
Energy: 1.054537378760308
Energy: 1.0541467753493063
Energy: 1.3752530381254229
Energy: 1.0531664060195363
Energy: 1.0527387905244663
Energy: 1.0531664060202968
Energy: 1.3885628093071871
Energy: 1.0532535907369351
Energy: 1.0528316515163283
Energy: 1.0532535907354137
Energy: 1.0859543550113626
Energy: 1.1105207291138384
Energy: 1.2374812640315722
Energy: 1.1105207291138384
Energy: 1.0694444857843821
Energy: 1.0693357633610607
Energy: 1.2350225294849553
Energy: 1.0693357633618215
Energy: 1.0703100408411308
Energy: 1.0707306163979682
Energy: 1.0700009326856785
Energy: 1.0707306163972075
Energy: 1.068914899999546
Energy: 1.0700835213384026
Energy: 1.0814069729531486
Energy: 1.070083521339163
Energy: 1.217639514456677
Energy: 1.0746861441716549
Energy: 1.050893661938792
Energy: 1.0746861441701336
Energy: 1.2397191213489425
Energy: 1.0682649968529432
Energy: 1.2174024413239888
Energy: 1.0682649968529432
Energy: 1.2407787407931288
Energy: 1.0676648481868434
Energy: 1.0828451311971194
Energy: 1.067664848185322
Energy: 1.2334208386370291
Energy: 1.1031729251841689
Energy: 1.2402314834246435
Energy: 1.1031729251841689
Energy: 1.237980853086609
Energy: 1.0684765788331156
Energy: 1.0685403512551128
Energy: 1.0684765788331156
Energy: 1.240738626174243
Energy: 1.0686269665333246
Energy: 1.0680396481742545
Energy: 1.0686269665363672
Energy: 1.3215698012571224
Energy: 1.07151607589766
Energy: 1.0701785938514814
Energy: 1.07151607589766
Energy: 1.3759828941192613
Energy: 1.112060041224929
Energy: 1.1201297626807272
Energy: 1.11206004122569
Energy: 1.071412181962789
Energy: 1.058359075595495
Energy: 1.2346259392713967
Energy: 1.0583590755985375
Energy: 1.0578556835751503
Energy: 1.0559694069643024
Energy: 1.116681294996312
Energy: 1.0559694069635417
Energy: 1.0528559780932536
Energy: 1.053804956207449
Energy: 1.0830556130853926
Energy: 1.053804956207449
Energy: 1.0554423702034812
Energy: 1.055225996842448
Energy: 1.3877421474787162
Energy: 1.0552259968432087
Energy: 1.2347054203252983
Energy: 1.1104921298516708
Energy: 1.1203672234073974
Energy: 1.1104921298524315
Energy: 1.2350748620330143
Energy: 1.0701151324146412
Energy: 1.0725149844639894
Energy: 1.0701151324146412
Energy: 1.0709051457010914
Energy: 1.069376229956541
Energy: 1.0717865531975004
Energy: 1.0693762299580625
Energy: 1.0832235296907557
Energy: 1.0692780245482667
Energy: 1.0674976878416382
Energy: 1.0692780245505487

minimum gb energy = 1.050893661938792 eV
minimum distance =  2.14124301300663 Angstroms
sigma value = 1


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

Energy: 1.4662584766606537
Energy: 1.0038076437445052
Energy: 1.1740409611576526
Energy: 1.174109728046145
Energy: 1.0380738711415634
Energy: 1.0333153204547614
Energy: 1.2322184814098285
Energy: 1.0333153204589682
Energy: 1.2311063425743054
Energy: 1.1352073587446165
Energy: 1.2328763784252723
Energy: 1.1352073587456686
Energy: 1.039075684172687
Energy: 1.026111307315014
Energy: 1.026739458934692
Energy: 1.0261113073171177
Energy: 1.0264963189782206
Energy: 1.0254789057601288
Energy: 1.2238053469892634
Energy: 1.02547890575487
Energy: 1.0248732261331592
Energy: 1.025898480650794
Energy: 1.2238696931963113
Energy: 1.0258984806497424
Energy: 1.024754148674046
Energy: 1.0241506290496507
Energy: 1.028062441758215
Energy: 1.0241506290454436
Energy: 1.0259282265469603
Energy: 1.0368369610184156
Energy: 1.3862543509206258
Energy: 1.0368369610173636
Energy: 1.2320108162922698
Energy: 1.095516003418868
Energy: 1.3864464708750406
Energy: 1.095516003414661
Energy: 1.2499250192723448
Energy: 1.036023983708218
Energy: 1.0360097662595957
Energy: 1.0360239837050866
Energy: 1.0356627073277818
Energy: 1.027204802830187
Energy: 1.0254156697176195
Energy: 1.0272048028312388
Energy: 1.381864091972686
Energy: 1.0266086774300665
Energy: 1.0259220189700522
Energy: 1.0266086774290148
Energy: 1.4587079981025357
Energy: 1.0270635328654356
Energy: 1.0252126257185135
Energy: 1.0270635328654356
Energy: 1.02619236373476
Energy: 1.0253115203749357
Energy: 1.2317309823980374
Energy: 1.0253115203759875
Energy: 1.038382768439957
Energy: 1.1340421903522924
Energy: 1.232090378776038
Energy: 1.1340421903533442
Energy: 1.0386662016137833
Energy: 1.1349075710136798
Energy: 1.0280561104006436
Energy: 1.1349075710115761
Energy: 1.0258486408138012
Energy: 1.027576497005797
Energy: 1.249417582137573
Energy: 1.0275764970089525
Energy: 1.0368429639247783
Energy: 1.0346190358749001
Energy: 1.2263434331402296
Energy: 1.0346190358791072
Energy: 1.0252206746721673
Energy: 1.0249529866758509
Energy: 1.3864216340704274
Energy: 1.0249529866769027
Energy: 1.0342136996774682
Energy: 1.0911682886372451
Energy: 1.3869294386331954
Energy: 1.0911682886361933
Energy: 1.223861054776662
Energy: 1.0262166112668305
Energy: 1.0282215549417253
Energy: 1.026216611267882
Energy: 1.2511272828169777
Energy: 1.0292115865929636
Energy: 1.027223951208981
Energy: 1.0292115865940152
Energy: 1.0276360653661263
Energy: 1.0251449970767788
Energy: 1.0256070229238836
Energy: 1.0251449970788822
Energy: 1.4588024345725248
Energy: 1.0278281686722068
Energy: 1.0259167184157552
Energy: 1.0278281686753623

minimum gb energy = 1.0038076437445052 eV
minimum distance =  2.14995876242425 Angstroms
sigma value = 17


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

Energy: 1.5531714859040793
Energy: 0.995691586882584
Energy: 1.174582410816932
Energy: 1.1749469825105556
Energy: 1.0185138132250917
Energy: 1.0102508936748038
Energy: 1.1380645779735956
Energy: 1.010250893675454
Energy: 1.2771522386850442
Energy: 1.007844056645979
Energy: 1.1511958261041242
Energy: 1.0078440566453288
Energy: 1.2774312110097559
Energy: 1.0653498955603535
Energy: 1.1290906784616281
Energy: 1.0653498955597034
Energy: 1.1192394267853962
Energy: 0.9971804683166012
Energy: 1.1519684946739601
Energy: 0.9971804683172512
Energy: 0.997738347065602
Energy: 0.9966463297970246
Energy: 1.2936127626201543
Energy: 0.9966463297976746
Energy: 0.9982881514979578
Energy: 0.9966838277415543
Energy: 1.0775250334245279
Energy: 0.9966838277402543
Energy: 1.000295028722937
Energy: 0.9984828966790942
Energy: 1.541346956963821
Energy: 0.9984828966836448
Energy: 1.2899728353487567
Energy: 0.9963750245239437
Energy: 1.275917278501026
Energy: 0.9963750245226435
Energy: 1.1468988045400115
Energy: 1.0688206318788271
Energy: 1.1396996437815503
Energy: 1.068820631878177
Energy: 1.121765321418866
Energy: 1.007884605328109
Energy: 1.0166230610493778
Energy: 1.0078846053261588
Energy: 1.3049893365324308
Energy: 1.0316503368509897
Energy: 1.1554663409951518
Energy: 1.0316503368522898
Energy: 1.1526009549747989
Energy: 1.010170665703103
Energy: 1.0096183699640329
Energy: 1.0101706657037532
Energy: 1.0077805715923165
Energy: 1.0084338519117395
Energy: 1.0106198540596716
Energy: 1.0084338519097895
Energy: 1.2779940857103915
Energy: 1.0102281166577727
Energy: 1.0136761604136777
Energy: 1.0102281166577727
Energy: 1.3346149689530133
Energy: 1.0083288423565036
Energy: 1.0118964820514025
Energy: 1.0083288423565036
Energy: 1.0338866562282623
Energy: 1.013014087107818
Energy: 1.4114162134367743
Energy: 1.013014087110418
Energy: 1.008144911014479
Energy: 1.0079105618856827
Energy: 1.2910724904956803
Energy: 1.0079105618863329
Energy: 1.0318370138104511
Energy: 1.0126788517837908
Energy: 1.2742928558884483
Energy: 1.012678851785032
Energy: 1.0090636721025859
Energy: 1.0076319937172753
Energy: 1.5413205149547184
Energy: 1.0076319937172753
Energy: 1.1526489418847923
Energy: 1.0098590947389074
Energy: 1.0334715076025127
Energy: 1.0098590947415074
Energy: 1.1548243754313787
Energy: 1.0078360102843809
Energy: 1.277837257697254
Energy: 1.0078360102863313
Energy: 1.129964198021852
Energy: 1.0627090273229003
Energy: 1.2887342294258324
Energy: 1.0627090273229003
Energy: 1.407692215268538
Energy: 0.9986938273779762
Energy: 1.1193671712451407
Energy: 0.9986938273773263
Energy: 1.3067880527478872
Energy: 0.9957808102941434
Energy: 0.9962683873857943
Energy: 0.9957808102973937
Energy: 1.1555691287094976
Energy: 0.9983587472004071
Energy: 0.9978536948585699
Energy: 0.9983587472017074
Energy: 0.9949489919095454
Energy: 1.0000764049023536
Energy: 1.0077174715770683
Energy: 1.0000764049023536
Energy: 1.2414391444404764
Energy: 1.0616687867991417
Energy: 1.287596353368843
Energy: 1.0616687867965413
Energy: 1.13684479440854
Energy: 1.065076535442319
Energy: 1.1478353878841159
Energy: 1.0650765354410188
Energy: 1.0180405831695112
Energy: 1.0074363130955908
Energy: 1.1205279445494087
Energy: 1.0074363130955908
Energy: 1.1296454450417432
Energy: 1.0080624996846965
Energy: 1.3134019417581775
Energy: 1.0080624996879468
Energy: 1.0078509927372346
Energy: 1.0084517091385534
Energy: 1.3056106577345432
Energy: 1.0084517091385534
Energy: 1.008142761052736
Energy: 1.0075121013848214
Energy: 1.0096465212854036
Energy: 1.0075121013861217
Energy: 1.0077315671795821
Energy: 1.010998258056522
Energy: 1.276095787504788
Energy: 1.010998258056522
Energy: 1.123072987264987
Energy: 1.0076757814791069
Energy: 1.3257201694585168
Energy: 1.0076757814778068
Energy: 1.4156610034386572
Energy: 1.017719152539976
Energy: 1.0449839564371313
Energy: 1.0177191525419262
Energy: 1.1227305615265126
Energy: 1.0094258265377007
Energy: 1.0102144579301706
Energy: 1.009425826540301
Energy: 1.2753939800246061
Energy: 1.0318378747388774
Energy: 1.0086762059134446
Energy: 1.031837874736277

minimum gb energy = 0.9949489919095454 eV
minimum distance =  2.18270227537995 Angstroms
sigma value = 89


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

Energy: 1.6420187623001354
Energy: 0.9137145041736928
Energy: 0.9238396716522606
Energy: 1.1100271779530182
Energy: 0.9121402516336138
Energy: 1.0323219692772307
Energy: 0.9216457693393301
Energy: 1.0323219692772307
Energy: 0.9125593719527838
Energy: 1.0313168849347032
Energy: 0.9501873531099997
Energy: 1.0313168849347032
Energy: 0.9132864569092556
Energy: 1.0120500775295695
Energy: 0.9221820699169317
Energy: 1.0120500775278687
Energy: 0.9220802334745984
Energy: 0.9386220756921094
Energy: 0.9348117993481404
Energy: 0.9386220756904085
Energy: 0.9230654213450709
Energy: 0.922830768570338
Energy: 0.9359660116297362
Energy: 0.922830768570338
Energy: 0.9215554815942056
Energy: 0.9229563216233658
Energy: 0.9233162636966215
Energy: 0.9229563216233658
Energy: 0.9227949355478355
Energy: 0.9229064904063096
Energy: 0.9121458291039949
Energy: 0.9229064904046087
Energy: 0.9228006062284463
Energy: 0.9213085098457162
Energy: 0.9122715976453222
Energy: 0.9213085098474173
Energy: 0.9217488161562639
Energy: 1.012433913590729
Energy: 0.9239274755072923
Energy: 1.0124339135890281
Energy: 0.9233283518261077
Energy: 1.010245964045894
Energy: 0.9115619382686803
Energy: 1.010245964045894
Energy: 0.9353691584976881
Energy: 0.9221606843389907
Energy: 0.9222108074245975
Energy: 0.9221606843389907
Energy: 0.9348071026858514
Energy: 0.9234785054126293
Energy: 0.9224428042909154
Energy: 0.9234785054126293
Energy: 0.9229422404485383
Energy: 0.9205333870629676
Energy: 0.9207992914866033
Energy: 0.9205333870629676
Energy: 0.911852151942146
Energy: 0.9240065542904007
Energy: 0.9220906117614956
Energy: 0.9240065542904007

minimum gb energy = 0.9115619382686803 eV
minimum distance =  2.19357185299399 Angstroms
sigma value = 13


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

Energy: 1.450432796536282
Energy: 0.8716381235471615
Energy: 1.0864512436268434
Energy: 0.878205702779791
Energy: 0.8781863702833992
Energy: 0.8784264051165684
Energy: 1.0135266133784284
Energy: 0.8784264051194202
Energy: 0.8785237997987507
Energy: 0.8748719936882525
Energy: 1.0213643872096014
Energy: 0.8748719936932429
Energy: 1.1507407838282964
Energy: 0.8745972929939716
Energy: 1.0161175353653218
Energy: 0.8745972929825647
Energy: 1.011333379377599
Energy: 0.8787017013259933
Energy: 1.281642631952793
Energy: 0.8787017013196418
Energy: 1.0171943138771435
Energy: 0.8767696400901704
Energy: 1.2914179940381234
Energy: 0.8767696400901704
Energy: 1.0179077487973391
Energy: 0.8750532098735203
Energy: 1.191767767727914
Energy: 0.8750532098906303
Energy: 0.8824332674797958
Energy: 0.8754209938967343
Energy: 1.0115058827349612
Energy: 0.8754209939031506
Energy: 0.8744013144029456
Energy: 0.8859498244752487
Energy: 1.0143798398417287
Energy: 0.8859498244795262
Energy: 0.87453049935889
Energy: 0.8742911206998956
Energy: 1.019614322002238
Energy: 0.8742911206991825
Energy: 0.8770499368676766
Energy: 0.8758245669222585
Energy: 1.4516160410781676
Energy: 0.8758245669229714
Energy: 1.0227478413061828
Energy: 0.9302629456646497
Energy: 1.0191962169032909
Energy: 0.9302629456689271
Energy: 1.296211981088043
Energy: 0.9275120997480478
Energy: 1.011806793495044
Energy: 0.9275120997451962
Energy: 1.0180038844651964
Energy: 0.9241842653425393
Energy: 1.1526725737284447
Energy: 0.9241842653439651
Energy: 1.0138405121367107
Energy: 0.8803072435488917
Energy: 1.1923178217483394
Energy: 0.880307243554595
Energy: 1.0130668986836495
Energy: 0.8772214518393007
Energy: 0.8790743810909739
Energy: 0.8772214518357362
Energy: 1.019175886344163
Energy: 0.875531885120797
Energy: 0.8764778019335533
Energy: 0.8755318851186584
Energy: 1.436796831470419
Energy: 0.8752819259638647
Energy: 0.8775268360175769
Energy: 0.8752819259724197
Energy: 1.1403170720358826
Energy: 0.8745013013492912
Energy: 1.0112551561753123
Energy: 0.8745013013535685
Energy: 1.0188398598996906
Energy: 0.8739153822061427
Energy: 1.0172272229139905
Energy: 0.8739153822146978
Energy: 1.148637237487452
Energy: 0.8748702518935336
Energy: 1.0130380565387844
Energy: 0.8748702519028015
Energy: 1.0192862192972525
Energy: 0.8757368427482684
Energy: 1.2744873760935576
Energy: 0.8757368427546846
Energy: 1.0243485450065652
Energy: 0.8782318432014864
Energy: 1.28135234166764
Energy: 0.878231843204338
Energy: 0.8802535465619151
Energy: 0.8743379202371355
Energy: 1.0169997502760675
Energy: 0.8743379202421259
Energy: 1.014183276812151
Energy: 0.875109086247228
Energy: 1.014136387482614
Energy: 0.8751090862408117
Energy: 0.8771666932245604
Energy: 0.8749595920254916
Energy: 1.014594955196757
Energy: 0.8749595920326207
Energy: 0.8789152705425394
Energy: 0.8744003597834243
Energy: 1.1972605277061221
Energy: 0.8744003597841372
Energy: 0.8903973606197596
Energy: 0.8882220076479156
Energy: 1.4376125781846356
Energy: 0.8882220076571836
Energy: 1.0210568420369892
Energy: 0.8748333228626713
Energy: 1.1414150463813821
Energy: 0.8748333228619585
Energy: 1.0149403595045963
Energy: 0.9243528164074124
Energy: 1.0117973248556786
Energy: 0.9243528164188191
Energy: 1.1912087957005983
Energy: 0.9261930199609328
Energy: 1.1505352834617482
Energy: 0.9261930199509519
Energy: 1.013150003964892
Energy: 0.8767087589932171
Energy: 1.0120078123996388
Energy: 0.8767087589896526
Energy: 1.0132586790723928
Energy: 0.8802740979608328
Energy: 0.8909191146892069
Energy: 0.8802740979601198
Energy: 1.1926193474401052
Energy: 0.8745083309372893
Energy: 0.8757309529372259
Energy: 0.8745083309365764
Energy: 1.140250746354702
Energy: 0.8760387033842243
Energy: 0.8777709620461474
Energy: 0.8760387033770951

minimum gb energy = 0.8716381235471615 eV
minimum distance =  2.20844925596347 Angstroms
sigma value = 37


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

Energy: 1.2737389792514788
Energy: 0.8036547128648932
Energy: 0.8020874253301572
Energy: 0.8038104163095601
Energy: 1.2748879840861465
Energy: 0.8025515508769059
Energy: 1.0436023636418887
Energy: 0.8025515508781323
Energy: 1.2746324357812318
Energy: 0.8027179165461927
Energy: 1.056718925348468
Energy: 0.8027179165461927
Energy: 1.2750975850904513
Energy: 0.9032048668709528
Energy: 1.042405715621206
Energy: 0.9032048668697263
Energy: 1.0465026296095954
Energy: 0.9033888316296339
Energy: 1.03657995705809
Energy: 0.9033888316284073
Energy: 1.0507608042903578
Energy: 0.8030780105568168
Energy: 1.0729257277154864
Energy: 0.8030780105568168
Energy: 0.7976173635015614
Energy: 0.8023829662715277
Energy: 1.045916435872607
Energy: 0.8023829662715277
Energy: 0.8159597932376856
Energy: 0.8048580485941969
Energy: 1.2977283105778485
Energy: 0.8048580485941969
Energy: 0.8122144512174069
Energy: 0.8129401961160254
Energy: 1.2836622427503768
Energy: 0.8129401961160254
Energy: 0.8022914405587901
Energy: 0.8028646262735756
Energy: 1.299012052626643
Energy: 0.8028646262748022
Energy: 0.8020874253326103
Energy: 0.8038104163132397
Energy: 1.2737389792514788
Energy: 0.8036547128648932
Energy: 1.0436023636406622
Energy: 0.8025515508769059
Energy: 1.2748879840861465
Energy: 0.8025515508769059
Energy: 1.056718925348468
Energy: 0.8027179165474193
Energy: 1.2746324357824304
Energy: 0.8027179165461927
Energy: 1.0424057156199797
Energy: 0.9032048668721794
Energy: 1.2750975850904513
Energy: 0.9032048668709528
Energy: 1.03657995705809
Energy: 0.9033888316284073
Energy: 1.0465026296095954
Energy: 0.9033888316284073
Energy: 1.072925727716713
Energy: 0.8030780105568168
Energy: 1.0507608042903578
Energy: 0.8030780105568168
Energy: 1.0459164358713804
Energy: 0.8023829662715277
Energy: 0.7976173635015614
Energy: 0.8023829662715277
Energy: 1.2977283105766217
Energy: 0.8048580485941969
Energy: 0.8159597932364591
Energy: 0.8048580485941969
Energy: 1.2836622427491504
Energy: 0.812940196117252
Energy: 0.8122144512174069
Energy: 0.8129401961160254
Energy: 1.1907269878481386
Energy: 0.8028646262748022
Energy: 0.8022914405587901
Energy: 0.8028646262748022

minimum gb energy = 0.7976173635015614 eV
minimum distance =  2.22332268499814 Angstroms
sigma value = 25


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

Energy: 1.4943419223810017
Energy: 0.7221755636599649
Energy: 0.7145653150592122
Energy: 0.7149721227771284
Energy: 1.0888512218927078
Energy: 0.713379056866018
Energy: 0.9059245050637033
Energy: 0.7133790568669758
Energy: 1.3984614838488918
Energy: 0.7145941902677243
Energy: 0.90602435178882
Energy: 0.7145941902677243
Energy: 1.0736659781922353
Energy: 0.7149257083778304
Energy: 0.90829121202526
Energy: 0.7149257083778304
Energy: 1.2589955754423439
Energy: 0.7946712007270045
Energy: 1.245552987653629
Energy: 0.7946712007270045
Energy: 1.0901587636202137
Energy: 0.7941111225695904
Energy: 1.2531794629748756
Energy: 0.7941111225686326
Energy: 1.0796021666726132
Energy: 0.7134493214838223
Energy: 1.1253244273318987
Energy: 0.7134493214847801
Energy: 0.9077901268395335
Energy: 0.7144270454942663
Energy: 1.2404881938347176
Energy: 0.7144270454933086
Energy: 0.9087199292536152
Energy: 0.7143357670770467
Energy: 1.255363604496302
Energy: 0.7143357670770467
Energy: 0.9131354332215986
Energy: 0.7154703910335718
Energy: 1.2558419549198645
Energy: 0.7154703910335718
Energy: 0.7154620333148839
Energy: 0.7157992162855673
Energy: 1.281120102065822
Energy: 0.7157992162865251
Energy: 0.7194679865070561
Energy: 0.7158925800833378
Energy: 1.256048438737345
Energy: 0.7158925800823801
Energy: 0.7163059382823449
Energy: 0.714545377964387
Energy: 1.0784389393511715
Energy: 0.714545377964387
Energy: 0.7213726698684189
Energy: 0.7149962005501203
Energy: 1.393301102380927
Energy: 0.7149962005501203
Energy: 0.9058737455432736
Energy: 0.7138560505790249
Energy: 1.2571236286270033
Energy: 0.7138560505799827
Energy: 0.8993718436567425
Energy: 0.7136682872325809
Energy: 1.3975574323956899
Energy: 0.7136682872316232
Energy: 1.2596571191876924
Energy: 0.7142521214000623
Energy: 1.3979660791314972
Energy: 0.7142521214000623
Energy: 0.8933797760372426
Energy: 0.795380065224648
Energy: 1.1249719995566323
Energy: 0.7953800652236902
Energy: 1.2528379359332655
Energy: 0.7953789901666982
Energy: 1.0806314240404844
Energy: 0.7953789901657404
Energy: 1.2567468740403545
Energy: 0.7134954050023974
Energy: 1.0902883130801628
Energy: 0.7134954050023974
Energy: 1.284577304445484
Energy: 0.7150336809619317
Energy: 0.9086486874548566
Energy: 0.7150336809590583
Energy: 1.2572886017019622
Energy: 0.7132720092755206
Energy: 0.7144926306791022
Energy: 0.7132720092755206
Energy: 1.251574613427599
Energy: 0.7144762285597798
Energy: 0.9094624666881975
Energy: 0.7144762285597798
Energy: 1.2396442209449845
Energy: 0.7179680090308911
Energy: 0.7142822523249548
Energy: 0.7179680090308911
Energy: 1.2581433179996013
Energy: 0.7135626767742363
Energy: 0.7148115368951524
Energy: 0.7135626767723208
Energy: 1.3966042023373963
Energy: 0.7169832639797065
Energy: 0.7214428896954542
Energy: 0.7169832639797065

minimum gb energy = 0.7132720092755206 eV
minimum distance =  2.25074725645393 Angstroms
sigma value = 41


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

Energy: 1.6297396943459401
Energy: 0.6571805391185601
Energy: 0.6479514805604046
Energy: 0.6497819593776731
Energy: 1.2331249860825308
Energy: 0.646085404313162
Energy: 0.7969388440944961
Energy: 0.6460854043123766
Energy: 1.478970967061614
Energy: 0.6471230602408715
Energy: 0.8051678718156872
Energy: 0.6471230602432272
Energy: 1.2360330180540158
Energy: 0.6507411059659218
Energy: 0.9910629737598184
Energy: 0.6507411059643514
Energy: 1.242701211886955
Energy: 0.6458500555409471
Energy: 1.090822413067603
Energy: 0.6458500555409471
Energy: 1.2299024884917473
Energy: 0.6469553175569807
Energy: 1.1013138678422942
Energy: 0.6469553175577659
Energy: 1.2331195236374595
Energy: 0.7132881868957188
Energy: 1.2434482103069202
Energy: 0.7132881868965041
Energy: 1.090062045013368
Energy: 0.7180122529493163
Energy: 1.0877082414370125
Energy: 0.7180122529501016
Energy: 0.9468235467247111
Energy: 0.6455786420337075
Energy: 1.3564055001332938
Energy: 0.6455786420352779
Energy: 0.947066879113962
Energy: 0.6455866176144244
Energy: 1.35760884090415
Energy: 0.6455866176152096
Energy: 0.7969401685550255
Energy: 0.6481951478888994
Energy: 1.3530609706008645
Energy: 0.6481951478881143
Energy: 0.7948582036823937
Energy: 0.6458255118796447
Energy: 1.3588488276896322
Energy: 0.6458255118804298
Energy: 0.8080025818871097
Energy: 0.6474213024058632
Energy: 1.354225403977447
Energy: 0.6474213024058632
Energy: 0.6460528245158185
Energy: 0.6512178762274916
Energy: 1.3513386020912297
Energy: 0.651217876228277
Energy: 0.6469025144639011
Energy: 0.6470935914863151
Energy: 1.3597858813846073
Energy: 0.6470935914839594
Energy: 0.6534125150486739
Energy: 0.6494112113707543
Energy: 1.4800520940332937
Energy: 0.649411211369969
Energy: 0.7970099999180235
Energy: 0.6491747018296078
Energy: 1.4725989273194824
Energy: 0.649174701830393
Energy: 0.7941051411969355
Energy: 0.6454630148082181
Energy: 1.244181896756503
Energy: 0.6454630148082181
Energy: 0.8026893089707083
Energy: 0.6479360232931389
Energy: 1.2308605539569566
Energy: 0.6479360232939241
Energy: 1.1039996309765865
Energy: 0.6462440589147886
Energy: 1.2293728327301867
Energy: 0.6462440589140035
Energy: 1.0916380082572361
Energy: 0.6468752268137088
Energy: 1.2452325775055708
Energy: 0.6468752268168497
Energy: 1.1052486372416965
Energy: 0.7160098736189122
Energy: 1.2353005003146367
Energy: 0.716009873618127
Energy: 1.356603380882763
Energy: 0.7107984071877391
Energy: 1.2292105640493003
Energy: 0.7107984071861686
Energy: 1.0879240631338942
Energy: 0.7172003253986167
Energy: 1.1064308401901608
Energy: 0.7172003253986167
Energy: 1.3580329213337805
Energy: 0.6464009606899963
Energy: 0.9377762614549671
Energy: 0.6464009606860702
Energy: 1.3553355462367433
Energy: 0.6473710060391611
Energy: 1.1028891720334593
Energy: 0.6473710060407316
Energy: 1.3596889290142715
Energy: 0.6480486082747119
Energy: 0.8114366905447378
Energy: 0.6480486082762823
Energy: 1.2425823113468695
Energy: 0.6462698860709443
Energy: 0.7921466939662559
Energy: 0.6462698860709443
Energy: 1.3564444183307236
Energy: 0.6481932003817025
Energy: 0.7978129895092055
Energy: 0.6481932003817025
Energy: 1.3549228209571014
Energy: 0.6473440942938888
Energy: 0.6492283867538753
Energy: 0.6473440942946741
Energy: 1.360696120852498
Energy: 0.6470272794769235
Energy: 0.6465499974567062
Energy: 0.6470272794784582
Energy: 1.4724210862924723
Energy: 0.6477797339954747
Energy: 0.6498093745855079
Energy: 0.6477797339978303

minimum gb energy = 0.6454630148082181 eV
minimum distance =  2.27020547223158 Angstroms
sigma value = 15


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

Energy: 1.4110502169541326
Energy: 0.6065976014638702
Energy: 0.8650526365195388
Energy: 0.5970520047038982
Energy: 1.324439774146966
Energy: 0.5933849252853919
Energy: 0.7215323668618455
Energy: 0.5933849252853919
Energy: 1.5320044995110607
Energy: 0.5946483125206498
Energy: 0.728413680017114
Energy: 0.5946483125193193
Energy: 1.3292597477980739
Energy: 0.5950089484918122
Energy: 0.97245877814167
Energy: 0.5950089484918122
Energy: 1.3322986622508555
Energy: 0.5927326775990692
Energy: 0.9737405643041677
Energy: 0.5927326776003995
Energy: 1.3242247519845796
Energy: 0.5934189097778426
Energy: 0.9758201552911562
Energy: 0.5934189097765122
Energy: 1.1002032664021364
Energy: 0.8532871906494252
Energy: 1.2159438901046973
Energy: 0.8532871906507555
Energy: 1.2116092223664277
Energy: 0.8521310407481678
Energy: 0.9721599190828119
Energy: 0.852131040748833
Energy: 1.0972992699349338
Energy: 0.8517620650182907
Energy: 1.212284241589706
Energy: 0.8517620650176255
Energy: 1.0966910621655759
Energy: 0.8520241804618743
Energy: 1.4307230738258228
Energy: 0.8520241804612092
Energy: 0.9734024932874973
Energy: 0.8545481573837621
Energy: 1.2095878241959388
Energy: 0.8545481573811012
Energy: 0.8435973314588725
Energy: 0.5926275134178981
Energy: 1.4303798648857171
Energy: 0.592627513420559
Energy: 0.9759525324419648
Energy: 0.5941949860543477
Energy: 1.428457767839103
Energy: 0.5941949860576736
Energy: 0.7198228530170359
Energy: 0.5946817012890485
Energy: 1.2163162381751897
Energy: 0.5946817012890485
Energy: 0.7180802993563047
Energy: 0.593104165997372
Energy: 1.3315619453579484
Energy: 0.5931041659967068
Energy: 0.7271561154146235
Energy: 0.5938638368633592
Energy: 1.4278630473982883
Energy: 0.5938638368633592
Energy: 0.600540764729394
Energy: 0.5963904889907178
Energy: 1.4317871348465219
Energy: 0.5963904889873918
Energy: 0.5935839459322335
Energy: 0.5933638549379946
Energy: 1.4331432857401512
Energy: 0.5933638549366641
Energy: 0.6007431055814112
Energy: 0.5962126294697336
Energy: 1.324944159490358
Energy: 0.5962126294697336
Energy: 0.7293232037030011
Energy: 0.5984590245059639
Energy: 1.5348262609621475
Energy: 0.5984590245046334
Energy: 0.7156369069807015
Energy: 0.5931128710318054
Energy: 1.4320470816364266
Energy: 0.593112871030475
Energy: 0.7308679028809325
Energy: 0.5945807987202777
Energy: 1.32866650438172
Energy: 0.5945807987202777
Energy: 0.976385097914686
Energy: 0.5941876420669981
Energy: 1.320904200553676
Energy: 0.5941876420689937
Energy: 0.9746964097174742
Energy: 0.5934480328441112
Energy: 1.4299921975464656
Energy: 0.5934480328454416
Energy: 0.9734573149562549
Energy: 0.8530204661417007
Energy: 1.1044898446557703
Energy: 0.8530204661436963
Energy: 1.2120327115242957
Energy: 0.8516310530840588
Energy: 1.3406373655172816
Energy: 0.8516310530860544
Energy: 0.9726978432193601
Energy: 0.8520658347723921
Energy: 1.2147732757733334
Energy: 0.8520658347730573
Energy: 1.2114080273027317
Energy: 0.8523683445153938
Energy: 1.1016835988153746
Energy: 0.8523683445140634
Energy: 1.2133769293089327
Energy: 0.8532737130244819
Energy: 1.214579150751053
Energy: 0.8532737130238166
Energy: 1.21013985888587
Energy: 0.5937263907204469
Energy: 0.9753455396501736
Energy: 0.593726390721112
Energy: 1.3318989961596337
Energy: 0.5926301550426524
Energy: 0.8435034460375144
Energy: 0.5926301550433175
Energy: 1.2159162401049888
Energy: 0.5947646782144167
Energy: 0.9731217635635144
Energy: 0.5947646782130863
Energy: 1.4293336199082527
Energy: 0.594766644194369
Energy: 0.7240905286153236
Energy: 0.5947666441930386
Energy: 1.4314213873608883
Energy: 0.5946165207795976
Energy: 0.7223564599356702
Energy: 0.5946165207769369
Energy: 1.4234967571201609
Energy: 0.597868433776228
Energy: 0.6055671827725919
Energy: 0.5978684337795539
Energy: 1.4267362183178605
Energy: 0.5967412868207959
Energy: 0.5985484826901699
Energy: 0.5967412868201306
Energy: 1.5311846527562956
Energy: 0.5944535671777027
Energy: 0.5966026477915106
Energy: 0.5944535671777027

minimum gb energy = 0.5926275134178981 eV
minimum distance =  2.28169223622555 Angstroms
sigma value = 85


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

Energy: 1.571015589899428
Energy: 0.5430134662683447
Energy: 0.7317883549642962
Energy: 0.5408817571555632
Energy: 1.4283122729046114
Energy: 0.5394292905706848
Energy: 0.6468357921708872
Energy: 0.5394292905724155
Energy: 1.4220045331130136
Energy: 0.5390055507276693
Energy: 0.6470018466652304
Energy: 0.5390055507270924
Energy: 1.2257812299259776
Energy: 0.5392901298820558
Energy: 0.8709878874157793
Energy: 0.5392901298791714
Energy: 1.39498357626372
Energy: 0.5370502701466698
Energy: 0.8720693600864879
Energy: 0.5370502701489775
Energy: 1.2296581027650255
Energy: 0.5380215706916651
Energy: 0.8718039564815206
Energy: 0.5380215706893573
Energy: 1.2283794747521106
Energy: 0.5375171517687808
Energy: 1.085498870965873
Energy: 0.5375171517710884
Energy: 1.2875259947824074
Energy: 0.5377058308111362
Energy: 0.9238117567217269
Energy: 0.5377058308111362
Energy: 1.2340483050814786
Energy: 0.8006773775044649
Energy: 1.0875064389784899
Energy: 0.8006773775044649
Energy: 1.2356990222594568
Energy: 0.9943501195619471
Energy: 1.2865815054960832
Energy: 0.9943501195631009
Energy: 1.0863101185054382
Energy: 0.7328539599166015
Energy: 1.1303483881649525
Energy: 0.7328539599189092
Energy: 1.0342919230652454
Energy: 0.5362520800522161
Energy: 1.287718854751974
Energy: 0.5362520800499084
Energy: 1.0863606618708896
Energy: 0.5361393219070184
Energy: 1.3303617351957218
Energy: 0.5361393219075953
Energy: 0.8677458986722811
Energy: 0.5364505895839438
Energy: 1.1270719879936404
Energy: 0.5364505895822129
Energy: 0.8096224668532758
Energy: 0.5365156660220827
Energy: 1.4719192922668385
Energy: 0.5365156660226335
Energy: 0.8694281050184111
Energy: 0.5367379382568069
Energy: 1.3253904987010423
Energy: 0.5367379382579608
Energy: 0.6472611263276873
Energy: 0.5354144200107607
Energy: 1.3251478912216654
Energy: 0.53541442000903
Energy: 0.6493883947131256
Energy: 0.5362816757379308
Energy: 1.3917791050569097
Energy: 0.5362816757385077
Energy: 0.647151650251488
Energy: 0.5369250815782456
Energy: 1.5078422417582
Energy: 0.5369250815765149
Energy: 0.5889819041558101
Energy: 0.5371002578510754
Energy: 1.507792599682222
Energy: 0.5371002578516523
Energy: 0.5895542143342365
Energy: 0.5341521520822655
Energy: 1.3895503469182253
Energy: 0.5341521520822655
Energy: 0.5928197597288576
Energy: 0.5344368240593308
Energy: 1.3723486271917362
Energy: 0.5344368240593308
Energy: 0.6974925851481403
Energy: 0.5376303700154733
Energy: 1.5545478446716217
Energy: 0.5376303700160503
Energy: 0.699607070452323
Energy: 0.5359662657508719
Energy: 1.3870671949992783
Energy: 0.5359662657491412
Energy: 0.7014361380408223
Energy: 0.5356159245216968
Energy: 1.225808284271807
Energy: 0.5356159245222737
Energy: 0.8753293586701384
Energy: 0.5340680676367322
Energy: 1.5158335171831787
Energy: 0.5340680676367322
Energy: 0.8732524410046146
Energy: 0.5356469132262397
Energy: 1.4280426053352144
Energy: 0.535646913223932
Energy: 0.8703663118369881
Energy: 0.5356351784257877
Energy: 1.2286836845358173
Energy: 0.5356351784246339
Energy: 1.0842145780151324
Energy: 0.5355939911740002
Energy: 1.3849696700348018
Energy: 0.5355939911751539
Energy: 1.0834817911555985
Energy: 0.5355220265338907
Energy: 1.2336467298689666
Energy: 0.5355220265373524
Energy: 1.2881491922575607
Energy: 0.7993623626131985
Energy: 1.0280660849954493
Energy: 0.7993623626143523
Energy: 1.1303051833273134
Energy: 0.8247311059988575
Energy: 1.2488458810778558
Energy: 0.8247311059965499
Energy: 1.287038627425692
Energy: 0.5371557159349801
Energy: 1.0307403150131065
Energy: 0.5371557159309417
Energy: 1.3950664658880891
Energy: 0.5371571416952617
Energy: 1.0314362865120261
Energy: 0.5371571416975695
Energy: 1.1282366929023009
Energy: 0.5378058759055577
Energy: 0.8710044270634463
Energy: 0.5378058759067116
Energy: 1.4763841169226837
Energy: 0.5370982111919805
Energy: 0.8700258339770215
Energy: 0.5370982111948651
Energy: 1.4277300722075106
Energy: 0.5379310644503543
Energy: 0.8714306065896853
Energy: 0.5379310644543926
Energy: 1.32531463247425
Energy: 0.539115629996115
Energy: 0.6499072298470879
Energy: 0.539115629996115
Energy: 1.435468575244096
Energy: 0.5372783871102469
Energy: 0.6474374115859381
Energy: 0.5372783871102469
Energy: 1.507657469493711
Energy: 0.5415119865606502
Energy: 0.6462332318989616
Energy: 0.5415119865583425
Energy: 1.3229666936969062
Energy: 0.5399920108124728
Energy: 0.5392107854651841
Energy: 0.539992010810742
Energy: 1.3932058812392099
Energy: 0.5374757226154124
Energy: 0.5380247636534502
Energy: 0.5374757226148354
Energy: 1.4180838073089828
Energy: 0.5385229425570663
Energy: 0.537448415899779
Energy: 0.5385229425587971

minimum gb energy = 0.5340680676367322 eV
minimum distance =  2.27781653786617 Angstroms
sigma value = 113


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

Energy: 0.015350964663608477
Energy: 0.01594762882344021
Energy: 1.1282378497868855
Energy: 0.41403966666432496
Energy: 0.016217414299932613
Energy: 0.11631308811741653
Energy: 0.8322472889302917
Energy: 0.11631308811741653
Energy: 0.016143707852461785
Energy: 0.11490621917349543
Energy: 0.8320479605334432
Energy: 0.11490621917435781
Energy: 0.016935254724535297
Energy: 0.1146796097433349
Energy: 0.828021167293099
Energy: 0.11467960974291602
Energy: 0.8306212279563688
Energy: 0.11477546641269308
Energy: 0.8274799692429214
Energy: 0.11477546641269308
Energy: 0.01607932051300929
Energy: 0.1149062921925124
Energy: 0.8298495931765993
Energy: 0.11490629219295591

minimum gb energy = 0.015350964663608477 eV
minimum distance =  2.52669631736847 Angstroms
sigma value = 1