Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_380272712420_001
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315671682358
cohesive_energy=3.5402784386331616
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.91030724425088e-19, 2.5288755991056e-19, 2.99259358228422e-19, 3.36904100420886e-19, 3.6864161736379197e-19, 3.9597955726973396e-19, 4.19835967349994e-19, 4.4082287907876e-19, 4.593760845004799e-19, 4.758192232952219e-19, 4.90397428487988e-19, 5.033077678047599e-19, 5.1471045890893795e-19, 5.24735278107876e-19, 5.33491173412686e-19, 5.410710710681399e-19, 5.475550799059379e-19, 5.53012093521342e-19, 5.57504596803078e-19, 5.610854615800679e-19, 5.638011509746979e-19, 5.65694923756086e-19, 5.66806834340082e-19, 5.67170528436e-19, 5.6677799516067e-19, 5.655042647366399e-19, 5.63182710793974e-19, 5.59617867783324e-19, 5.54571011386224e-19, 5.47753749808554e-19, 5.388184107207359e-19, 5.273404173147599e-19, 5.12797460007942e-19, 4.945454637934139e-19, 4.717801360009079e-19, 4.4349851405754e-19, 4.0842846971591395e-19, 3.6495180457568995e-19, 3.1097928030613195e-19, 2.43793605335976e-19, 1.5981119118795419e-19, 5.42423308147236e-20, -7.94106031229028e-20, -2.50130213923446e-19, -4.70544857816094e-19, -7.588629518109299e-19, -1.1419770307096438e-18, -1.6608483423370797e-18, -2.38014554217138e-18, -3.40648387214544e-18, -4.925090972915999e-18, -7.279890080737499e-18, -1.1166866725419539e-17, -1.81677217235796e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.015462999950957
Energy: 0.02013959088627831
Energy: 0.11046302416962038
Energy: 0.11054336281926402
Energy: 0.019286726994713402
Energy: 0.016707719353594216
Energy: 0.109751189269861
Energy: 0.10914402179515624
Energy: 0.11004591594188809
Energy: 0.01849211821807081
Energy: 0.01574600162402372
Energy: 0.10924855769983823
Energy: 0.10993471219914751
Energy: 0.7251849895965252
Energy: 0.11128428696407838
Energy: 0.10959244079928919
Energy: 0.10938420430272915
Energy: 0.10944205551262166
Energy: 0.7232467009249129
Energy: 0.11105361348620656
Energy: 0.11162964914073628
Energy: 0.016246323521551156
Energy: 0.015836020795776378
Energy: 0.1093535101076114
Energy: 0.7241835457401938
Energy: 0.11106686773742622
Energy: 0.018607057510014086
Energy: 0.015757258566674787
Energy: 0.10917845326192901
Energy: 0.7286952330042963
Energy: 0.7325367929231166
Energy: 0.01696074542313538
Energy: 0.016860497867890914
Energy: 0.10902323481007864
Energy: 0.10932069245189131
Energy: 0.10921769843067622
Energy: 0.01658000191061705
Energy: 0.015990464075673193
Energy: 0.10880600157266761
Energy: 0.10955945785841496
Energy: 0.7353077624953193
Energy: 0.10992179892378048
Energy: 0.11218282838952386
Energy: 0.017193227721280936
Energy: 0.016491731450085766
Energy: 0.7285602571073688
Energy: 0.11164400955795002
Energy: 0.11162399016002837
Energy: 0.01800909050467778
Energy: 0.10886410490721721
Energy: 0.11216739338153998
Energy: 0.7227364902602912
Energy: 0.11037516584602124
Energy: 0.016556239843764316
Energy: 0.015682133473225737
Energy: 0.11095519048901338
Energy: 0.7205898491677644
Energy: 0.11077466470994103
Energy: 0.017111083603636425
Energy: 0.015715956014965473
Energy: 0.01576303168854952
Energy: 0.11204366831987589
Energy: 0.7258206965617535
Energy: 0.11092351625385902
Energy: 0.11226169179735268
Energy: 0.015729315756090805
Energy: 0.1128292828532415
Energy: 0.7308612709333977
Energy: 0.11029317803255033
Energy: 0.11280257323994797

minimum gb energy = 0.015462999950957 eV
minimum distance =  2.51970578507993 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 1.2219991135373618
Energy: 1.0879889309821416
Energy: 0.9771977440425804
Energy: 0.9786108384941801
Energy: 1.0817802069363367
Energy: 1.1860008600942151
Energy: 1.048197891224194
Energy: 0.9782497812733252
Energy: 0.9767960108609102
Energy: 1.0852817070473584
Energy: 1.0753739108747862
Energy: 1.2921011443410784
Energy: 0.9886547258358164
Energy: 0.8707276671215132
Energy: 1.025719742540816
Energy: 1.261373727705402
Energy: 1.241511615377166
Energy: 0.988934584362774
Energy: 0.8722978463725322
Energy: 1.0245116329315185
Energy: 0.9803507320340055
Energy: 1.4388188908024155
Energy: 1.517605298933656
Energy: 1.0026904298648942
Energy: 0.9820966684689548
Energy: 0.9041046243062538
Energy: 1.4381496949204267
Energy: 1.5097235905977926
Energy: 0.9974298945311567
Energy: 0.9848128507324723
Energy: 0.979526382540597
Energy: 1.0032953937438827
Energy: 1.4280387295762857
Energy: 1.1505228839939672
Energy: 0.9775351897174483
Energy: 0.9891885207809381
Energy: 0.9813738701009068
Energy: 1.4309531032158453
Energy: 1.1965434692590504
Energy: 0.9789444091181818
Energy: 1.2391988611342983
Energy: 1.2197701590953585
Energy: 1.1904886510525947
Energy: 1.3378808022121904
Energy: 1.2319581727940307
Energy: 1.31732208617622
Energy: 1.1098620191144135
Energy: 1.1633536109907652
Energy: 1.3370321741187212
Energy: 1.214266645712941
Energy: 1.112164627579111
Energy: 1.2260573661633425
Energy: 1.14263335239726
Energy: 1.169454111158976
Energy: 1.2899897632664834
Energy: 1.2247220051895993
Energy: 1.2345348367095446
Energy: 1.1334683203214893
Energy: 1.3434934499210909
Energy: 1.2829155273160227
Energy: 1.0318267901505809
Energy: 1.2221917696144755
Energy: 1.3877318785729986
Energy: 1.0734932046535341
Energy: 1.0309428473468805
Energy: 1.0261607782516862
Energy: 1.1946115412827887
Energy: 1.4587610486299232
Energy: 1.0917268058596712
Energy: 1.0447152116151326
Energy: 1.01926430907001
Energy: 1.041309818071505
Energy: 1.1673830905361882
Energy: 1.1454479708576637
Energy: 1.0349368767311127
Energy: 1.0199010775211932
Energy: 1.0309999841289377
Energy: 1.1565401142074094
Energy: 1.1425763266962663
Energy: 1.0254599671217368
Energy: 1.0223644656424218
Energy: 0.9447729667373085
Energy: 1.0813679048488483
Energy: 1.4006227995022666
Energy: 1.0410393756012541
Energy: 1.0208705063278496
Energy: 0.9695186323436646
Energy: 1.0328394611391725
Energy: 1.402415469921289
Energy: 1.080863995671015
Energy: 1.1564373449415222
Energy: 1.013097699295136
Energy: 0.8872073526658493
Energy: 0.9609708969178314
Energy: 1.4424659362054995
Energy: 0.9664343263324562
Energy: 1.0131793951193448
Energy: 0.9006561078541515
Energy: 0.958145689779848
Energy: 1.5149688234091419
Energy: 1.2335628088678465
Energy: 0.9710948411448549
Energy: 0.9969254814140239
Energy: 0.942016769429308
Energy: 1.4399637786154407
Energy: 1.4354102117907228
Energy: 0.9150234430860457
Energy: 0.9976029609359832
Energy: 0.9620459138245534
Energy: 1.4378526092798756
Energy: 1.2962866680705314
Energy: 1.014248232007507
Energy: 1.2523830106473743
Energy: 1.1880244236899038
Energy: 1.236677212469013
Energy: 1.3111769994351108
Energy: 0.8565678559241937
Energy: 1.29278824067694
Energy: 1.169792101111825
Energy: 1.1651976355225606
Energy: 1.1226763688839705
Energy: 1.3431155564350714
Energy: 1.2071467154867095
Energy: 1.2285901234298218
Energy: 1.1847616170125082
Energy: 1.1187627476154138
Energy: 1.3167796974112984
Energy: 1.1406579198686122
Energy: 1.2254728090594216
Energy: 1.1174503401000695
Energy: 1.1625788239381325
Energy: 1.0739146100313126
Energy: 1.0866315822702002
Energy: 1.2372280922109482
Energy: 1.358279357558857
Energy: 1.1634440794509828
Energy: 1.2492571768483967
Energy: 1.0773450052784694
Energy: 1.2364183404632734
Energy: 1.3599768043556224
Energy: 1.116547961896748
Energy: 1.1707322064308356
Energy: 1.051911185772046
Energy: 1.0483123099921487
Energy: 1.16902375159322
Energy: 1.1178223835831702
Energy: 1.1718806685934684
Energy: 1.0497110776186203
Energy: 1.0493509302832127
Energy: 1.162911509747213
Energy: 1.1979038972948177
Energy: 1.4104185100210302
Energy: 1.1156304933100962
Energy: 0.9580927337203706
Energy: 0.8428893971519823
Energy: 1.5246389053867717
Energy: 1.402991333456206
Energy: 1.0533007174994797
Energy: 0.9556942169915633
Energy: 0.8407541198623341
Energy: 0.8974080266623354
Energy: 1.4376048663509418
Energy: 1.1174761551453527
Energy: 1.0084861862936005
Energy: 1.0060629994817867
Energy: 0.8972598141612018
Energy: 1.437857695759517
Energy: 1.116900073398911
Energy: 1.007298068180796
Energy: 1.0035045580950186
Energy: 0.9645141140208088
Energy: 1.248150823664116
Energy: 1.433265730641677
Energy: 0.8366725963753202
Energy: 0.8776660574573498
Energy: 0.9713017866278225
Energy: 1.2403429703921185
Energy: 1.43304637880916
Energy: 0.8374724156900253
Energy: 0.8772031258512551
Energy: 1.0323517942187765
Energy: 1.0651322133621992
Energy: 1.1062556166440323
Energy: 1.3366655185188896
Energy: 1.2253813984635993
Energy: 1.0177609900081956
Energy: 1.067634932155987
Energy: 1.3002518083158572
Energy: 1.3377269650297663
Energy: 1.226318808355367
Energy: 1.1146812630823186
Energy: 1.225412796355573
Energy: 1.1490959997150656
Energy: 1.2337056845843042
Energy: 1.3007912209054306
Energy: 1.2389487432783992
Energy: 1.2276488997538981
Energy: 1.131944367612418
Energy: 1.0086668055876091
Energy: 1.3234741342711882
Energy: 1.1613113909156223
Energy: 1.2208734104009298
Energy: 1.3152202078434017
Energy: 1.0948180605974913
Energy: 1.17376493069311
Energy: 1.1480556454212951
Energy: 1.1779579312893507
Energy: 1.4681837272585982
Energy: 1.082297392428105
Energy: 1.1718009075033864
Energy: 1.0167138079597187
Energy: 1.0414450427191464
Energy: 1.421162626904325
Energy: 1.1448357563697942
Energy: 1.0434582778983434
Energy: 1.0169680975813131
Energy: 1.040587232955545
Energy: 1.4066295832313833
Energy: 1.1443256197759073
Energy: 1.0296902457778287
Energy: 1.031490696752673
Energy: 0.9802536799754203
Energy: 1.0384724927730042
Energy: 1.4001977206465968
Energy: 1.0982255036297006
Energy: 1.0289013246970344
Energy: 0.9682489141134295
Energy: 1.0344972913216064
Energy: 1.3950869183955275
Energy: 1.0764774479064574
Energy: 1.0273951050091017
Energy: 1.0350300934087162
Energy: 0.8923223184039347
Energy: 1.019453537826937
Energy: 1.4332160631593125
Energy: 1.0629451237828047
Energy: 1.0341515630980178
Energy: 0.9002252808494906
Energy: 1.3437195475666217
Energy: 1.4487481387326995
Energy: 1.20574981180372
Energy: 0.9436011846246628
Energy: 0.9962939722147706
Energy: 0.9774543341797495
Energy: 1.4345520508112029
Energy: 1.4011674934647955
Energy: 0.9417263730869425
Energy: 0.9816950044175673
Energy: 1.0108048188984184
Energy: 1.4325837289870689
Energy: 1.3575390424353098
Energy: 1.0510971181989888
Energy: 1.0936929648808833
Energy: 1.1999422884692708
Energy: 1.1277070861780125
Energy: 1.3014795618749326
Energy: 1.1817487797829493
Energy: 1.014436283507537
Energy: 1.2111387138426235
Energy: 1.106145012367951
Energy: 1.1692719860393748
Energy: 1.006388683069616
Energy: 1.1915848717748547
Energy: 1.2271129955495952
Energy: 1.1592281922325847
Energy: 1.0919733633889277
Energy: 1.3201677672815295
Energy: 1.1570480680677104
Energy: 1.224141506380837
Energy: 1.137303112501926
Energy: 1.1520520824187
Energy: 1.1458001112703153
Energy: 0.9831399090434336
Energy: 1.0868795571388206
Energy: 1.3791582651445233
Energy: 1.0830513402966946
Energy: 1.1887235700554912
Energy: 0.9927883070481941
Energy: 1.0824571807054661
Energy: 1.1668782586037616
Energy: 1.2254391348793618
Energy: 1.070371682624884
Energy: 0.9817240639283341
Energy: 0.9790551553071493
Energy: 1.0556376655423945
Energy: 1.1900449748746245
Energy: 1.0503514832514382
Energy: 0.9813676606499144
Energy: 0.978867050614821
Energy: 1.0781391420608797

minimum gb energy = 0.8366725963753202 eV
minimum distance =  2.27198002987083 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.62819055033571
Energy: 1.2306979304518906
Energy: 1.2115120767167908
Energy: 1.212873592513176
Energy: 1.1611966587055715
Energy: 1.5167212740261062
Energy: 1.1605204396987223
Energy: 1.2151205425950087
Energy: 1.2159794985548682
Energy: 1.2190738967951174
Energy: 1.3069227493039466
Energy: 1.1817347617619511
Energy: 1.0283768417718093
Energy: 1.0126712594629848
Energy: 1.0309230228962913
Energy: 1.3616268988996174
Energy: 1.0703132319902608
Energy: 1.052877698062533
Energy: 1.0777941968339086
Energy: 1.0739023437403958
Energy: 1.1773921964170677
Energy: 1.206336661835958
Energy: 1.2056167955114814
Energy: 1.0562895728488815
Energy: 1.047351767580054
Energy: 1.017328389263748
Energy: 1.2059483365765356
Energy: 1.205746854321031
Energy: 1.1315482790343534
Energy: 1.0340174520310905
Energy: 1.0069376724127517
Energy: 1.2701108187843586
Energy: 1.1561198545162827
Energy: 1.2620040501249667
Energy: 1.0254984858211125
Energy: 0.9766946691573548
Energy: 1.2587288316087462
Energy: 1.0450909354442546
Energy: 1.0910408639588791
Energy: 1.0257367401841515
Energy: 1.0568972146701814
Energy: 1.2560516455300563
Energy: 1.2289124398205222
Energy: 1.2381574057804368
Energy: 1.0423412408656076
Energy: 1.2593202339458487
Energy: 1.25578154684435
Energy: 1.2395561413984655
Energy: 1.2070675866487697
Energy: 1.0232116259829396
Energy: 1.0252958929940361
Energy: 1.4961658107293228
Energy: 1.2533856702056745
Energy: 1.2528517062585822
Energy: 1.1971778710219956
Energy: 1.0252880233554416
Energy: 1.493881261571355
Energy: 1.1633844827302375
Energy: 1.2341192244977695
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Energy: 1.0258275572684032
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Energy: 1.0293880969290998
Energy: 1.266343632936224
Energy: 1.06869127499197
Energy: 1.0519328677109352
Energy: 1.2773151634052078
Energy: 1.0320785191804671
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Energy: 1.0226379267649084
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Energy: 1.0384363331977917
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Energy: 1.0363207412626343
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Energy: 1.094925013372737
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Energy: 1.0370141754975921
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Energy: 1.19163780011264
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Energy: 1.1996453069425788
Energy: 1.185519653759378
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Energy: 1.3057411684500877
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Energy: 1.212571880153364
Energy: 1.0594285816422593
Energy: 1.0446292438229186
Energy: 1.2702534224438051
Energy: 1.0542522994591372
Energy: 1.068371245020683
Energy: 1.0776541263761152
Energy: 1.081551865567641
Energy: 1.3231033066822737
Energy: 1.3029017559110572
Energy: 1.0587747325482695
Energy: 0.9793092997781673
Energy: 1.0253032838079628
Energy: 1.1364782816195944
Energy: 1.2054834390035793
Energy: 1.116168831725471
Energy: 1.0425276864876316
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Energy: 1.2079088521472559
Energy: 1.1467768928065383
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Energy: 1.0621879475176264
Energy: 1.0113955774008878
Energy: 1.0434075411122572
Energy: 1.0890538220466475
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Energy: 1.0811247184061947
Energy: 1.020398420271625
Energy: 1.0732850845897621
Energy: 1.090037366263592
Energy: 1.2006041913817997
Energy: 1.2880425526958148
Energy: 1.2828996959558276
Energy: 1.0419844681555668
Energy: 1.2315953445131447
Energy: 1.1931745544718415
Energy: 1.2909210927807082
Energy: 1.2925742895831076
Energy: 1.0303599655021103
Energy: 1.2533406951553119
Energy: 1.2168679927891448
Energy: 1.0282545506400573
Energy: 1.049385550322178
Energy: 1.3006515765650835
Energy: 1.0609748470348266
Energy: 1.2211873688242523
Energy: 1.0419878153160635
Energy: 1.0278579931802374
Energy: 1.2895820765592805
Energy: 1.0434657982498372
Energy: 1.0569577493329971
Energy: 1.0811265464697584
Energy: 1.0369368784919986
Energy: 1.2552102314930829
Energy: 1.2064579884749562
Energy: 1.0802031526794504
Energy: 1.0779494111736636
Energy: 1.0833283133723701
Energy: 1.3188004293944675
Energy: 1.2120226127674956
Energy: 1.0841855646427747
Energy: 1.0256534418501824
Energy: 1.0251821975078241
Energy: 1.1756897465188878
Energy: 1.2059509877384664
Energy: 1.1217578948772768
Energy: 1.0253994258769557
Energy: 1.024944112273927
Energy: 1.189519574437702
Energy: 1.2079729312360787
Energy: 1.224419398130178
Energy: 1.2998676548688108
Energy: 1.0027336195511969
Energy: 1.018785894820612
Energy: 1.0004873843823954
Energy: 1.155515782205819
Energy: 1.0780085605623424
Energy: 1.0860464406904091
Energy: 1.3708057951603567
Energy: 1.0026033072968477
Energy: 1.2087391026235033
Energy: 1.2202619523224747
Energy: 1.2731217027440598
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minimum gb energy = 0.9758233504358121 eV
minimum distance =  2.24778284309798 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 1.1565610954029186
Energy: 1.082148061241251
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Energy: 1.169804823064502
Energy: 1.0299274139563828
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Energy: 1.0493397751023923
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Energy: 1.3126033546872322
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Energy: 1.051183732875418
Energy: 1.050666873793776
Energy: 1.1666372827269988
Energy: 1.4526288305681176
Energy: 1.1806914230316101
Energy: 1.0788897940951225
Energy: 1.0783425819238743
Energy: 1.0288775716813585
Energy: 1.3953865382531392
Energy: 1.215003963225206
Energy: 1.0810882447492647
Energy: 1.0522610468347284
Energy: 1.0288931791908031
Energy: 1.5245285151033605
Energy: 1.1339291238610862
Energy: 1.1686225068604146
Energy: 1.036245879567759
Energy: 1.1870073650549149
Energy: 1.0881846015604035
Energy: 1.1181758757968483
Energy: 1.0737597480187977
Energy: 1.039770381935172
Energy: 1.1922939215732657
Energy: 1.1008778757985842
Energy: 1.0592071750300955
Energy: 1.4152561205597705
Energy: 1.1917197446949932
Energy: 1.1269671288369643
Energy: 1.129162863118961
Energy: 1.3372785991224942
Energy: 1.4157124530199034
Energy: 1.2102673402580735
Energy: 1.127182314720041
Energy: 1.126202867273209
Energy: 1.1388154451172665
Energy: 1.2534949947120617
Energy: 1.0669854582929064
Energy: 1.022757186955222
Energy: 1.2106642271402044
Energy: 1.0996977823721465
Energy: 1.0582237451619496
Energy: 1.0386552655157242
Energy: 1.1784256699496662
Energy: 1.1939346456915285
Energy: 1.5324941029699133
Energy: 1.008469669123044
Energy: 0.9752119176949591
Energy: 0.9761862507172528
Energy: 1.2561066868401793
Energy: 1.520913679098582
Energy: 1.0074821738358228
Energy: 0.9638972923356459
Energy: 0.9655884272302926
Energy: 1.2273696616773981

minimum gb energy = 0.9628605354630447 eV
minimum distance =  2.25536867551306 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.1434840604313774
Energy: 1.004591532412308
Energy: 1.0278311645629787
Energy: 0.9927779106959825
Energy: 1.0025309400760538
Energy: 1.0690339192308602
Energy: 0.9959495493484494
Energy: 1.0168777259033717
Energy: 1.0143751174414697
Energy: 1.003479766732757
Energy: 1.1631658187062452
Energy: 1.102935471240944
Energy: 1.0342588550908762
Energy: 0.9821064498076633
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Energy: 1.221206943010314
Energy: 1.1107650375721525
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Energy: 1.0420951623983779
Energy: 1.1145726909514493
Energy: 0.9781957458977025
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Energy: 1.0040611997509972
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Energy: 1.0658734543852608
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Energy: 1.005956365941201
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Energy: 1.0385718710239042
Energy: 1.067053832507412
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Energy: 1.0898651912945958
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Energy: 1.0392525417650222
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Energy: 1.0677424946746268
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Energy: 1.115078237354508
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Energy: 1.0678617752726784
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Energy: 1.03672377870594
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Energy: 1.103525272812893
Energy: 1.1589774253647953
Energy: 0.9923727226207724
Energy: 0.9910543772603845
Energy: 1.1656005230863136
Energy: 1.0967677296065708
Energy: 1.1424797632986756
Energy: 1.0373654984333056
Energy: 1.005877134319083
Energy: 1.1651256544864446
Energy: 1.1631804797658933
Energy: 1.4449410987458264
Energy: 0.969250398924989
Energy: 0.9888796193362899
Energy: 1.0243145423161397
Energy: 1.163283028873058
Energy: 1.4472256182717305
Energy: 0.9926027982242485
Energy: 1.0064232568421803
Energy: 1.067210284160305
Energy: 0.9693923222367562
Energy: 1.1751211607165681
Energy: 1.0534890084483615
Energy: 0.9076381792098971
Energy: 1.008007107918611
Energy: 1.0172320451072228
Energy: 1.2277887286500244
Energy: 1.0704214814478146
Energy: 0.9117890195924003
Energy: 1.0836032721426305
Energy: 1.1613798444089976
Energy: 1.0498036621742348
Energy: 1.0512602964770488
Energy: 1.0415612065815165
Energy: 1.032738533831484
Energy: 1.1083602553656002
Energy: 0.9975720102750485
Energy: 1.0168313093989438
Energy: 1.0045722720359394
Energy: 1.0764747018141767

minimum gb energy = 0.9076381792098971 eV
minimum distance =  2.29154329564446 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

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Energy: 0.8324885652169414
Energy: 0.8535613904724026
Energy: 0.8111086444382749
Energy: 0.8887818446364552
Energy: 1.553092394522179
Energy: 0.8813628529855534
Energy: 0.83704217524567
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Energy: 1.4053508597299091
Energy: 0.8618924793613457
Energy: 1.0250586690982708
Energy: 0.9032131600409263
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Energy: 0.8210542071565925
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Energy: 0.8774717538441716
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Energy: 0.9111873434963559
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Energy: 1.226626486607538
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Energy: 1.0313656267258555
Energy: 0.9980337297880836
Energy: 0.9242775185105587
Energy: 0.8648738078891912
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Energy: 0.8588538716133379
Energy: 0.9539544909377589
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Energy: 0.8693894600775967
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Energy: 0.9396208695978842
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Energy: 1.267036276781825
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Energy: 0.9501318019981407
Energy: 0.877406264380989
Energy: 0.9297497092226645
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Energy: 0.8619120942245332
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Energy: 0.9040129899537472
Energy: 0.9026729867598291
Energy: 0.8607970252816901
Energy: 0.9096933270102827
Energy: 0.9668019489874428
Energy: 0.9032181530516639
Energy: 0.8921026346963676
Energy: 0.8551603039491344
Energy: 0.8373274757548904
Energy: 0.8348000295580168
Energy: 0.8456567691687183
Energy: 0.8833374724910216
Energy: 0.8523023139037091
Energy: 0.8398906972308434
Energy: 0.8326200347547013
Energy: 0.8317546861258178
Energy: 0.8948390698415284
Energy: 1.4039979643860738
Energy: 0.8571915686105048
Energy: 0.8204489672310882
Energy: 0.8789178096463488
Energy: 0.9047463016372483
Energy: 1.4069526736103846
Energy: 0.9071558191559258
Energy: 0.8396931679987438
Energy: 0.8487382123131805
Energy: 0.8281087302301621
Energy: 0.8989252466230523
Energy: 0.8666981760751316
Energy: 0.854479047493225
Energy: 0.870925656137683
Energy: 0.9334091973093104
Energy: 0.8847951967602757
Energy: 0.840533856126149
Energy: 0.8575494778345342
Energy: 0.8338622619473648
Energy: 0.8668106215018554
Energy: 0.8289010233826318
Energy: 0.8502147211400171
Energy: 0.851235740657424
Energy: 0.8706687521961157
Energy: 0.8554218309456534
Energy: 0.820096444268643
Energy: 0.8367928701858126
Energy: 0.8331266198817326
Energy: 0.9000795806733924

minimum gb energy = 0.8111086444382749 eV
minimum distance =  2.34031439186494 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.7057073983542914
Energy: 1.6214836842091045
Energy: 0.5255662871152073
Energy: 0.4413509006153135
Energy: 0.4411888372884609
Energy: 0.7924120490449335
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Energy: 0.9002499059518538
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Energy: 0.6421774094776512
Energy: 0.7706341563665544
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Energy: 0.6255971016671156
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Energy: 0.4943437972030135
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Energy: 0.6707564671096353
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Energy: 0.5485919658107855
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Energy: 0.40796518233924534
Energy: 0.40757930195924824
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Energy: 0.5915890615988605
Energy: 0.4794542234347801
Energy: 0.47918747597308187
Energy: 0.48779056957625416
Energy: 1.324383407451853
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Energy: 1.85501961645879
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Energy: 1.6252243363514212
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Energy: 0.45858542234677746
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Energy: 1.470550956794982
Energy: 0.8255478427451901
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Energy: 0.5162249487587988
Energy: 0.5620410506862533
Energy: 1.5462976660579935
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Energy: 0.4073843950761665
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Energy: 0.6338822900939044
Energy: 1.4753201528045183
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Energy: 0.6478411947931847
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Energy: 0.798380399560391
Energy: 0.8907353345634323
Energy: 0.5908844928550443
Energy: 0.49510360772138595
Energy: 0.5617361210345526
Energy: 0.6716255540539008
Energy: 0.8219682986753715
Energy: 0.6999991066534904
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Energy: 0.5943808748158299
Energy: 1.7006760746028582
Energy: 0.881146983254396
Energy: 0.6857667863434724
Energy: 0.46522823971075855
Energy: 0.638861093226808
Energy: 1.637484608000675
Energy: 0.841133270736587
Energy: 0.4800332613866897
Energy: 0.4798704023071593
Energy: 0.7047944398016313
Energy: 1.6146578539022103
Energy: 0.616001847645246
Energy: 0.4786426976519024
Energy: 0.4781112425963943
Energy: 0.6225121946813706
Energy: 1.6215790969209583
Energy: 0.7413126227878024
Energy: 0.6644287021256773
Energy: 0.590038553082481
Energy: 0.8355814530983439
Energy: 1.5239123693595156
Energy: 0.6621940223114896
Energy: 0.4830608593357753
Energy: 0.5972453730766476
Energy: 0.7633649258005415
Energy: 0.9815748842969644
Energy: 0.656319568238569
Energy: 0.7039605391179121
Energy: 0.7587138564064823
Energy: 1.6365978602504634
Energy: 0.7972639401297631
Energy: 0.6037095964919129
Energy: 0.45480494303877156
Energy: 0.6218263677427887
Energy: 1.4447608210914638
Energy: 0.8897426915619944
Energy: 0.6924560284818061

minimum gb energy = 0.3970264446584567 eV
minimum distance =  2.38794391934451 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 1.3635540981703356
Energy: 0.7678278116739652
Energy: 0.7794017667644745
Energy: 0.734000493702658
Energy: 0.7458652924592217
Energy: 1.34480612470562
Energy: 0.7577725089092497
Energy: 0.7879112869288537
Energy: 0.7293283955687804
Energy: 0.7633184469795862
Energy: 0.7565167826923854
Energy: 0.7219179984079981
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Energy: 0.7338412163529854
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Energy: 0.7332200077958194
Energy: 0.7291478843591925
Energy: 0.7806912677619342
Energy: 0.7511358709057877
Energy: 0.7175511688455007
Energy: 0.7206360010760766
Energy: 0.7508806215207424
Energy: 0.7434600645647056
Energy: 0.7560433262107893
Energy: 0.7146608319428113
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Energy: 0.737076910506922
Energy: 1.359718087738667
Energy: 0.8410323895307659
Energy: 0.7704682784384563
Energy: 0.776216223489864
Energy: 0.7715777750365362
Energy: 1.1810158595990543
Energy: 0.8411312538840657
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Energy: 0.7749279872523284
Energy: 0.7762661177437403
Energy: 1.4877116089496498
Energy: 0.7549797948994552
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Energy: 0.7663165115062577
Energy: 0.7904823206834605
Energy: 0.7552927346411331
Energy: 0.7746983741538929
Energy: 0.7629984453502324
Energy: 0.7701491302896578
Energy: 0.7835649044944505
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Energy: 0.7543785785184217
Energy: 0.8587842019076678
Energy: 0.9114821867917942
Energy: 0.7820635541736984
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Energy: 0.7509988340965649
Energy: 0.7930360531438617
Energy: 0.877859182871019
Energy: 0.753724271181566
Energy: 0.7512919347842537
Energy: 0.7508580241252556
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Energy: 1.2538929716831064
Energy: 0.9285196490558679
Energy: 0.751154491196403
Energy: 0.7867294485028016
Energy: 0.8963753440591348
Energy: 1.2502039406748655
Energy: 0.7572885042835378
Energy: 0.7513210423151355
Energy: 0.9112792811985855
Energy: 0.7948979594064424
Energy: 1.2157044004904047
Energy: 0.7478988766811648
Energy: 0.7653730081674798
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Energy: 0.7780107246655943
Energy: 0.7478159115952479
Energy: 0.747879324961011
Energy: 0.7654288403468793
Energy: 0.8648825432410308
Energy: 0.8764162632342409
Energy: 0.7485949881341035
Energy: 0.7477975094201422
Energy: 0.7485289807222636
Energy: 0.8605624646256884
Energy: 0.8081127749587306
Energy: 0.7482622463774107
Energy: 0.7478001691789807
Energy: 0.7479774928101227
Energy: 0.7789410683441201
Energy: 0.8522527534587546
Energy: 1.2645251165599993
Energy: 0.8941037142192171
Energy: 0.7434091153333722
Energy: 0.7491214242227239
Energy: 0.7591342504979101
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Energy: 0.7818817174441856
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Energy: 0.8025964598486529
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Energy: 0.8480955068621524
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Energy: 0.750180360813491
Energy: 0.7808883301513735
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Energy: 0.7695621752131394
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Energy: 0.7485814521581862
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Energy: 0.7849634392582281
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Energy: 0.7563407323132991
Energy: 0.7511695572833949
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Energy: 0.7527027891235729
Energy: 0.7873810551487337
Energy: 0.7710324694034618
Energy: 0.8803416921354534

minimum gb energy = 0.705464251485801 eV
minimum distance =  2.3284092969017 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 1.2772478747653155
Energy: 1.0989430375693416
Energy: 1.0485623259768833
Energy: 1.0585501634794707
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Energy: 1.0676696371138628
Energy: 1.0505804364544507
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Energy: 1.0350494389094465
Energy: 1.09946050625111
Energy: 1.1921519425042586
Energy: 1.265196490698716
Energy: 1.0365557157366123
Energy: 1.0441337272956444
Energy: 1.0990305179227438
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Energy: 1.0190818995716184
Energy: 1.069640156291752
Energy: 1.1072967887257128
Energy: 1.0279604250586232
Energy: 1.1227628999621106
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Energy: 1.1456432015605582
Energy: 1.1076182713538942
Energy: 1.0283233912228378
Energy: 1.028859579996657
Energy: 1.028163201451071
Energy: 1.1055679039340989
Energy: 1.0404165588435645
Energy: 1.034998011660532
Energy: 1.0280757858718466
Energy: 1.0283041549578955
Energy: 1.0758643476680438
Energy: 1.035819477725211
Energy: 1.0350329006325258

minimum gb energy = 0.856409233871727 eV
minimum distance =  2.34869238837037 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.4961361616138427
Energy: 1.2609874975920214
Energy: 1.1016075980315507
Energy: 1.0789495361723191
Energy: 1.364117799099792
Energy: 1.4971607532573064
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Energy: 1.1434054135695169
Energy: 1.3859260707304335
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Energy: 1.3342798200202541
Energy: 1.169701826114479
Energy: 1.3718537916314075
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Energy: 1.366168429945806
Energy: 1.3576448740649172
Energy: 1.232944933322448
Energy: 1.420069697822778
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Energy: 1.1571403251218382
Energy: 1.234120327956549
Energy: 1.4179255455925976
Energy: 1.4358212195820863
Energy: 1.1089153134060126
Energy: 1.156370150905718
Energy: 1.2242427365454451
Energy: 1.3349743198142066
Energy: 1.174818051021401
Energy: 1.013741227407758
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minimum gb energy = 1.0000821709616887 eV
minimum distance =  2.28955188069001 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.4003393904622292
Energy: 1.1461257225679913
Energy: 1.0221776124628477
Energy: 1.1083500944971099
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Energy: 1.2716510753815995
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Energy: 1.0236039777930748
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Energy: 1.1040800980496936
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Energy: 1.100973407365556
Energy: 1.0219369605662598
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Energy: 1.102770362852941
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Energy: 1.100267548462793
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Energy: 1.1014473714516304
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Energy: 1.039303958509905
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Energy: 1.0204157033560306
Energy: 1.0361462832194575
Energy: 1.255905094886608
Energy: 1.6607755823607584
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Energy: 1.0348832956186493
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Energy: 1.1362907390708503
Energy: 1.080018776759574
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Energy: 1.2913991810867005
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Energy: 1.3059596178821837
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Energy: 1.02298536600732
Energy: 1.1083439062517613
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Energy: 1.4407201675763874
Energy: 1.0240774153031489
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Energy: 1.1086062074184386
Energy: 1.3600041054250958
Energy: 1.4379675366594873
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Energy: 1.0228070777574474
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Energy: 1.1033457298555451
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Energy: 1.0250675913759426
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Energy: 1.1852499211684542
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Energy: 1.1017668138016707
Energy: 1.2201088369703736
Energy: 1.1927777449013637
Energy: 1.2114092606356073
Energy: 1.1035755500011801
Energy: 1.1027951738725492
Energy: 1.219530900031337
Energy: 1.2647005931479578
Energy: 1.2119420546835247
Energy: 1.1027929769905662
Energy: 1.3568141266314246
Energy: 1.3210080913856117
Energy: 1.2056581540846605
Energy: 1.2234751011714042
Energy: 1.3621013820654884
Energy: 1.2712372851186549
Energy: 1.34918549420232
Energy: 1.3660371057521898
Energy: 1.2912662006410447
Energy: 1.3643138328477966
Energy: 1.1096105899998867
Energy: 1.100716635044525
Energy: 1.1786895435534626
Energy: 1.227875561590317
Energy: 1.3617747471288553
Energy: 1.1528821910938951
Energy: 1.1003299547716792
Energy: 1.1801349018994236
Energy: 1.3346341678800455
Energy: 1.3637375189594165
Energy: 1.0247303583367164
Energy: 1.020798407679388
Energy: 1.102992751990918
Energy: 1.2598571137065095
Energy: 1.1401692673879138
Energy: 1.0249757190788638
Energy: 1.0231992946373045
Energy: 1.103637278184028
Energy: 1.2556918273746913
Energy: 1.1712106062395085
Energy: 1.1342122615464132
Energy: 1.0889911264646903
Energy: 1.1350692845729615
Energy: 1.5636558326205574
Energy: 1.3841711638193728
Energy: 1.0373287214603912
Energy: 1.087477165000238
Energy: 1.136742576442398
Energy: 1.6599887687772568
Energy: 1.3838587538412
Energy: 1.1327315138454368
Energy: 0.9968618423301617
Energy: 1.0251984956675144
Energy: 1.339511149588789
Energy: 1.3058215607017407
Energy: 0.9966670589401495
Energy: 0.9962361580695981
Energy: 1.182617612124955
Energy: 1.339821784878402
Energy: 1.3094310362551616
Energy: 1.179866856357568
Energy: 1.1378050012921526
Energy: 1.2080780729662584
Energy: 1.2645761834215241
Energy: 1.3045870411619953
Energy: 1.266926506358745
Energy: 1.1377057826068568
Energy: 1.207875474941455
Energy: 1.2653172271877393
Energy: 1.3049438677379022
Energy: 1.359998086076144
Energy: 1.3466169096274772
Energy: 1.2545465380595464
Energy: 1.1016481287611986
Energy: 1.1727883079936474
Energy: 1.3589914487894443
Energy: 1.2172814146564481
Energy: 1.1963472235982795
Energy: 1.1386741371092965
Energy: 1.148657344838741

minimum gb energy = 0.9948652873600565 eV
minimum distance =  2.31022446832337 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.9056991381335892
Energy: 0.9109952491923815
Energy: 1.022961245889517
Energy: 1.335426589530058
Energy: 0.9109580416982666
Energy: 0.9063158490643531
Energy: 0.9321980197607218
Energy: 1.0227656910123504
Energy: 1.335655631967858
Energy: 0.910480716361671
Energy: 0.9089795824292647
Energy: 0.9303246823676764
Energy: 0.928111781386022
Energy: 1.3366685867012065
Energy: 1.2776937234585066
Energy: 0.9941766142465821
Energy: 1.0981906061315014
Energy: 1.100357098326219
Energy: 1.3368684790866099
Energy: 1.2782043513646735
Energy: 1.1321678890274576
Energy: 1.1731834277536277
Energy: 1.0976758406093876
Energy: 0.9300162936381363
Energy: 1.241479177771708
Energy: 1.132070617676699
Energy: 1.1723887603860648
Energy: 0.9302446254057776
Energy: 1.0234658624019954
Energy: 1.026579899907738
Energy: 1.0248319109209059
Energy: 0.9085368281976755
Energy: 0.9106544664589858
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Energy: 1.0280804518010727
Energy: 1.022855014920203
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Energy: 1.3361253056096436
Energy: 0.9103091917294847
Energy: 0.9085020937833647
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Energy: 1.3369072691123662
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Energy: 0.9087926036798776
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Energy: 1.0235681459033226
Energy: 0.9315937744970215
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Energy: 1.1002548903549554
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Energy: 1.0976990192632665
Energy: 1.1002074395407497
Energy: 1.0250809603522433
Energy: 0.912237324442365
Energy: 1.1316968722092504
Energy: 0.930321988735505
Energy: 0.9295961318546072
Energy: 1.0259910357333193
Energy: 0.9121052286456423
Energy: 1.1315807108669196
Energy: 0.9291671539720675
Energy: 1.1775117495562863
Energy: 1.1321241287913755
Energy: 1.2419619961635755
Energy: 1.130580300057327
Energy: 0.9080224765507378
Energy: 0.9101838749058363
Energy: 1.1321944642075774
Energy: 1.2410430233783116
Energy: 0.9333872104417509
Energy: 0.9079310601539466
Energy: 0.9101408688017153
Energy: 0.9297504623408628
Energy: 0.9103321614463181
Energy: 1.338089186311299
Energy: 0.9096118764883628
Energy: 0.9953885339739311
Energy: 0.9293487014693074
Energy: 0.9248605719122647
Energy: 1.3365789711759006
Energy: 0.9092528675051186
Energy: 0.9960810266622773
Energy: 1.0978314278364851
Energy: 0.9309961357989286
Energy: 1.240067525255598
Energy: 1.1813597022252653
Energy: 1.1746923071507398
Energy: 1.0976409965150016
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Energy: 1.240245609458614
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Energy: 1.1739963785903098
Energy: 0.9088550939357926
Energy: 1.1312299171115627
Energy: 0.996550158341645
Energy: 1.0270172607745198
Energy: 0.9955482600672988
Energy: 0.9092460891142807
Energy: 1.1319039433501443
Energy: 1.0909338186238264
Energy: 1.0264451913715307
Energy: 0.9946161133855644
Energy: 0.9058541823198125
Energy: 0.9315382475850725
Energy: 1.0224622679037914
Energy: 1.3354008452654478
Energy: 0.910470289080933
Energy: 0.906786832663636
Energy: 0.9320167562292963
Energy: 1.0225470046859675
Energy: 1.3355777648013043
Energy: 0.911007164978769
Energy: 0.9948610660157401
Energy: 0.9294414980389524
Energy: 0.9268710709361939
Energy: 1.3370427223909214
Energy: 1.2778580045131656
Energy: 0.9939855256318165
Energy: 1.098240563942762
Energy: 1.0998148655858333
Energy: 1.3364228436309393
Energy: 1.2780870408464668
Energy: 1.1323298544728637
Energy: 1.173413552813323
Energy: 1.0975484432739098
Energy: 1.0218029869416094
Energy: 1.241470177202104
Energy: 1.1323879494116722
Energy: 1.1724951849502556
Energy: 0.9306632035761312
Energy: 1.0230871950315057
Energy: 1.0273968082444855
Energy: 1.0259981660694704
Energy: 0.9086074188495369
Energy: 0.9098462945266844
Energy: 1.1318821696401664
Energy: 1.028051544654216
Energy: 1.0232753083189159
Energy: 0.908604161147389
Energy: 0.9104863063090708
Energy: 1.1319232700872066
Energy: 1.0263828914826114
Energy: 1.3359549886312467
Energy: 0.9104674039347207
Energy: 0.9081395650430171
Energy: 0.9306446537356947
Energy: 0.9328121136174213
Energy: 1.3367613313506475
Energy: 0.9098519483407425
Energy: 0.9084390670489024
Energy: 0.929335528121673
Energy: 1.0988272301162856
Energy: 1.1728080358924962
Energy: 1.023985819356345
Energy: 0.9328050848390679
Energy: 1.09863098916032
Energy: 1.1001701078279504
Energy: 1.173098498157673
Energy: 1.023104057257348
Energy: 1.1746222456953104
Energy: 1.0977618805755602
Energy: 1.1000829637867682
Energy: 1.0264506072503965
Energy: 0.9129789974032139
Energy: 1.1319860961605506
Energy: 0.9302847790064055
Energy: 0.929335397578498
Energy: 1.0262535567999667
Energy: 0.9116971591097858
Energy: 1.1316736489104622
Energy: 0.9294036608749286
Energy: 1.179553504615145
Energy: 1.1320240979290408
Energy: 1.241938296262677
Energy: 0.9327059007233097
Energy: 0.908329148424252
Energy: 0.9102227338554475
Energy: 1.1320021411516104
Energy: 1.2408089803261952
Energy: 0.931318335372846
Energy: 0.9078401294063084
Energy: 0.9101160367445643
Energy: 0.9298751080597298
Energy: 1.0998490372967058
Energy: 1.3379172009346072
Energy: 0.9098061642492071
Energy: 0.995463778525815
Energy: 0.9290878429146183
Energy: 0.9280667222937853
Energy: 1.3368571088856667
Energy: 0.9091847400962682
Energy: 0.9304566739293454
Energy: 1.0979127589068682
Energy: 0.9304728076202935
Energy: 1.2403353126927832
Energy: 1.1814685736521477
Energy: 1.1749033541536107
Energy: 1.0973432480337282
Energy: 0.9309350749492068
Energy: 1.239498386611005
Energy: 1.1821960253715138
Energy: 1.174022036476491
Energy: 0.908619215784938
Energy: 1.1313359860173207
Energy: 0.9962146436544119
Energy: 1.0278197504932827
Energy: 0.9945684052809012
Energy: 0.9090895489930072
Energy: 1.131573463750594
Energy: 0.911643974042504
Energy: 1.0262206183778018
Energy: 0.9937062168261231

minimum gb energy = 0.9056991381335892 eV
minimum distance =  2.33289280927819 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.7319929090683237
Energy: 1.1032829560690574
Energy: 1.2650566265913443
Energy: 1.1056888575304311
Energy: 1.305804364079732
Energy: 1.7325274101548127
Energy: 1.3440132403228944
Energy: 1.170950982294701
Energy: 1.1085407229134643
Energy: 1.2859597251708959
Energy: 1.0609870050954668
Energy: 1.2306276928647382
Energy: 1.060278035898089
Energy: 1.059966778328202
Energy: 1.1102407240242513
Energy: 1.0602425475340174
Energy: 1.1862166697723107
Energy: 1.0614786296011487
Energy: 1.135334444972995
Energy: 1.2985637303410673
Energy: 1.1505601119425828
Energy: 1.1653926925170965
Energy: 1.1288129855453792
Energy: 1.1496577187573174
Energy: 1.0865796648341086
Energy: 1.1497870940085713
Energy: 1.1844975377310583
Energy: 1.1284374695461872
Energy: 1.0543782648770625
Energy: 1.0864771833002085
Energy: 1.1279315308977451
Energy: 1.301802967578501
Energy: 1.0260484477350815
Energy: 1.1501145832288688
Energy: 1.0869238150328007
Energy: 1.1296178756437125
Energy: 1.3167478532338632
Energy: 1.2016623199580851
Energy: 1.1496989415394623
Energy: 1.0866221608190176
Energy: 1.3252011127500813
Energy: 1.0260965066945014
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Energy: 1.207699629350915
Energy: 1.335842903910961
Energy: 1.1430546844057858
Energy: 1.065980233333271
Energy: 1.0486055995191186
Energy: 1.173348564601196
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Energy: 1.3420297107250039
Energy: 0.9964553427073776
Energy: 1.0404960686718012
Energy: 1.322479878558461
Energy: 1.3217098208083733
Energy: 1.3191053463765068
Energy: 0.9975987511122093
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Energy: 1.346619376954888
Energy: 1.3222108044916083
Energy: 1.0489793893654482
Energy: 0.9963729143393244
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Energy: 1.4291625865772055
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Energy: 1.5300054190173045
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Energy: 1.1183309918038655
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Energy: 1.2817346739140818
Energy: 1.1807091866570067
Energy: 1.2797053485427463
Energy: 1.1705875033039534
Energy: 1.5036953879496682
Energy: 1.3203936893022399
Energy: 1.161938255197507
Energy: 1.1796023874588428
Energy: 1.021685106213083
Energy: 1.0115283017550085
Energy: 1.0240031951528878
Energy: 1.2821204028217812
Energy: 1.1806159713911235
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Energy: 0.9954288866568918
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Energy: 1.0099660469591016
Energy: 1.0345288121767457
Energy: 1.14170895873002
Energy: 1.2381704897074883
Energy: 1.105996810399137
Energy: 0.9875495649919552
Energy: 1.3599291170192152
Energy: 1.1426355394045897
Energy: 1.241914120280034
Energy: 1.0396285628786743
Energy: 1.3108122525233679
Energy: 1.3599102866178558
Energy: 1.1745654045989693
Energy: 1.0566892749620205
Energy: 1.4971141513389334
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Energy: 1.1671489611707373
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Energy: 1.4570876092863168
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Energy: 1.0622062887544763
Energy: 1.1280795646872805
Energy: 1.2644148324198172
Energy: 1.3239126546954796
Energy: 1.106380302599111
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Energy: 1.190269489370255
Energy: 1.2102961272807409
Energy: 1.105870558611511
Energy: 1.0403591929537785
Energy: 1.1060051173816285
Energy: 1.1705552432775048
Energy: 1.2566331365456733
Energy: 1.0814978027800513
Energy: 1.0400300035930456
Energy: 1.105137906217622
Energy: 1.1716225833864486
Energy: 1.263063145675317
Energy: 1.069398665179422
Energy: 1.2742745560610844
Energy: 1.1853667948822335
Energy: 1.1050389828839675
Energy: 1.1575270165136309
Energy: 1.1519914442591066
Energy: 1.2289948467040515
Energy: 1.185324579367309
Energy: 1.1060200870364194
Energy: 1.1567946501559105
Energy: 1.1445158410792762
Energy: 0.9968015431051704
Energy: 1.3500952979551561
Energy: 1.3691566344834518
Energy: 1.197202013709066
Energy: 1.5266314692102994
Energy: 1.2040750254604788
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Energy: 1.2016081925067916
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Energy: 1.2266342378559256
Energy: 1.3548340277029713
Energy: 1.2874561204974735
Energy: 1.1388441841356869
Energy: 1.0101189118883607
Energy: 1.249015551129649
Energy: 1.325801864372217
Energy: 1.331228505052157
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Energy: 1.0322108208129943
Energy: 1.1138499796182788
Energy: 1.3317664026208778
Energy: 1.0529928194137934
Energy: 0.9988878284309616
Energy: 1.0056890666716376
Energy: 1.110668495084327
Energy: 1.3764012671433583
Energy: 1.0467839631820743
Energy: 0.999206972905467
Energy: 0.9995113079104663
Energy: 1.3553694579586257
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Energy: 1.1001142589815058
Energy: 1.0304506686089225
Energy: 0.9982981586038889
Energy: 1.3696005170620738
Energy: 1.4350258083355825
Energy: 1.0654754397838848
Energy: 1.0099689059735844
Energy: 0.9993848972518349
Energy: 1.3448243230356958
Energy: 1.020305625869311
Energy: 1.14465039115342
Energy: 1.1845321746950208
Energy: 1.2880358917982324
Energy: 1.352364366265888
Energy: 1.0209897635978913
Energy: 1.1525340155282895
Energy: 1.2841735503749736
Energy: 1.3234578921223021
Energy: 1.013846718489198
Energy: 1.026032173396281
Energy: 1.2198903020076384
Energy: 1.2803127382828945
Energy: 1.1815768507364948
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Energy: 1.0262991728949737
Energy: 1.173629001841097
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Energy: 1.0987491875550537
Energy: 1.0232041683985857
Energy: 1.0157996605032338
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Energy: 1.0122402264027086
Energy: 1.039706839372529
Energy: 1.0733718527896385
Energy: 1.0592780470950685
Energy: 1.0446180624517907
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Energy: 1.3629685802849076
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Energy: 1.1395334504794785
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Energy: 1.2156968831544954
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Energy: 1.061454571169747
Energy: 1.110510834104383
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Energy: 1.165912528153532
Energy: 1.0628648676255017
Energy: 1.03970487236575
Energy: 1.1058109037011605
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Energy: 1.0591909186768542
Energy: 1.0403228546145167
Energy: 1.1056513816118612
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Energy: 1.082205646207821
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Energy: 1.154999760195075
Energy: 1.338855407976022
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Energy: 1.1067431076521952
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Energy: 1.0239518598141786
Energy: 1.4399175901281356
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Energy: 1.4228626977441252
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Energy: 1.2872077525759087
Energy: 1.3458292560583776
Energy: 1.3362651942068242
Energy: 0.9990809338973516
Energy: 1.134329590626013
Energy: 1.332540803600103
Energy: 1.319170998978
Energy: 1.3317677108629409
Energy: 1.0005988783014932
Energy: 1.1437948571059082
Energy: 1.3415863770901042
Energy: 1.319056590468839
Energy: 1.0404570306554872
Energy: 0.9982690768742414
Energy: 1.156935361677093
Energy: 1.2435534847142888
Energy: 1.363110809255696
Energy: 1.0499567296736725
Energy: 0.9987880017871303
Energy: 1.101400026184221
Energy: 1.249685308540491
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Energy: 1.047797527413811
Energy: 1.0076819622081195
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Energy: 1.1636560091896784
Energy: 1.3813619141609899
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Energy: 1.4404674299541205
Energy: 1.3535115249320844
Energy: 1.181358119398655
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Energy: 1.2652134711358527
Energy: 1.4326588741871569
Energy: 1.3526850677880802
Energy: 1.1275460463959075
Energy: 1.3170716168404135
Energy: 1.0215876036568705
Energy: 1.011141992226178
Energy: 1.0398386316167907
Energy: 1.1261732340073471
Energy: 1.2842473185439487
Energy: 1.0216553452593908
Energy: 1.0119482929148818
Energy: 1.024593259797215
Energy: 1.4088450814917233
Energy: 1.220798877305126
Energy: 1.0606903097228333
Energy: 1.0125143187475025
Energy: 1.0421797157122679
Energy: 1.3650191076956506
Energy: 1.1466528683158757
Energy: 1.0492831812134698
Energy: 1.012267427345271
Energy: 1.0375199221171838
Energy: 1.1420532580043308
Energy: 1.2454729782697531
Energy: 1.0772288393030374
Energy: 0.9884817732861502
Energy: 1.3621373260702592
Energy: 1.1424850138084504
Energy: 1.2453171851906335
Energy: 1.1204045332160317
Energy: 1.0527668200581297
Energy: 1.3617961462730317
Energy: 1.0446474910647987
Energy: 1.0403312647330605
Energy: 1.533062829396044
Energy: 1.4781710532187498
Energy: 1.0698018819734443
Energy: 1.0455968813289203
Energy: 1.0391774286735236
Energy: 1.4973535933324615
Energy: 1.4601639172986471
Energy: 1.0707794693583614
Energy: 1.059030599635722
Energy: 1.1293976315704108
Energy: 1.2635401201360312
Energy: 1.3031195305540495
Energy: 1.0635616829483403
Energy: 1.0599943325143513
Energy: 1.0629195842880503
Energy: 1.4347948697080097
Energy: 1.3236948362848384
Energy: 1.0629702215100536
Energy: 1.0400464011381063
Energy: 1.0737485922001442
Energy: 1.1695407418800223
Energy: 1.1459592807868175
Energy: 1.1344785548894152
Energy: 1.0384344283972888
Energy: 1.1067659800583036
Energy: 1.1693012511731127
Energy: 1.1603160540795183
Energy: 1.137305735182192
Energy: 1.312663726270163
Energy: 1.1839466936631746
Energy: 1.1043544580894153
Energy: 1.1559279212354345
Energy: 0.9984457273870453
Energy: 1.2771183498316032
Energy: 1.116276764303883
Energy: 1.104642407585724
Energy: 1.1822905992353643
Energy: 1.1295673945784042
Energy: 1.0262335706715733
Energy: 1.2534557742366643
Energy: 1.3542524810060035
Energy: 1.2095266928511093
Energy: 1.5226661828940515
Energy: 1.210524355456755
Energy: 1.1753951927744326
Energy: 1.3840645330271026
Energy: 1.2102449656631935
Energy: 1.522424678467494
Energy: 1.3001498159849014
Energy: 1.2840730021877682
Energy: 1.2811724957620088
Energy: 1.3338479938414805
Energy: 1.0089260620033929
Energy: 1.3017953722064723
Energy: 1.3308453282101405
Energy: 1.325303477124207
Energy: 1.3520928587284156
Energy: 1.009558141060813
Energy: 1.115506716327687
Energy: 1.319232794799483
Energy: 1.0380280484317486
Energy: 0.9965836693748688
Energy: 0.9967844482698014
Energy: 1.1143608434312688
Energy: 1.318148802014849
Energy: 1.0384907051570693
Energy: 0.995905058169742
Energy: 1.009879794411682
Energy: 1.2233989312439513
Energy: 1.4326768019167946
Energy: 1.1010329204631584
Energy: 1.0401300598519736
Energy: 0.9973289473326933
Energy: 1.2598326778983504
Energy: 1.4393354038790387
Energy: 1.07048746635369
Energy: 1.0078961647120495
Energy: 0.9968821856237531
Energy: 1.2698506719219953
Energy: 1.2630113721213139
Energy: 1.0760380051755625
Energy: 1.1810795214882412
Energy: 1.22828400264235
Energy: 1.2686885513771406
Energy: 1.3605755784191322
Energy: 0.9958471699935275
Energy: 1.1994806238473792
Energy: 1.1896387926842982
Energy: 0.9942462926652156
Energy: 0.9939017213625072
Energy: 1.1157764681203965
Energy: 1.2795699620907552
Energy: 1.1266517305697408
Energy: 0.9935457264321118
Energy: 1.0445211498856801
Energy: 1.117430475254729
Energy: 1.3230042983678116
Energy: 1.1290231297860012
Energy: 1.0050565272646261
Energy: 0.994559540812825
Energy: 0.9971975920577374
Energy: 1.3867861795100553
Energy: 1.107156452676735
Energy: 1.008772049981392
Energy: 0.9940816321114697
Energy: 1.007876781144892
Energy: 1.0783788976307171
Energy: 1.1823219746549976
Energy: 1.0146501012877407
Energy: 0.9954820044700959
Energy: 1.144593567218367
Energy: 1.1445301342403211
Energy: 1.1513676763309484
Energy: 1.0620124110543112
Energy: 0.995616842557503
Energy: 1.1428264121691432
Energy: 1.3629629013149325
Energy: 1.181179977354664
Energy: 1.7352178482819187
Energy: 1.1425208099014506
Energy: 1.360545284780277
Energy: 1.0765758552878633
Energy: 1.1568264795117384
Energy: 1.3982124819498654
Energy: 1.144538193761146
Energy: 1.4197547840764841
Energy: 1.1155373335801426
Energy: 1.3842796813277793

minimum gb energy = 0.9875495649919552 eV
minimum distance =  2.25988895804257 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.2561306818143794
Energy: 1.2467470218195755
Energy: 1.2168195780445341
Energy: 1.3076341766685604
Energy: 1.2476493572065208
Energy: 1.25721025582819
Energy: 1.148674886917304
Energy: 1.2215342829960956
Energy: 1.3239312590961527
Energy: 1.5076589732939725
Energy: 0.9754348410454798
Energy: 1.29094466291821
Energy: 1.0948709002483
Energy: 1.1026287396704195
Energy: 1.344279620432993
Energy: 1.1633334117841547
Energy: 1.2910370679993048
Energy: 1.0944562401433826
Energy: 1.270753552448782
Energy: 1.184881171233594
Energy: 1.1074223872702842
Energy: 1.1388436517795577
Energy: 1.1406299788312702
Energy: 1.1165703690102609
Energy: 1.0343099317530118
Energy: 1.1091888270176233
Energy: 1.1383506466058069
Energy: 1.2497492862561392
Energy: 1.0606477692071572
Energy: 1.036556382178385
Energy: 1.0835319202615301
Energy: 1.1055287380858292
Energy: 1.2523450421052684
Energy: 1.0968219990553032
Energy: 1.0359084231754467
Energy: 1.0800458254832102
Energy: 1.0785294501999763
Energy: 1.2519993368467635
Energy: 1.0971754594985996
Energy: 1.0346779366251522
Energy: 1.230222229030175
Energy: 1.4538564739947426
Energy: 1.2140057924834033
Energy: 1.1015552929051835
Energy: 1.4090477503736816
Energy: 1.2296817765246881
Energy: 1.4541449582564767
Energy: 1.2105419068421945
Energy: 1.101923643432723
Energy: 1.3804235878086855
Energy: 1.3419073241566821
Energy: 1.0059272732753806
Energy: 1.0788277402633626
Energy: 1.1182930608417732
Energy: 1.2599724252184445
Energy: 1.195828696039561
Energy: 1.0057738181764413
Energy: 1.1178078370354276
Energy: 1.1160885327186048
Energy: 1.259674256850596
Energy: 1.1135777222020868
Energy: 1.0798487749988428
Energy: 1.068512203647278
Energy: 1.0827059574049327
Energy: 1.3291932716222108
Energy: 1.113598781829154
Energy: 1.074874082749944
Energy: 1.0688960526293527
Energy: 1.3873596341344212
Energy: 1.3350241157716274
Energy: 1.2347600486610368
Energy: 1.1124118291603171
Energy: 1.0510419421700992
Energy: 1.1795425573366491
Energy: 1.3003702046928105
Energy: 1.1477383382021948
Energy: 1.1109196106488108
Energy: 1.1142679631485974
Energy: 1.182651462851154
Energy: 1.303252836926264
Energy: 1.195979165767011
Energy: 1.356348826909894
Energy: 1.3152920761007056
Energy: 1.302768417165592
Energy: 1.1889356836173803
Energy: 1.192847309112983
Energy: 1.3589495224865107
Energy: 1.2736972605738601
Energy: 1.315822929544855
Energy: 1.171574001136603
Energy: 1.298068135011047
Energy: 1.2142171173118668
Energy: 1.14589580511987
Energy: 1.417284008856226
Energy: 1.339280024373246
Energy: 1.1721854438366306
Energy: 1.2112065671981553
Energy: 1.1486670314692855
Energy: 1.415701254032912
Energy: 1.3347581791885235
Energy: 0.989287332673348
Energy: 0.9904582493006818
Energy: 1.283600174219491
Energy: 1.3149038040232353
Energy: 1.3544486867695935
Energy: 0.9873765126513325
Energy: 0.9801830936605805
Energy: 1.280828182628238
Energy: 1.265709154402932
Energy: 1.1166508010925271
Energy: 0.9879647751917406
Energy: 0.9900172170396389
Energy: 0.9879282916711399
Energy: 1.3920934296087881
Energy: 0.9909134309909573
Energy: 0.9839049500621766
Energy: 0.9928474760346016
Energy: 1.0549136096094052
Energy: 1.3898042605889953
Energy: 0.9947293263896965
Energy: 0.9846975643162761
Energy: 1.2090974647996768
Energy: 1.1816338661359975
Energy: 1.2451571388036975
Energy: 1.1818586284382253
Energy: 0.9876597424123001
Energy: 1.213087403073113
Energy: 1.1826166320184204
Energy: 1.2541568725437242
Energy: 1.1196715315488124
Energy: 1.6444791693133858
Energy: 1.3231381930572448
Energy: 1.4619938567957256
Energy: 0.9901080217095863
Energy: 1.2005651494396383
Energy: 1.6450724286954725
Energy: 1.340168544661191
Energy: 1.463529002012516
Energy: 1.2318910709745583
Energy: 1.325753739798112

minimum gb energy = 0.9754348410454798 eV
minimum distance =  2.27526422894275 Angstroms
sigma value = 33