Model name: model_name=EAM_Mendelev_2019_CuZr__MO_945018740343_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.640646010637284
cohesive_energy=3.276684801703484
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.6503220418516997e-19, 2.0759562864401396e-19, 2.4800893206003e-19, 2.8281621943367997e-19, 3.13299232072164e-19, 3.38562353237076e-19, 3.59959422184146e-19, 3.79464320526462e-19, 3.9825945461991593e-19, 4.1661559231565395e-19, 4.342203091700459e-19, 4.504663802388059e-19, 4.647882371701319e-19, 4.7691991864278e-19, 4.86996007494006e-19, 4.95482737124304e-19, 5.02809490871586e-19, 5.09088421100232e-19, 5.14271462511222e-19, 5.18337786808314e-19, 5.2134026582043e-19, 5.23376632322244e-19, 5.24555834324868e-19, 5.249419588936619e-19, 5.24555834324868e-19, 5.23288512607374e-19, 5.20673760340686e-19, 5.16238935417774e-19, 5.0960432197638e-19, 5.00395010684148e-19, 4.8824730744516e-19, 4.72880831348466e-19, 4.54173816969882e-19, 4.3216792090189196e-19, 4.068166800221099e-19, 3.77868552598998e-19, 3.4476918551719196e-19, 3.0654765973648797e-19, 2.61754005403116e-19, 2.0820125141166598e-19, 1.4244808256996938e-19, 6.01788758966838e-20, -4.549717009336139e-20, -1.8965765904975e-19, -4.04110603687284e-19, -7.57544360441148e-19, -1.407385601014914e-18, -2.7288913300941596e-18, -5.54768079112206e-18, -1.154499643280988e-17, -2.5593489986842796e-17, -6.36225943538034e-17, -1.8991721166445798e-16, -7.60848048660456e-16]
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: 0.015259526892097476
Energy: 0.505804603625082
Energy: 0.5036233424435494
Energy: 0.84849861018951
Energy: 0.8513476390691765
Energy: 0.3151133902759282
Energy: 0.01603371711954766
Energy: 0.08582730160092418
Energy: 0.8938471411680312
Energy: 0.2508129313016936
Energy: 0.5040743481443721
Energy: 0.5058623176489255
Energy: 0.01671263944986567
Energy: 0.08678577276779924
Energy: 0.015614202863687256
Energy: 0.8926537570130916
Energy: 0.7316510237376084
Energy: 0.5039989183375693
Energy: 0.5065501543381355
Energy: 0.08546654005410369
Energy: 0.08701677322719091
Energy: 0.017656453966188274
Energy: 0.668375194844376
Energy: 0.5041635848784931
Energy: 0.8334228693224327
Energy: 0.8508517211366162
Energy: 0.08576461645013304
Energy: 0.01608704837603491
Energy: 0.3152671883877143
Energy: 0.8993327602088449
Energy: 0.25101239921232427
Energy: 0.5038885429152801
Energy: 0.5050882417765568
Energy: 0.01648915067991402
Energy: 0.08575158634639463
Energy: 0.01547291062761593
Energy: 0.6670466325952823
Energy: 0.7315937184082558
Energy: 0.7322987160266089
Energy: 0.5059810505218972
Energy: 0.08547195099925226
Energy: 0.0869440157870079

minimum gb energy = 0.015259526892097476 eV
minimum distance =  2.55082426614613 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.1247794832436802
Energy: 1.355382426790615
Energy: 1.1869535950320298
Energy: 1.048821214707308
Energy: 1.193967854667996
Energy: 1.2100245481325114
Energy: 1.160374527852528
Energy: 1.0216036256924694
Energy: 1.141320246830821
Energy: 1.0507907789600417
Energy: 1.1970857863696076
Energy: 1.1812172897730295
Energy: 1.0448695477766567
Energy: 1.127099438034806
Energy: 1.181869778676567
Energy: 1.1839470277406392
Energy: 1.1565158199541017
Energy: 1.149760557263556
Energy: 1.1637217880148671
Energy: 1.1543249746864113
Energy: 1.142075318345456
Energy: 1.0097017663145718
Energy: 1.187269950236691
Energy: 1.0304223866182403
Energy: 1.1489688538720222
Energy: 1.152576414741651
Energy: 1.0989657897478011
Energy: 1.2319854461253577
Energy: 1.1997296522961873
Energy: 1.1053962978432816
Energy: 1.0911497475012868
Energy: 1.0478784873802347
Energy: 1.0845979775057706
Energy: 1.1787446569058353
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Energy: 1.1302334350098906
Energy: 1.1046599935262509
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Energy: 1.0555874769143194
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Energy: 1.1147707485186489
Energy: 1.0450061374451247
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Energy: 1.1325839667924333
Energy: 1.1245832832431046
Energy: 1.1383972142318954
Energy: 1.1104531086967597
Energy: 1.1568963608217722
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Energy: 1.1200571248583346
Energy: 1.116285391001105
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Energy: 1.0783688781798615
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Energy: 1.1547981548530106
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Energy: 1.0097096526277114
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Energy: 1.02960899933048
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Energy: 1.1837929617650618
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Energy: 1.1555121215521933
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Energy: 1.0759889658714386
Energy: 1.05485825751525
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Energy: 1.0453669375338839
Energy: 1.1447307986328548
Energy: 1.098181092310461
Energy: 1.1066201330323642
Energy: 1.2122264328467836
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Energy: 1.0984489717073944
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Energy: 1.1341334984643934
Energy: 1.2031637197511573
Energy: 1.1129538170405973
Energy: 1.0680697276353772
Energy: 1.0479965015842396
Energy: 1.0465581331685119
Energy: 1.119915875073858
Energy: 1.1335694947988597
Energy: 1.1260941456308915
Energy: 1.0922343364369365
Energy: 1.1504071510909037
Energy: 1.1571289152419297
Energy: 1.1544332754805444
Energy: 1.090868148228976
Energy: 1.1247290486409673
Energy: 1.1483485282140684
Energy: 1.1420651444659762
Energy: 1.0071481291185034
Energy: 1.183860849001968
Energy: 1.104651116597018
Energy: 1.1243381033062727
Energy: 1.1296367920374737
Energy: 1.111239864136243
Energy: 1.1791633477363133
Energy: 1.154960579434524
Energy: 1.119597345105788
Energy: 1.1404238337888506
Energy: 1.0854501271861776
Energy: 1.170616143589572
Energy: 1.17368473100138
Energy: 1.155830880286477
Energy: 1.0471575430081543
Energy: 1.1491479544869656
Energy: 1.0313378705352028
Energy: 1.1810472157014134
Energy: 1.1311332746449154
Energy: 1.0255740095119938
Energy: 1.0928919119383302
Energy: 1.1117261673969343
Energy: 1.0676712633279504
Energy: 1.1294769800750497
Energy: 1.1783258856259458
Energy: 1.1490780162565533
Energy: 1.084253277620494
Energy: 1.068552632048702

minimum gb energy = 1.0071481291185034 eV
minimum distance =  2.17869226556432 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.0685997973340073
Energy: 1.2644189812919857
Energy: 1.2159890188703926
Energy: 1.2247482126128162
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Energy: 1.1769471919664476
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Energy: 1.1148161192262716
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Energy: 1.2008174410678154
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Energy: 1.0576298737866692
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Energy: 1.0788316519024832
Energy: 1.065225486465042
Energy: 1.0298922464652562
Energy: 1.0906631740945005
Energy: 1.1061122493373134
Energy: 1.0314039136946962
Energy: 1.1563521373923575
Energy: 1.1928537270269424
Energy: 1.0645182428346776
Energy: 1.1677189311822345
Energy: 1.102565023643544
Energy: 1.12653707757088
Energy: 1.1156532252248934
Energy: 1.167339626403637
Energy: 1.0671739196555945
Energy: 1.1453745657965082
Energy: 1.163995623650553
Energy: 1.1394739279086692
Energy: 1.0748702268767305
Energy: 1.130480118958214
Energy: 1.1353683183830556
Energy: 1.056632450007788
Energy: 1.0987967570945205
Energy: 1.0954280717496014
Energy: 1.1760924357391276
Energy: 1.154099572635261
Energy: 1.0809187990534586
Energy: 1.0754836531740308
Energy: 1.0456984793681063
Energy: 1.0474892952812502
Energy: 1.0608595820390319
Energy: 1.0813328852412942
Energy: 1.1160903360066918
Energy: 1.0047548820212822
Energy: 1.0399676147387713
Energy: 1.0350355977747532
Energy: 1.0704971857185603
Energy: 1.0887474647700102
Energy: 1.1289197555578765
Energy: 1.1719607916361385
Energy: 1.0593265988008902
Energy: 1.036490684841837
Energy: 1.053795258482069
Energy: 1.1730972068034238
Energy: 1.0801274800181666
Energy: 1.0772751312803144
Energy: 1.1330910577399225
Energy: 1.111578984890706
Energy: 1.127408095464254
Energy: 1.1704971530813273
Energy: 1.144153600195005
Energy: 1.1156909853074999
Energy: 1.1164650421283622
Energy: 1.1232140119309546
Energy: 1.1986486364759779
Energy: 1.1513735635264222
Energy: 1.0497126829149344
Energy: 1.0835150449236077
Energy: 1.0539914146303915
Energy: 1.0530123004675507
Energy: 1.0274964401159055
Energy: 1.2248076279218971
Energy: 1.1770801737202365
Energy: 1.1873025518904863
Energy: 1.1340847587671548
Energy: 1.0882976081097242
Energy: 1.0588819115550063
Energy: 1.0595097304665122
Energy: 1.2393892323043716
Energy: 1.1709485516099745
Energy: 1.073400414076798
Energy: 1.073697335433351
Energy: 1.074279298085396
Energy: 1.079012537022944
Energy: 1.025071037597857
Energy: 1.032048381150189
Energy: 1.1188736973443116
Energy: 1.223944754717493
Energy: 1.0583745663083504
Energy: 1.1500490578444347
Energy: 1.1100772678324455
Energy: 1.0702117397619189
Energy: 1.1675985270378948
Energy: 1.1627885131274356
Energy: 1.0645098480278459
Energy: 1.196606333241803
Energy: 1.1583397550089212
Energy: 1.0872349571502204
Energy: 1.1503503859405875
Energy: 1.160771542133573
Energy: 1.1653827340569824
Energy: 1.0444862354734448
Energy: 1.106900455304795
Energy: 1.1147506016568918
Energy: 1.175535442240656
Energy: 1.1802066834335045
Energy: 1.132167413250402
Energy: 1.0952192939245997
Energy: 1.081193146111596
Energy: 1.0479513551037214
Energy: 1.0502387904852386
Energy: 1.1783910560270159
Energy: 1.119534996250349
Energy: 1.0462609340935018
Energy: 1.0626164440541401

minimum gb energy = 1.003345960822469 eV
minimum distance =  2.22698276664229 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.1278130267530646
Energy: 1.0742665237553486
Energy: 1.1310752096887233
Energy: 1.0803187959234914
Energy: 1.1701883718935266
Energy: 1.1245240054364243
Energy: 1.1893132762799012
Energy: 1.044201001098919
Energy: 1.121719692337052
Energy: 1.0432062886329376
Energy: 1.1066001631134632
Energy: 1.1231129128602617
Energy: 1.0651961417037195
Energy: 1.121258943956504
Energy: 1.0834083719914738
Energy: 1.085934408708859
Energy: 1.1227754082988601
Energy: 1.1322868832047692
Energy: 1.0628985978398284
Energy: 1.13351932998953
Energy: 1.1170995932732477
Energy: 1.0613757557959673
Energy: 1.1791373934606812
Energy: 1.0616751049129618
Energy: 1.1260836435929293
Energy: 1.1095209933649695
Energy: 1.0618875072860414
Energy: 1.1216265068395057
Energy: 1.0870720296666796
Energy: 1.1174391294537869
Energy: 1.0886445148304247
Energy: 1.2003622448230509
Energy: 1.0892221335551355
Energy: 1.197210050474273
Energy: 1.0772802971350632
Energy: 1.056961115807816
Energy: 1.0567981257876975
Energy: 1.06819046205391
Energy: 1.0511857801093063
Energy: 1.06493880879311
Energy: 1.055584108220132
Energy: 1.0567796345222193
Energy: 1.1462798023230643
Energy: 1.1247174282759669
Energy: 1.1298682290585647
Energy: 1.0706034865056158
Energy: 1.180177566279556
Energy: 1.1410551418539796
Energy: 1.1869732981948682
Energy: 1.043973821059564
Energy: 1.1213460043818588
Energy: 1.0431866994665668
Energy: 1.1399861065613386
Energy: 1.1245068698535006
Energy: 1.0985700170061048
Energy: 1.1222494503283431
Energy: 1.062832851017511
Energy: 1.0885320751938496
Energy: 1.1278749649182078
Energy: 1.1322511610417667
Energy: 1.1001895513842084
Energy: 1.0666080123587178
Energy: 1.079873742573393
Energy: 1.061595400108131
Energy: 1.1216954094421925
Energy: 1.0617217742565077
Energy: 1.1227561821794543
Energy: 1.091200444346084
Energy: 1.061865193359947
Energy: 1.1210855996743392
Energy: 1.1618653207211072
Energy: 1.0561182015396915
Energy: 1.088618805197641
Energy: 1.2001112538555232
Energy: 1.0889930077430583
Energy: 1.1640153283962842
Energy: 1.0791966612482817
Energy: 1.0546251920000034
Energy: 1.057382919467154
Energy: 1.0679745701331054
Energy: 1.0761592631013588
Energy: 1.055892086893407
Energy: 1.0547185417319438
Energy: 1.0569684268502308
Energy: 1.1466095846367632
Energy: 1.0746057715994843
Energy: 1.1653764824477433
Energy: 1.0718632585948764
Energy: 1.1796856281910297
Energy: 1.1073243064859029
Energy: 1.1164232466645596
Energy: 1.0437538958113801
Energy: 1.121257283101732
Energy: 1.0431342906784158
Energy: 1.1339770484450724
Energy: 1.1309443652803273
Energy: 1.0986278515906023
Energy: 1.177835193079648
Energy: 1.062819048076611
Energy: 1.0884167226695993
Energy: 1.1365320898918163
Energy: 1.1042112066061245
Energy: 1.1000900322105878
Energy: 1.1306773320631351
Energy: 1.1145501864861662
Energy: 1.0625314031887687
Energy: 1.1228691290858257
Energy: 1.0616315225062456
Energy: 1.1378456284058693
Energy: 1.090595739664138
Energy: 1.059401358340625
Energy: 1.121299746334516
Energy: 1.0683389977996922
Energy: 1.108248018446668
Energy: 1.087404521459677
Energy: 1.1993826026956913
Energy: 1.0890257106102625
Energy: 1.1640809487552373
Energy: 1.0784706708638971
Energy: 1.0459051163490174
Energy: 1.0577348801775983
Energy: 1.057470329365813
Energy: 1.0699030076141458
Energy: 1.0578390841231455
Energy: 1.0692891197617946
Energy: 1.0574460848563985
Energy: 1.129561184978478
Energy: 1.0731600025731114
Energy: 1.1665399804653434
Energy: 1.0706670416813382
Energy: 1.1804782007132366
Energy: 1.1069988204321202
Energy: 1.116340255660549
Energy: 1.0983691391375516
Energy: 1.1218722572585267
Energy: 1.1052971542268526
Energy: 1.14214938385272
Energy: 1.1309782298208995
Energy: 1.0986306008672106
Energy: 1.1782977916071569
Energy: 1.0629702405255703
Energy: 1.0830716752824068
Energy: 1.0795926277242607
Energy: 1.069337637408571
Energy: 1.087862347189302
Energy: 1.0803485817523755
Energy: 1.1033384796178318
Energy: 1.0614776906244128
Energy: 1.1187153110244414
Energy: 1.0762700904557245
Energy: 1.0781217327424886
Energy: 1.063989316158278
Energy: 1.069649905732738
Energy: 1.1220229806116393
Energy: 1.0629161436670502
Energy: 1.1197247506661812
Energy: 1.0671742972074572
Energy: 1.2020655770003121
Energy: 1.083217861145079
Energy: 1.080928867103601
Energy: 1.0815060865226205
Energy: 1.1191039474205309
Energy: 1.0547562250129026
Energy: 1.0581873652808889
Energy: 1.0699124629594592
Energy: 1.093159499297294
Energy: 1.0699579332377205
Energy: 1.057372897326321
Energy: 1.1296373393564796
Energy: 1.0748379092141214
Energy: 1.1687052152704986
Energy: 1.0707530694022696
Energy: 1.129988243378782
Energy: 1.106782174013529
Energy: 1.1295178516873587
Energy: 1.0986843289458708
Energy: 1.1623353703172217
Energy: 1.1095873237539735
Energy: 1.173955035142323
Energy: 1.1478353737376044
Energy: 1.1055291162698628
Energy: 1.141520113016522
Energy: 1.0629043668952902
Energy: 1.149476293144514
Energy: 1.0628276762695927
Energy: 1.0700860968438166
Energy: 1.0943507917474917
Energy: 1.085691917254824
Energy: 1.0968936553967954
Energy: 1.0531736289072509
Energy: 1.0589448611991836
Energy: 1.0542572042934764
Energy: 1.076823916188494
Energy: 1.0823898884857608
Energy: 1.0434193868337265
Energy: 1.0873522953588055
Energy: 1.0549446798500717
Energy: 1.1808199008204268
Energy: 1.0622050648986627
Energy: 1.202700904596262
Energy: 1.0627742551400239
Energy: 1.1581022573293975
Energy: 1.0907847364169816
Energy: 1.1195480327204341
Energy: 1.0608547020193586
Energy: 1.1187498618085754
Energy: 1.0705158815313118
Energy: 1.09323679820018
Energy: 1.0810904674787152
Energy: 1.0954802319508132
Energy: 1.1464993620464272
Energy: 1.0746541987060627
Energy: 1.095106580582415
Energy: 1.0709393702363406
Energy: 1.1297459099540976
Energy: 1.0437256246469278
Energy: 1.0688658160188154
Energy: 1.0744683198935636
Energy: 1.1626464691786957
Energy: 1.1172982000162786
Energy: 1.1282803317870342
Energy: 1.1428499476798883
Energy: 1.1111879035812313
Energy: 1.1405708824058463
Energy: 1.0686043029558216
Energy: 1.141889177799747
Energy: 1.0965671733318045
Energy: 1.139226078222269
Energy: 1.1142276581848929
Energy: 1.085557755827433
Energy: 1.1683783204384703
Energy: 1.0520828276032008
Energy: 1.0945715183391183
Energy: 1.081580086193667
Energy: 1.0609079480019257
Energy: 1.0821170546196666
Energy: 1.0447974487337515
Energy: 1.0758154185776976
Energy: 1.0628358028590679
Energy: 1.093050356533054
Energy: 1.0624807523670416
Energy: 1.1613830418365536
Energy: 1.0629552868149799
Energy: 1.0549688474510555
Energy: 1.1131593771215864
Energy: 1.11853302650041
Energy: 1.110529775197531
Energy: 1.1189796373522365
Energy: 1.04997953936833
Energy: 1.1441011861474002
Energy: 1.0801478256519308
Energy: 1.0820830042734904

minimum gb energy = 1.0431342906784158 eV
minimum distance =  2.18992131824318 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.0134742701799095
Energy: 1.2442336867127917
Energy: 1.2888987653631157
Energy: 1.1980673512725881
Energy: 1.0519583244706219
Energy: 1.1001169602820589
Energy: 1.0065224155191315
Energy: 1.048481088674143
Energy: 1.0488198547653715
Energy: 1.0941110298435444
Energy: 1.0823255534565006
Energy: 1.059798419723402
Energy: 1.048574905939934
Energy: 1.1308365632384392
Energy: 1.0497395755675558
Energy: 0.9876494106827395
Energy: 1.1237969678280313
Energy: 1.0833131573385275
Energy: 1.070992998026372
Energy: 1.069681978441449
Energy: 1.0482241535362442
Energy: 1.0519831233981005
Energy: 1.0273141474399183
Energy: 1.0990316337535886
Energy: 1.0872346673342004
Energy: 1.0816097649532215
Energy: 1.094797470777082
Energy: 1.1614381061286816
Energy: 1.0693012613230948
Energy: 1.0618526558498074
Energy: 1.0947995605848706
Energy: 1.0270819802709703
Energy: 1.0320665498939061
Energy: 1.096118653725415
Energy: 1.058714294084994
Energy: 1.0056385854844898
Energy: 1.0601959090130157
Energy: 1.0527002291203544
Energy: 0.9864023801260762
Energy: 1.0828503891092858
Energy: 1.0601418412600168
Energy: 1.1307141916029744
Energy: 1.037946831086542
Energy: 0.9877816117025177
Energy: 1.023548435712399
Energy: 1.2572858913078233
Energy: 1.0070896130337925
Energy: 1.0075636560176622
Energy: 1.0697396844041809
Energy: 1.0054069962663503
Energy: 1.0888295021378593
Energy: 1.1230518908549725
Energy: 0.9888915574962954
Energy: 1.1142010694639557
Energy: 1.1190377949760533
Energy: 1.047733466162553
Energy: 1.0055280150549528
Energy: 1.0914035071654822
Energy: 1.0990160491598837
Energy: 1.027921119976109
Energy: 1.0597342245618624
Energy: 1.183018173685076
Energy: 1.047715511418859
Energy: 1.0383677427127647
Energy: 0.9798695875560477
Energy: 1.0950524207972718
Energy: 1.0817165740923724
Energy: 1.0615115875485668
Energy: 1.0490903144364803
Energy: 1.1307176066859301
Energy: 1.0533280248625125
Energy: 1.047596214192131
Energy: 1.1009444812001439
Energy: 1.0069781535964502
Energy: 1.069821758286781
Energy: 1.0710355000405178
Energy: 1.1598968198379762
Energy: 1.0688176214389828
Energy: 1.0724018834116302
Energy: 1.0922240331407733
Energy: 1.0285928033447727
Energy: 1.0979471009009434
Energy: 1.0922635042098134
Energy: 1.0695582762238642
Energy: 1.0068113562063055
Energy: 1.0615665266524517
Energy: 1.1156155004441293
Energy: 1.0946687528363035
Energy: 1.0957361705919142
Energy: 1.119553666408192
Energy: 1.0481613906010494
Energy: 1.1962942874926055
Energy: 0.9889694545616255
Energy: 1.0526549170941302
Energy: 1.2560976032238185
Energy: 1.0070318438615973
Energy: 1.0063754829304667
Energy: 1.0698129755185661
Energy: 1.0055598334071283
Energy: 1.0464157802268665
Energy: 1.0210121157348566
Energy: 1.1910788116938305
Energy: 1.007060014318873
Energy: 1.0064515728451255
Energy: 1.0691978064067051
Energy: 1.0134998203327614
Energy: 1.221650929440165
Energy: 1.2699864371173155
Energy: 1.0214376137486403
Energy: 1.0519685369625154
Energy: 1.099556315648966
Energy: 1.0066111179281862
Energy: 1.0533267621494602
Energy: 1.0495300883713627
Energy: 1.0940109791377137
Energy: 1.097960318481145
Energy: 1.059548912635084
Energy: 1.0488067033384074
Energy: 1.130896800085549
Energy: 1.0496789751389288
Energy: 0.9878526604444922
Energy: 1.1240720504282304
Energy: 1.0955279378117344
Energy: 1.0709326899563139
Energy: 1.0695996070508804
Energy: 1.048313181722058
Energy: 1.051913438601473
Energy: 1.0287024812559604
Energy: 1.0990566681059015
Energy: 1.087268366587811
Energy: 1.0815226132235798
Energy: 1.0945872969696464
Energy: 1.161635855924867
Energy: 1.0693750421371508
Energy: 1.0628866023929902
Energy: 1.095033011419442
Energy: 1.0265401424988128
Energy: 1.0029158828672524
Energy: 1.1008413144304425
Energy: 1.0586210888655339
Energy: 1.0059288906821686
Energy: 1.0601916038019898
Energy: 1.0532796327836071
Energy: 0.9863072564615842
Energy: 1.0819022366450417
Energy: 1.0059085221856219
Energy: 1.130724800841811
Energy: 1.0378826637624816
Energy: 1.0453164452676498
Energy: 1.0234916805645164
Energy: 1.2570680437678874
Energy: 1.0071862419507303
Energy: 1.0082117755127549
Energy: 1.0699691716705517
Energy: 1.005455047648347
Energy: 1.088749104957191
Energy: 1.26897031323884
Energy: 0.9872454342161804
Energy: 1.1140920964944034
Energy: 1.1190813565188351
Energy: 1.047834711146871
Energy: 1.005504930225033
Energy: 1.0921997821709997
Energy: 1.1062365878119838
Energy: 1.0290673643619062
Energy: 1.0604605724163518
Energy: 1.0967545802450216
Energy: 1.1324035177913725
Energy: 1.0383650768815824
Energy: 0.9799796944204555
Energy: 1.105766161832597
Energy: 1.0819208676669116
Energy: 1.0612832113132247
Energy: 1.0489668481489616
Energy: 1.0479957502370265
Energy: 1.0541167132650036
Energy: 1.0475041214511156
Energy: 1.100777688134691
Energy: 1.0849955298240277
Energy: 1.069915431819273
Energy: 1.1063875791761442
Energy: 1.159827440926469
Energy: 1.0687565810542008
Energy: 1.072125765066711
Energy: 1.0866170708281304
Energy: 1.0289851884242969
Energy: 1.098005714551334
Energy: 1.0951500580877924
Energy: 1.069492770385753
Energy: 1.007350683253332
Energy: 1.0609485472766806
Energy: 1.1156476942405378
Energy: 1.0946002108176371
Energy: 1.095583947517506
Energy: 1.1193131305264923
Energy: 1.0482013929475384
Energy: 1.1966832817701372
Energy: 0.9893310577262101
Energy: 1.0722138957822802
Energy: 1.2561788874255462
Energy: 1.0070066135741642
Energy: 1.0064881795656782
Energy: 1.069832912022102
Energy: 1.005422264508531
Energy: 1.0462713782083626
Energy: 1.0209517987784698
Energy: 1.019031797475697
Energy: 1.0060994495546478
Energy: 1.0064805570996427
Energy: 1.0690487085682134

minimum gb energy = 0.9798695875560477 eV
minimum distance =  2.30567697885972 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.2190944487461925
Energy: 1.1999643348751328
Energy: 1.0883541018108578
Energy: 1.2991972037050008
Energy: 1.0893265410767516
Energy: 1.137105370960244
Energy: 1.1950528719405358
Energy: 1.095477924375748
Energy: 1.1295597470654761
Energy: 1.1351298925046198
Energy: 1.1318147098353224
Energy: 1.2107576501695314
Energy: 1.2037272920824251
Energy: 0.9953668614455958
Energy: 1.1401598287427956
Energy: 1.1714008535811213
Energy: 1.0514603261358073
Energy: 1.20357236045925
Energy: 1.2149552315883039
Energy: 1.0273855749804013
Energy: 1.1662247181167853
Energy: 1.0189698073861453
Energy: 1.1463090910932776
Energy: 1.0719277207644629
Energy: 1.099190119759439
Energy: 1.0961642664411524
Energy: 1.0368826814266012
Energy: 1.0983749351528997
Energy: 1.0194973169233146
Energy: 1.0675298354436684
Energy: 1.0374710929037951
Energy: 0.9934093597172932
Energy: 0.9677641050230285
Energy: 1.049667775006188
Energy: 0.9887000351399439
Energy: 1.0017766728034927
Energy: 1.0189698946122425
Energy: 1.092202603593833
Energy: 0.9854381609902169
Energy: 1.0435870795747022
Energy: 1.0205796496712376
Energy: 0.9840319282218383
Energy: 1.019115869317312
Energy: 0.9854512216214364
Energy: 1.0367478915897625
Energy: 1.0865699303592875
Energy: 1.001431854584672
Energy: 1.0016263434772608
Energy: 0.984575297644821
Energy: 1.037560279016384
Energy: 0.9954580890503589
Energy: 1.051531065291895
Energy: 1.121982990867642
Energy: 1.1324351561721517
Energy: 1.0274231185405354
Energy: 1.0130957069005757
Energy: 1.0367195483307288
Energy: 1.0901247616044492
Energy: 1.1539855576843487
Energy: 1.0616883525726526
Energy: 1.1484349713848687
Energy: 1.0986063944901538
Energy: 1.000738661717167
Energy: 1.0274707044689557
Energy: 1.2133492938945245
Energy: 1.132781071679664
Energy: 1.1395078792438347
Energy: 1.0649961775906527
Energy: 1.123274624318662
Energy: 1.2067453356034183
Energy: 1.0043449169859138
Energy: 1.1097932777342152
Energy: 1.0456326632356934
Energy: 1.1686933661992047
Energy: 1.0401730560833082
Energy: 1.005050123731519
Energy: 1.1558084476582202
Energy: 1.0952115073559576
Energy: 1.1201817904280498
Energy: 1.1296182112950524
Energy: 1.1688580937655089
Energy: 1.1843525759537992
Energy: 1.0022189431184223
Energy: 1.2336981404966982
Energy: 1.188417690304016
Energy: 1.2132486344548858
Energy: 1.1577405284188176
Energy: 1.1291506603510408
Energy: 1.0784733265671416
Energy: 1.0944657623396892
Energy: 1.0965451551933163
Energy: 1.0022287854695753
Energy: 1.0921667636742722
Energy: 1.0645202725200165
Energy: 1.0675524503846283
Energy: 1.1278024540575355
Energy: 1.026814100658576
Energy: 1.324422978387547
Energy: 1.0949771879577144
Energy: 1.0776060665984557
Energy: 1.1386541323576127
Energy: 1.2081684124567351
Energy: 1.2162295572140935
Energy: 1.2073012819963216
Energy: 1.1486871005449115
Energy: 1.0189034353449926
Energy: 1.145627035622243
Energy: 1.0719453655207096
Energy: 1.0558628210188876
Energy: 1.0781635817338018
Energy: 1.0514399352180062
Energy: 0.9886689828406728
Energy: 1.0189158098958975
Energy: 1.088711247196037
Energy: 1.1079695560167262
Energy: 1.0361942417635523
Energy: 0.9761138546058807
Energy: 1.0969994095016693
Energy: 1.0014533954279785
Energy: 1.0028492986857482
Energy: 1.066039206340479
Energy: 1.066605847922995
Energy: 1.0749519134946544
Energy: 0.976608097515621
Energy: 1.0238654234926576
Energy: 1.0613862554481355
Energy: 1.0021429410734588
Energy: 0.9824007640268443
Energy: 1.1087865293141193
Energy: 1.0584840265926614
Energy: 1.002246691466526
Energy: 1.0016465999092667
Energy: 0.9826374016613381
Energy: 1.0291260852148054
Energy: 0.995342726897427
Energy: 1.05124240617587
Energy: 1.0690401552404318
Energy: 1.0698602179045429
Energy: 1.0182083052001731
Energy: 1.0013108998083824
Energy: 1.0365508987370569
Energy: 1.2229976576636412
Energy: 1.059528578379303
Energy: 1.2171429861271459
Energy: 1.132228738715007
Energy: 1.0989953703676958
Energy: 1.058969268000427
Energy: 1.0187092363465449
Energy: 1.2075119525654068
Energy: 1.1324704438005375
Energy: 1.0512541285807897
Energy: 1.1306393590811235
Energy: 1.1412362024239486
Energy: 1.0087090904946647
Energy: 1.1585819696444426
Energy: 1.1454219621149495
Energy: 1.2194055323305828
Energy: 1.2286533191123732
Energy: 1.1017075782903374
Energy: 1.1567855994945264
Energy: 1.0200423615871976
Energy: 1.2169493528216178
Energy: 1.169242881377943
Energy: 1.076844496017117
Energy: 1.132813780328096
Energy: 1.0029856084348898
Energy: 1.001820451155193
Energy: 1.2327387746275296
Energy: 1.0022292327386475
Energy: 1.0973336920265628
Energy: 1.1686082242940004
Energy: 1.1975615538922022
Energy: 1.1016108822960056
Energy: 1.1559872056204332
Energy: 1.317589054207023

minimum gb energy = 0.9677641050230285 eV
minimum distance =  2.05628979850273 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.181927496737424
Energy: 1.398941185911024
Energy: 1.2514851816099828
Energy: 1.1961563156090105
Energy: 1.2290277443948199
Energy: 1.2327276755950929
Energy: 1.1857333956052922
Energy: 1.2637823629288578
Energy: 1.194931748934622
Energy: 1.2454801432756473
Energy: 1.276822982632891
Energy: 1.2490048295209535
Energy: 1.2696060342941122
Energy: 1.3490253660914038
Energy: 1.2244630792412288
Energy: 1.1830999062733987
Energy: 1.1970389415836045
Energy: 1.1966239544236588
Energy: 1.199523328749078
Energy: 1.1756416990740937
Energy: 1.1864202721854071
Energy: 1.1871329120702958
Energy: 1.131970189993169
Energy: 1.1801567252877152
Energy: 1.142549807162351
Energy: 1.2166448747135654
Energy: 1.1804493665795772
Energy: 1.276290227808368
Energy: 1.1477350326851983
Energy: 1.1633490364000836
Energy: 1.1975044074309604
Energy: 1.127307209531981
Energy: 1.124610192015029
Energy: 1.1555107354646703
Energy: 1.1420560865520446
Energy: 1.066552113792195
Energy: 1.0982801435656144
Energy: 1.1298598815037486
Energy: 1.11237301270869
Energy: 1.0676918468899703
Energy: 1.1196427854396909
Energy: 1.136527517999533
Energy: 1.1162070670281932
Energy: 1.122558393374952
Energy: 1.1768733706866084
Energy: 1.090202227063709
Energy: 1.135673236155448
Energy: 1.1556332709932684
Energy: 1.2084975296140945
Energy: 1.099940153270349
Energy: 0.9566425176175112
Energy: 1.0437437755292196
Energy: 1.1829309365399931
Energy: 1.1809052363243406
Energy: 1.1110790491026787
Energy: 1.0155477427777466
Energy: 1.0980472724644539
Energy: 1.0272485517803969
Energy: 1.202321706714181
Energy: 1.0575336533187207
Energy: 1.1410449664635058
Energy: 1.192799724296254
Energy: 1.1723719177471497
Energy: 1.1417705210889315
Energy: 1.1769770997893547
Energy: 1.082774029463911
Energy: 1.014023353147214
Energy: 0.9831144363627918
Energy: 1.1921533038464422
Energy: 1.0808039606663415
Energy: 1.1434689716157023
Energy: 1.0689270057076128
Energy: 1.2035849453434753
Energy: 1.0299210259895868
Energy: 1.0707874914947315
Energy: 1.0826839792467995
Energy: 1.0070526655379657
Energy: 1.087592297048874
Energy: 1.0077208908645103
Energy: 1.1938663569710852
Energy: 1.0861475164675363
Energy: 1.1326780932972529
Energy: 1.160065668130707
Energy: 1.08623126107692
Energy: 1.173100947259664
Energy: 0.9593282103862029
Energy: 1.0461042308819213
Energy: 1.1647292062883006
Energy: 1.1906805407315486
Energy: 1.1849266979269937
Energy: 0.9750687551624792
Energy: 1.186191434744891
Energy: 1.1047460581682667
Energy: 1.0630683747571614
Energy: 1.1067205379877898
Energy: 1.044644928468698
Energy: 1.1009279741867861
Energy: 1.1689928131591703
Energy: 1.0790470175289424
Energy: 1.1378538756804928
Energy: 1.158846524980818
Energy: 1.0425718595582918
Energy: 1.0974668098874683
Energy: 1.0775207172572694
Energy: 1.11434761899637
Energy: 1.1489084243075545
Energy: 1.0834200319966474
Energy: 1.2070850887550597
Energy: 1.1584735988834536
Energy: 1.1362252963208188
Energy: 1.1357239822357077
Energy: 1.066955877640878
Energy: 1.106913032582374
Energy: 1.0573860393333594
Energy: 1.1609795996397658
Energy: 1.2253608154933522
Energy: 1.1842158021793938
Energy: 1.1830087506017164
Energy: 1.1022911453298605
Energy: 1.1165576992586788
Energy: 1.109450475938113
Energy: 1.1762119109993516
Energy: 1.1372439649596282
Energy: 1.1603624882415142
Energy: 1.1825821269806156
Energy: 1.1558946773813024
Energy: 1.2300426945431735
Energy: 1.1409925153111597
Energy: 1.1614427530307052
Energy: 1.2338678564116194
Energy: 1.240224200414093
Energy: 1.2510840988951049
Energy: 1.2302053937889275
Energy: 1.1897468277088028
Energy: 1.2519312986291908
Energy: 1.1885009692196427
Energy: 1.1683375501400024
Energy: 1.2182466254567084
Energy: 1.2027712870729483
Energy: 1.2971863527532195
Energy: 1.2136638650932756
Energy: 1.3105301922736352
Energy: 1.0961477214410293
Energy: 1.1114917660841848
Energy: 1.118241681111196
Energy: 1.1832555472509303
Energy: 1.3585224174403918
Energy: 1.2647247608104446
Energy: 1.2776578487336243
Energy: 1.1131456411182894
Energy: 1.2482245664060125
Energy: 1.1187066311844636
Energy: 1.1599987058301702
Energy: 1.2452669368832807
Energy: 1.177600738912357
Energy: 1.2786384472375585
Energy: 1.2519638070129795
Energy: 1.1972589970465377
Energy: 1.229965845314521
Energy: 1.2330771256922615
Energy: 1.2772969333860533
Energy: 1.2860576220442175
Energy: 1.1956049998498322
Energy: 1.241928858922077
Energy: 1.2155871718855953
Energy: 1.274758926508022
Energy: 1.2714163695864718
Energy: 1.3484278637171718
Energy: 1.1180880584169668
Energy: 1.2152953218195295
Energy: 1.1960663344291649
Energy: 1.1927623762980748
Energy: 1.1774549633605063
Energy: 1.174844845851755
Energy: 1.2406726587331984
Energy: 1.1871449154272082
Energy: 1.1138826606759258
Energy: 1.1786240960744252
Energy: 1.2494930236243769
Energy: 1.2387311982186289
Energy: 1.1817045675665674
Energy: 1.210917243795048
Energy: 1.1572629293000996
Energy: 1.1622933793263117
Energy: 1.1961278096866081
Energy: 1.127461843699187
Energy: 1.1513831552176486
Energy: 1.1879181640098264
Energy: 1.1432131864455657
Energy: 1.0702889002131777
Energy: 1.1657121757154316
Energy: 1.0907129914483968
Energy: 1.1112797821081077
Energy: 1.0501369283239155
Energy: 1.1205528382365546
Energy: 1.1193179038870005
Energy: 1.1380915488510581
Energy: 1.1231227133396313
Energy: 1.0992840804576445
Energy: 1.1419602994419895
Energy: 1.1378718182148537
Energy: 1.1571105778357336
Energy: 1.2054401461762163
Energy: 1.1826618162411886
Energy: 0.9556131442401987
Energy: 1.0460995077468191
Energy: 1.2189402238469438
Energy: 1.1856533025211644
Energy: 1.1022864649205706
Energy: 1.0166151203468896
Energy: 1.056227707055541
Energy: 1.0264800709477866
Energy: 1.1890411330518096
Energy: 1.0002824678147042
Energy: 1.1341098230997868
Energy: 1.1953717428173396
Energy: 1.0819430538810408
Energy: 1.1820790824125784
Energy: 1.1773244253699047
Energy: 1.201628860475689
Energy: 1.0119948174842535
Energy: 0.9866614470713553
Energy: 1.1632294550485243
Energy: 1.0458392767806002
Energy: 1.1423758214795805
Energy: 1.0739017975123188
Energy: 1.16362620800383
Energy: 1.029283339802542
Energy: 1.0698968655778638
Energy: 1.2275650281995707
Energy: 1.0649941902385571
Energy: 1.109641670404703
Energy: 1.1059586698415964
Energy: 1.1963043526977906
Energy: 1.0861437844690849
Energy: 1.1628596078424807
Energy: 1.1602513102943193
Energy: 1.0861800799141974
Energy: 1.1728428705849026
Energy: 0.9595677015937851
Energy: 1.047886695280595
Energy: 1.1249329245186923
Energy: 1.151291855632963
Energy: 1.0909085349803402
Energy: 0.9742411816777378
Energy: 1.1712541845632356
Energy: 1.1024709653159586
Energy: 1.062024178596055
Energy: 1.1058172053436006
Energy: 1.0380035155699725
Energy: 1.0998583331919656
Energy: 1.0608661337427256
Energy: 1.0783728478029775
Energy: 1.1461334855951224
Energy: 1.1597902644028169
Energy: 1.0432005181116293
Energy: 1.0757455139410472
Energy: 1.0773252279178698
Energy: 1.1131175323546603
Energy: 1.1485470681684053
Energy: 1.0734978324877158
Energy: 1.2115854913845954
Energy: 1.1102829539158972
Energy: 1.1185933281665015
Energy: 1.1358087684246034
Energy: 1.1110097962016932
Energy: 1.138147896531219
Energy: 1.0587122294250992
Energy: 1.1606913975948847
Energy: 1.2254686553753944
Energy: 1.183448413174403
Energy: 1.1284078325515527
Energy: 1.0892933276443753
Energy: 1.1171188287439446
Energy: 1.108977540669313
Energy: 1.1356423864493357
Energy: 1.1923367097305297
Energy: 1.1807010557448008
Energy: 1.1851931329226906
Energy: 1.154320440210623
Energy: 1.2123983907838887
Energy: 1.1405746623140618
Energy: 1.2378148730465146
Energy: 1.2359851282832044
Energy: 1.218134711312742
Energy: 1.2804158496720799
Energy: 1.229737122818021
Energy: 1.1903482930921248
Energy: 1.2680681025873533
Energy: 1.1876820031774722
Energy: 1.195684381356486
Energy: 1.1923741224150781
Energy: 1.2173918378174036
Energy: 1.2743004891695078
Energy: 1.2029876685845333
Energy: 1.3118252982494862
Energy: 1.096649943969439
Energy: 1.2016963059705406
Energy: 1.1189258999881109
Energy: 1.1739048130636855
Energy: 1.3564774638391528
Energy: 1.255805022248519
Energy: 1.2792730140140078
Energy: 1.1127716872579458
Energy: 1.2560615447903851
Energy: 1.1210014472246437
Energy: 1.182473398013638
Energy: 1.3583352616549988
Energy: 1.1767493004822627
Energy: 1.2510347825468804
Energy: 1.2529227165934218
Energy: 1.1825941109081939
Energy: 1.2303778997198118
Energy: 1.233961546835174
Energy: 1.2607011825202235

minimum gb energy = 0.9556131442401987 eV
minimum distance =  2.1265648956406 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.0553030839703474
Energy: 1.201348651330723
Energy: 1.0123296001240933
Energy: 1.0079139417646346
Energy: 1.0078799085777026
Energy: 1.0106412741480604
Energy: 1.0107389733873904
Energy: 1.001718823449861
Energy: 1.2041249942872356
Energy: 0.9981254271911961
Energy: 1.0034226871424168
Energy: 1.0038647996210688
Energy: 0.998245428664458
Energy: 1.206725779870826
Energy: 1.0034703730458956
Energy: 1.2015793158294386
Energy: 1.0068800978869243
Energy: 1.0002744512462391
Energy: 0.9999743239476774
Energy: 1.00289509971243
Energy: 1.0009202108642912
Energy: 1.0046138617331526
Energy: 1.2038232345881756
Energy: 1.0028791703705873
Energy: 0.999538474010672
Energy: 0.9992555896823718
Energy: 1.0012769035835603
Energy: 1.0011193378362093
Energy: 1.0000446176524336
Energy: 1.2017615643501791
Energy: 0.9998051709327215
Energy: 1.2039602395120215
Energy: 0.9988287740514995
Energy: 0.999725605137097
Energy: 1.212737023845203
Energy: 1.0046203114744028
Energy: 1.1934120692794015
Energy: 1.0035214728039097
Energy: 1.0058539871684602
Energy: 1.0072667584341393
Energy: 1.0021557020293053
Energy: 1.0099609860008572
Energy: 1.0030234414927468
Energy: 1.2078255977172268
Energy: 1.0031975129744395
Energy: 1.0028171979558913
Energy: 1.0033479696750995
Energy: 1.002265406199887
Energy: 1.2093976327464193
Energy: 1.0033121179393256
Energy: 1.2078742770459985
Energy: 1.0036442689931593
Energy: 1.0030607236215394
Energy: 1.0030146318086597
Energy: 1.0022400893696837
Energy: 1.2089942708737107
Energy: 1.006472985153568
Energy: 1.1902074994097656
Energy: 1.0027536727222257
Energy: 1.0015938383797431
Energy: 0.9999815794922344
Energy: 1.0010318930765487
Energy: 1.0093597986970597
Energy: 1.04675910918773
Energy: 1.2019956081872
Energy: 0.9996591105903871
Energy: 1.2028529022503214
Energy: 1.2025040946862964
Energy: 1.0004281425222161
Energy: 1.2017037157793196
Energy: 1.0055219928431223
Energy: 1.2143077463885148
Energy: 1.002375517723901
Energy: 1.0003647517040748
Energy: 0.999097858022945
Energy: 1.0010741917136659
Energy: 1.007820602111508
Energy: 1.0038667215668815
Energy: 1.2090662489345398
Energy: 1.008048148905361
Energy: 1.0029718709537645
Energy: 1.0035114392872362
Energy: 1.0022114632721981
Energy: 1.207798687328484
Energy: 1.0032611924870407
Energy: 1.2085601958262577
Energy: 1.0037816276483946
Energy: 1.0029039082575744
Energy: 1.0038888607770695
Energy: 1.0026857909089497
Energy: 1.2095084919549437
Energy: 1.0045127830536464
Energy: 1.2094078791102225
Energy: 1.0043544953234047
Energy: 1.007759102764929
Energy: 1.0082382318063363
Energy: 1.0033443526911796
Energy: 1.0106253206174665
Energy: 1.000538882412573
Energy: 1.2067648724368054
Energy: 0.9998920567873611
Energy: 1.0183025942389428
Energy: 0.9988685410021694
Energy: 0.9979040533817838
Energy: 1.2021804039828938
Energy: 1.004110148593614
Energy: 1.2009147028454918
Energy: 1.0052626576695327
Energy: 0.9997666996545822
Energy: 0.9994056644868591
Energy: 1.0015799422793987
Energy: 1.0025485678648334
Energy: 1.003757042486825
Energy: 1.2004784269848323
Energy: 1.006430658628095
Energy: 0.9996526687743478
Energy: 0.9998659807530067
Energy: 1.0022463515387654
Energy: 1.0019032193333754
Energy: 1.0006629251144705
Energy: 1.2060554774284102
Energy: 0.9983029278531397
Energy: 1.0041745921891112
Energy: 1.0024184002332832
Energy: 0.9982131039130623
Energy: 1.2024962180685883
Energy: 1.0050252321016238
Energy: 1.2097978766735011
Energy: 1.0113111646120525
Energy: 1.0078663668604932
Energy: 1.007652383956761
Energy: 1.0113366568898112
Energy: 1.0104421106839778
Energy: 1.0033893455719238
Energy: 1.209220853526011
Energy: 0.9985270180342611
Energy: 1.0031510572607603
Energy: 1.0037203809233521
Energy: 1.0032513020691232
Energy: 1.210727756891216

minimum gb energy = 0.9979040533817838 eV
minimum distance =  2.17120758956577 Angstroms
sigma value = 23