Model name: model_name=MEAM_LAMMPS_JeongParkDo_2018_PdCu__MO_353393547686_001
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=3.613315671682358
cohesive_energy=3.540278438572939
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=[1.91030724425088e-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: 0.016739188471304574
Energy: 0.01719422978602232
Energy: 1.3912184315481093
Energy: 0.9166825817640122
Energy: 0.9184539551508137
Energy: 0.2827079647396072
Energy: 0.017211176618979886
Energy: 0.42112184595890667
Energy: 0.8479394291275173
Energy: 0.2318103263695627
Energy: 0.6083993041934713
Energy: 0.6092652064646529
Energy: 0.01779951572252004
Energy: 0.08880000034030996
Energy: 0.017011339326480218
Energy: 0.8480122443627994
Energy: 0.809339648113953
Energy: 0.811211944313626
Energy: 0.6092236511241416
Energy: 0.08745078539166513
Energy: 0.08877045021884516
Energy: 0.019116342967216114
Energy: 0.6088035392407833
Energy: 1.2851184483686695
Energy: 0.916671944746356
Energy: 0.9182568970200496
Energy: 0.2813725967414571
Energy: 0.01733737019918485
Energy: 0.28140337307993174
Energy: 0.8514301469656743
Energy: 0.23180461742697603
Energy: 0.608536258414182
Energy: 0.6371986267539391
Energy: 0.017580367789374
Energy: 0.2828163609534793
Energy: 0.017127352057748332
Energy: 0.7848115107408091
Energy: 0.809068822141826
Energy: 0.8105847301671238
Energy: 0.7655130529105555
Energy: 0.08735585172801659
Energy: 0.08860831130237361

minimum gb energy = 0.016739188471304574 eV
minimum distance =  2.53110369310323 Angstroms
sigma value = 5


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

Energy: 1.1435481736415032
Energy: 1.389678374548247
Energy: 1.2803841265626188
Energy: 1.366360433923392
Energy: 1.2764958025097557
Energy: 1.2646285956146035
Energy: 1.3648837964456788
Energy: 1.0947267562729164
Energy: 1.1328579037685291
Energy: 1.19524769234047
Energy: 1.4335441839727285
Energy: 1.30916409073251
Energy: 1.114922445824267
Energy: 1.299030936282749
Energy: 1.2264709457221559
Energy: 1.2854534489923686
Energy: 1.2267990790157828
Energy: 1.273279785160184
Energy: 1.3472905084742293
Energy: 1.2317205345024014
Energy: 1.2943704971680692
Energy: 1.1695509472965007
Energy: 1.32580515804028
Energy: 1.1218376746203937
Energy: 1.267272546913923
Energy: 1.3300488015633527
Energy: 1.1548983757215676
Energy: 1.3293850018507702
Energy: 1.2512193921934824
Energy: 1.3179836564245513
Energy: 1.1542467159813614
Energy: 1.2259762991372547
Energy: 1.188044022965122
Energy: 1.254580902863788
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Energy: 1.2645893740680374
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Energy: 1.3459447077791435
Energy: 1.2904874719989305
Energy: 1.4003148698315862
Energy: 1.2628053111662638
Energy: 1.3054304923082622
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Energy: 1.2298957647294364
Energy: 1.2624579102134255
Energy: 1.1933271448940757
Energy: 1.451302205663415
Energy: 1.1016591199122097
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Energy: 1.200298581308695
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Energy: 1.3591458688554139
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Energy: 1.2703740586297978
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Energy: 1.1397750233229316
Energy: 1.2755060794789712
Energy: 1.2866536501272583
Energy: 1.1631804475032093
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Energy: 1.4397728154926062
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Energy: 1.3625523751460207
Energy: 1.1789148880034548
Energy: 1.2577028395319862
Energy: 1.3118785966930484
Energy: 1.2480235659430126
Energy: 1.4447640647141746
Energy: 1.2004457078609194
Energy: 1.3336451579155393
Energy: 1.1603953816889674
Energy: 1.1941928713450223
Energy: 1.2195749204822202
Energy: 1.2044590892052458
Energy: 1.3372731349612788
Energy: 1.0965661813801644
Energy: 1.3217322490765067
Energy: 1.2191591502306114
Energy: 1.2896349246420398
Energy: 1.33189796813128
Energy: 1.3171720863836114
Energy: 1.3137854787334518
Energy: 1.181577133932258
Energy: 1.3170765276232659
Energy: 1.1863762730895087
Energy: 1.3004750345629963
Energy: 1.3949892373250403
Energy: 1.2343723673825384
Energy: 1.284269197085895
Energy: 1.0884741377464449
Energy: 1.293722664563293
Energy: 1.2755345320793974
Energy: 1.3508914562023318
Energy: 1.202483952297836
Energy: 1.2303402594489319
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Energy: 1.1411336447977114
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Energy: 1.2502188653542148
Energy: 1.3026998971961654
Energy: 1.3422056976402936
Energy: 1.164505059157397
Energy: 1.3047478487717634

minimum gb energy = 1.080295786362611 eV
minimum distance =  2.26453073258649 Angstroms
sigma value = 401


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

Energy: 1.1308173166649684
Energy: 1.1687988249809105
Energy: 1.206421802396685
Energy: 1.3253966082300002
Energy: 1.3515761650626228
Energy: 1.2469013466694887
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Energy: 1.236251522326962
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Energy: 1.1761639102170627
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Energy: 1.2578194524477122
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Energy: 1.215021763853994
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Energy: 1.3237741700413115
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Energy: 1.1498811633797743
Energy: 1.3121583841505178
Energy: 1.4379756076853896
Energy: 1.200228081894496
Energy: 1.2451138941329127
Energy: 1.1958725462378788
Energy: 1.177848128256207
Energy: 1.1842088894232676
Energy: 1.1810671484360526
Energy: 1.2820878300272627
Energy: 1.264742555129122
Energy: 1.36992364520477
Energy: 1.2042642557391257
Energy: 1.229927673877401
Energy: 1.2713195100428973
Energy: 1.2228048593335035
Energy: 1.3372893607012357
Energy: 1.1056374675155312
Energy: 1.1983209757788773
Energy: 1.2299312505262272
Energy: 1.3429371902930909
Energy: 1.4106202995119868
Energy: 1.2175748335465266
Energy: 1.1957087921416707
Energy: 1.1089944130206641
Energy: 1.1747069258875371
Energy: 1.2406285219948237
Energy: 1.4442901258377983
Energy: 1.2574709263153838
Energy: 1.1655286610446363
Energy: 1.208745315184247
Energy: 1.0833464372650303
Energy: 1.1419550640527691
Energy: 1.2422831625699604
Energy: 1.4013635545122158
Energy: 1.229236707521194
Energy: 1.2124107577973857
Energy: 1.1696850504915983
Energy: 1.0880290222996505
Energy: 1.1174718632406013
Energy: 1.191955495200716
Energy: 1.3752352761407647
Energy: 1.3147055192467043
Energy: 1.1962418131949473
Energy: 1.168906011868257
Energy: 1.1163222727631064
Energy: 1.2345889034154005
Energy: 1.1261454934202166
Energy: 1.343154496296342
Energy: 1.3682856099154097
Energy: 1.1490040618864206
Energy: 1.1635794709924716
Energy: 1.187166278794806
Energy: 1.229005378977174
Energy: 1.1633368183461534
Energy: 1.2546679488252221
Energy: 1.2548328769740893
Energy: 1.225783441586619
Energy: 1.3465819890956523
Energy: 1.1374557599887003
Energy: 1.2078053541105875
Energy: 1.128698293971805
Energy: 1.204645337784675
Energy: 1.2349560672144075
Energy: 1.2628578137117692
Energy: 1.3009916775202024
Energy: 1.2161902165700176
Energy: 1.434089301651974
Energy: 1.1365467641567573
Energy: 1.1550431913682344
Energy: 1.3358712601233698
Energy: 1.3070374996136163
Energy: 1.4161020754073432
Energy: 1.198471373127956
Energy: 1.2000908412209645
Energy: 1.1188112648348287
Energy: 1.190035434107799
Energy: 1.1866003932388163
Energy: 1.211950415827035
Energy: 1.3181814664850298
Energy: 1.2571030582714586
Energy: 1.3046062335673214
Energy: 1.201877797482798
Energy: 1.209691645048345
Energy: 1.1553611004005733
Energy: 1.2218489701191741
Energy: 1.4282371532207847
Energy: 1.1102002752386528
Energy: 1.2778115357828324
Energy: 1.2066540398429453
Energy: 1.2851592900159063
Energy: 1.3622178894630539
Energy: 1.204540184257617
Energy: 1.2130632183841745
Energy: 1.1401982095899275
Energy: 1.180822187292445
Energy: 1.2542531839179183
Energy: 1.3542854212171525
Energy: 1.254952520762048
Energy: 1.2535250058348884
Energy: 1.1875855688129944
Energy: 1.1240679708676655
Energy: 1.220033372327776
Energy: 1.237315924795155
Energy: 1.4404394393718556
Energy: 1.373913280236675
Energy: 1.1253970601160472
Energy: 1.186948974234286

minimum gb energy = 1.081477217861637 eV
minimum distance =  2.2548039911948 Angstroms
sigma value = 311


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

Energy: 1.2072698927957408
Energy: 1.1626261360860095
Energy: 1.1496258937497772
Energy: 1.1843659888046811
Energy: 1.216616216569839
Energy: 1.152459603274886
Energy: 1.3429808753581487
Energy: 1.2160578073223012
Energy: 1.2947797170034736
Energy: 1.1507981048955278
Energy: 1.2357717703296032
Energy: 1.2500560156084788
Energy: 1.1600639142973723
Energy: 1.3550320037457726
Energy: 1.1972625289391488
Energy: 1.2327861225763173
Energy: 1.256328558387407
Energy: 1.2329849273328246
Energy: 1.1954312534430254
Energy: 1.180304110753904
Energy: 1.2685321618171823
Energy: 1.1456694856095229
Energy: 1.256604013250511
Energy: 1.1707300312298403
Energy: 1.3636569388684434
Energy: 1.2124873567453747
Energy: 1.1586876326578242
Energy: 1.2694536417305342
Energy: 1.2283640083275402
Energy: 1.3142320955559432
Energy: 1.233054761015327
Energy: 1.2721876004512147
Energy: 1.2235634982280945
Energy: 1.2769066877412418
Energy: 1.1927534186824447
Energy: 1.2311114241778407
Energy: 1.2036897179260078
Energy: 1.1013462881797558
Energy: 1.2989786541813866
Energy: 1.3262241888807877
Energy: 1.2805264924214173
Energy: 1.3307618677917707
Energy: 1.1955670652844332
Energy: 1.2160184139359012
Energy: 1.158097378074239
Energy: 1.2162846057217196
Energy: 1.3318784002160533
Energy: 1.2130638616012588
Energy: 1.3339249707638408
Energy: 1.2138491447769535
Energy: 1.2552361860711452
Energy: 1.1736213114410983
Energy: 1.2460861830456342
Energy: 1.2737189308516532
Energy: 1.1586040906562902
Energy: 1.2710087061925033
Energy: 1.2043437519745086
Energy: 1.2368479426800991
Energy: 1.2960931427977591
Energy: 1.2374957477977047
Energy: 1.223588688473228
Energy: 1.3133097530867979
Energy: 1.243843998186298
Energy: 1.1498351336084
Energy: 1.2429751039549417
Energy: 1.1551539531957502
Energy: 1.2933231829498222
Energy: 1.2775406750911422
Energy: 1.167896300977122
Energy: 1.303683871056576
Energy: 1.245849331340157
Energy: 1.3478339459516457
Energy: 1.2225989990725112
Energy: 1.2351278681723883
Energy: 1.1758059257984397
Energy: 1.2388555296979675
Energy: 1.2294447688546384
Energy: 1.218005946269424
Energy: 1.22362709649692
Energy: 1.1030394986664744
Energy: 1.2144284029170587
Energy: 1.1666162699541478
Energy: 1.222168744017054
Energy: 1.234057986616119
Energy: 1.151323201575308
Energy: 1.1799332081935365
Energy: 1.1579835142286117
Energy: 1.1838204709780162
Energy: 1.3299673260145204
Energy: 1.2289659917670572
Energy: 1.3052592461691421
Energy: 1.1744501239254364
Energy: 1.2887555499561023
Energy: 1.1699645166612413
Energy: 1.2323857611764701
Energy: 1.3204526309068934
Energy: 1.2035428358314195
Energy: 1.2546377110801818
Energy: 1.1650986334265394
Energy: 1.2313605423716296
Energy: 1.206061577039875
Energy: 1.341289655136174
Energy: 1.3107024597143697
Energy: 1.237409925604345
Energy: 1.1738010143063973
Energy: 1.1234029703599828
Energy: 1.2638577653009597
Energy: 1.1848590698294104
Energy: 1.1871876118118219
Energy: 1.2667150580109936
Energy: 1.3067793376085617
Energy: 1.2740319682022365
Energy: 1.2361607866057087
Energy: 1.308710721851357
Energy: 1.2312679981274324
Energy: 1.2417345721223032
Energy: 1.2000074351691332
Energy: 1.2213219181704964
Energy: 1.286233247786136
Energy: 1.2102062806650498
Energy: 1.2547602158781876
Energy: 1.1579456154994758
Energy: 1.273853997326282
Energy: 1.2872527410755727
Energy: 1.2579749204015305
Energy: 1.2501654240062978
Energy: 1.1608367963056012
Energy: 1.1723329654727428
Energy: 1.2228335857995498
Energy: 1.2858653948065446
Energy: 1.3444040184496817
Energy: 1.1853124624743436
Energy: 1.2664720813698855
Energy: 1.1680502935743764
Energy: 1.3077524898325266
Energy: 1.1882774005699115
Energy: 1.1642517981297602
Energy: 1.300153861745529
Energy: 1.1906907456214377
Energy: 1.368111628418967
Energy: 1.1874005142164745
Energy: 1.2397300643103977
Energy: 1.2018791034472405
Energy: 1.2896653755876366
Energy: 1.2756222634700682
Energy: 1.1416449862118183
Energy: 1.1636945403787728
Energy: 1.1029927456431667
Energy: 1.2011781067997112
Energy: 1.144091770367499
Energy: 1.2451273714925009
Energy: 1.213772888018245
Energy: 1.2484187365201715
Energy: 1.2238227580314502
Energy: 1.1850069891822663
Energy: 1.3845535204364918
Energy: 1.2466049389918992
Energy: 1.2722820040807816
Energy: 1.1587391009137236
Energy: 1.259210818521375
Energy: 1.2130353067751631
Energy: 1.2191758682628786
Energy: 1.2056750006966175
Energy: 1.168387784539428
Energy: 1.2673163317241276
Energy: 1.2178518259114477
Energy: 1.2366335946763558
Energy: 1.242525372180558
Energy: 1.1682983728037004
Energy: 1.2572162083807243
Energy: 1.165179353393133
Energy: 1.2736640515916473
Energy: 1.2669249079012108
Energy: 1.1888206396189198
Energy: 1.162307824775814
Energy: 1.1643640540798466
Energy: 1.3015605468346256
Energy: 1.1574651748774483
Energy: 1.2002539088020319
Energy: 1.2808949402526684
Energy: 1.1971431181211576
Energy: 1.3114532591218286
Energy: 1.2024986473575219
Energy: 1.208915137681085
Energy: 1.1676252073402202
Energy: 1.2797436404979798
Energy: 1.2527895487421785
Energy: 1.2050545845552723
Energy: 1.2546784922460315
Energy: 1.2343941126480498
Energy: 1.2038817003053377
Energy: 1.13406389285113
Energy: 1.2555108710338045
Energy: 1.1656075750545698
Energy: 1.2003307540596355
Energy: 1.27361572924182
Energy: 1.2468877552883604
Energy: 1.417610698207985
Energy: 1.253494919450982
Energy: 1.2783643947685468
Energy: 1.1158439628026582
Energy: 1.2124338649238342
Energy: 1.2093032617997037
Energy: 1.1505814252928732
Energy: 1.3195390904729767
Energy: 1.2488943108826283
Energy: 1.2554774940289377
Energy: 1.277374279460732
Energy: 1.152422740058532
Energy: 1.2459525031426195
Energy: 1.1574015163251559
Energy: 1.1336950449933085
Energy: 1.269506167887567
Energy: 1.3114053099544813
Energy: 1.1672602677081048
Energy: 1.2504391378185362
Energy: 1.2021546165423986
Energy: 1.1920557382471868
Energy: 1.4054918874816589
Energy: 1.2405038552264271
Energy: 1.280734398446286
Energy: 1.2387946047018186
Energy: 1.1687514859937762
Energy: 1.3165179152287911
Energy: 1.1589013806264912
Energy: 1.2158261525738088
Energy: 1.1759359273348913
Energy: 1.2460036740581089
Energy: 1.2713503480034933
Energy: 1.1854802182770128
Energy: 1.257294077161037
Energy: 1.2079726929143066
Energy: 1.2235117921130796
Energy: 1.1430784322339143
Energy: 1.216127680544281
Energy: 1.1613754507184477
Energy: 1.2249217187985635
Energy: 1.308957621896099
Energy: 1.2826850207567535
Energy: 1.3627287750885146
Energy: 1.1770864693145142
Energy: 1.2417920581033886
Energy: 1.1635757697684563
Energy: 1.2356916389352308
Energy: 1.2248163623779242
Energy: 1.1963902116650211
Energy: 1.2459544187031597
Energy: 1.1938505423150436
Energy: 1.2579135512773274
Energy: 1.2467171311343488
Energy: 1.1492829376979508
Energy: 1.300038690695257

minimum gb energy = 1.1013462881797558 eV
minimum distance =  2.26927238362371 Angstroms
sigma value = 39


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

Energy: 1.0050807563605157
Energy: 1.005200640517865
Energy: 1.3039113046298028
Energy: 1.0727767797196452
Energy: 1.1832763909368498
Energy: 1.1534465756963217
Energy: 1.0048071110829857
Energy: 0.9704754355974302
Energy: 1.1028322958798422
Energy: 1.113218176542845
Energy: 1.176143304673704
Energy: 1.079096329723745
Energy: 1.0751282501899664
Energy: 1.3068225857072617
Energy: 1.483751350372304
Energy: 1.0593018551376694
Energy: 1.112364047009357
Energy: 1.0598287222023504
Energy: 1.0941332262478738
Energy: 1.0737707963282357
Energy: 1.1811707317604825
Energy: 1.0451754181318633
Energy: 1.362249593930259
Energy: 1.0885358807854257
Energy: 1.1501320616075665
Energy: 1.135148935728192
Energy: 1.1582979995826643
Energy: 1.1355714280450544
Energy: 1.0547105546791367
Energy: 1.0821582667236804
Energy: 1.095390520613912
Energy: 1.109583582819149
Energy: 1.3878821300181667
Energy: 1.2830976511322352
Energy: 1.0687174056494344
Energy: 0.9699530322961502
Energy: 1.028920448441642
Energy: 1.0730464911914575
Energy: 1.2892344405198015
Energy: 1.12513720262196
Energy: 1.054707792614494
Energy: 1.2279726573572989
Energy: 1.278723850460067
Energy: 1.104500821064883
Energy: 1.0647611644136843
Energy: 1.2761627441020855
Energy: 0.9855334658840241
Energy: 0.9843431840921065
Energy: 1.2892893414034958
Energy: 0.9914164997166801
Energy: 1.1003061752715142
Energy: 1.293295113194106
Energy: 1.132089267297174
Energy: 1.146045265382323
Energy: 1.1551075361727159
Energy: 1.1571385593169028
Energy: 0.9731542294772125
Energy: 1.1005999009986702
Energy: 1.2636920565529397
Energy: 1.0988555865572323
Energy: 1.1436290707043035
Energy: 1.267219753850614
Energy: 1.157492580843651
Energy: 1.2936547811363714
Energy: 1.1275745578324394
Energy: 1.1153548796266166
Energy: 1.1186610490480084
Energy: 1.102005070102151
Energy: 1.073736832294755
Energy: 1.0663334112011267
Energy: 1.0261558460327591
Energy: 1.0327857295379044
Energy: 1.0859781668790025
Energy: 1.1201211514114748
Energy: 1.0734785222288838
Energy: 1.1087664302955857
Energy: 1.2814092141449849
Energy: 1.055009005720391
Energy: 1.0898207193986844
Energy: 1.086168116628698
Energy: 1.1439184355156433
Energy: 1.3153769342044137
Energy: 1.1144409460060447
Energy: 1.2874544439138618
Energy: 0.9881968581527864
Energy: 1.084959069173452
Energy: 1.114915420892545
Energy: 1.2036435440589093
Energy: 1.1562804053432834
Energy: 1.1540929406283684
Energy: 1.0674614842217305
Energy: 1.290651711746947
Energy: 1.0291096220229792
Energy: 1.259390243522549
Energy: 1.2149412484154993
Energy: 0.9882925667459125
Energy: 0.990865132277097
Energy: 1.28122405124096
Energy: 0.970789422196035
Energy: 1.1005190038465744
Energy: 1.0687180350696983
Energy: 1.2763191308449018
Energy: 0.9847264084967754
Energy: 0.9702990546690609
Energy: 1.0990449575047838
Energy: 1.0052414712418938
Energy: 1.3061482653279124
Energy: 1.3035139853632778
Energy: 1.0705044532461485
Energy: 1.184057250875918
Energy: 1.2667685317203372
Energy: 1.0049439690069744
Energy: 1.0535223878841742
Energy: 1.1028489816808995
Energy: 1.1085999277389238
Energy: 1.176946104524957
Energy: 1.078693335727441
Energy: 1.0741658524348223
Energy: 1.307076918497834
Energy: 1.4838146007008657
Energy: 1.0583634527748123
Energy: 1.1106467854893438
Energy: 1.0601715658789106
Energy: 1.0937334909794312
Energy: 1.0738039818689937
Energy: 1.1815735770030142
Energy: 1.044735471543366
Energy: 1.3623623063882775
Energy: 1.0886840349522755
Energy: 1.1488470398784145
Energy: 1.1348545427629095
Energy: 1.112565227214654
Energy: 1.2957496241699058
Energy: 1.0717634405591987
Energy: 1.0772457789997334
Energy: 1.0958481095965327
Energy: 1.1663785340369968
Energy: 1.3871628591529388
Energy: 1.2827496895526411
Energy: 1.0692942937556023
Energy: 0.9699373654122287
Energy: 1.0277434417198519
Energy: 1.0734254514796049
Energy: 1.2197457739098876
Energy: 1.1244471355833077
Energy: 0.9839637194459304
Energy: 1.2298995094285203
Energy: 1.2737497983020414
Energy: 1.1129810661499202
Energy: 1.064540133219521
Energy: 1.2741511945379487
Energy: 0.9865803482677952
Energy: 0.9848877474127732
Energy: 1.2755700517095803
Energy: 0.9727981175799669
Energy: 1.1048673227349648
Energy: 1.2884251027947395
Energy: 1.1319154024368798
Energy: 1.153295635447114
Energy: 1.154976926211768
Energy: 1.1570396781298355
Energy: 0.9728008052767001
Energy: 1.0566377834808562
Energy: 1.2662820176347618
Energy: 1.099872203706202
Energy: 1.084542166905311
Energy: 1.267251926147352
Energy: 1.1572064756462694
Energy: 1.2931478609797387
Energy: 1.1270192191646424
Energy: 1.1089524604723617
Energy: 1.1218964015291983
Energy: 1.1042751244497682
Energy: 1.0745032998851316
Energy: 1.0662959061198938
Energy: 1.02656135132536
Energy: 1.0683802997315195
Energy: 1.0858857099417916
Energy: 1.1199521934265728
Energy: 1.087055484653049
Energy: 1.1442798371973946
Energy: 1.2814958141658044
Energy: 1.0552882768728629
Energy: 1.0894684667953174
Energy: 1.0862189241758453
Energy: 1.1438827147550754
Energy: 1.3156601862587216
Energy: 1.1070586856010771
Energy: 1.0703697660044937
Energy: 0.9722991993076227
Energy: 1.0851821964258677
Energy: 1.1146312593039183
Energy: 1.2041031461877334
Energy: 1.155648176220002
Energy: 1.154043096798285
Energy: 1.0672391096838385
Energy: 1.290503661177168
Energy: 1.0290272859918008
Energy: 1.2727490289777472
Energy: 1.2149697400886528
Energy: 0.9838408719456516
Energy: 0.9875900105246218
Energy: 1.2801643631473183
Energy: 0.9704247722955535
Energy: 1.1003034652480608
Energy: 1.0727650240732307
Energy: 1.2188764113232
Energy: 0.9851009467413391
Energy: 0.9704158505343918
Energy: 1.100696496546107

minimum gb energy = 0.9699373654122287 eV
minimum distance =  2.26633411334315 Angstroms
sigma value = 21


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

Energy: 1.2909397367386581
Energy: 1.2723347568407706
Energy: 1.2645512843901514
Energy: 1.3589727546620398
Energy: 1.0986588957021797
Energy: 1.2858907045962098
Energy: 1.2709336626134673
Energy: 1.2486912325977504
Energy: 1.249283900802074
Energy: 1.3360844604653441
Energy: 1.3287723529370143
Energy: 1.2934194306808824
Energy: 1.2397746009066997
Energy: 1.4000450784646887
Energy: 1.2198518902663598
Energy: 1.166335704483149
Energy: 1.2167789154316477
Energy: 1.2845341085071276
Energy: 1.2943864814697605
Energy: 1.2313419081568573
Energy: 1.260547051109748
Energy: 1.2311570892289756
Energy: 1.3208471230613255
Energy: 1.1487501681713235
Energy: 1.3100792368004548
Energy: 1.1254482236847076
Energy: 1.127659620115437
Energy: 1.4242747972680991
Energy: 1.1053934641725325
Energy: 1.110837516214765
Energy: 1.3006172425999378
Energy: 1.085651739178696
Energy: 1.281176598158114
Energy: 1.3440676524098731
Energy: 1.152244276430755
Energy: 0.9816318149945057
Energy: 1.0462647801764384
Energy: 1.2034163138729372
Energy: 1.1423941998438294
Energy: 1.2959501925242098
Energy: 1.2731907194529661
Energy: 1.1370155786087384
Energy: 1.2794229634279366
Energy: 1.5432985199765548
Energy: 1.123811020762187
Energy: 1.205996393303737
Energy: 0.9937498770622174
Energy: 0.9963284777493085
Energy: 1.1663149720920118
Energy: 1.1567642852737208
Energy: 1.0899309924378178
Energy: 1.2503086080696175
Energy: 1.1528289525975097
Energy: 1.2608195503993387
Energy: 1.1722636558787807
Energy: 1.1542029666712965
Energy: 1.1157845673482532
Energy: 1.1354882855423216
Energy: 1.2484078001477918
Energy: 1.333860794570512
Energy: 1.3425116781144115
Energy: 1.245594632651453
Energy: 1.2002309893498189
Energy: 1.2198631037428807
Energy: 1.2748925626895713
Energy: 1.1067902545547383
Energy: 1.285702470404768
Energy: 1.0957070565626692
Energy: 1.2617610014841805
Energy: 1.3260518260525291
Energy: 1.2510743726324942
Energy: 1.256467997476626
Energy: 1.221186303274608
Energy: 1.3299445803030372
Energy: 1.1890568701832698
Energy: 1.0736700172852327
Energy: 1.4406890483373693
Energy: 1.2564210992695777
Energy: 1.4044377418351233
Energy: 1.3048088865311667
Energy: 1.3509921172257455
Energy: 1.2450742193597075
Energy: 1.2328073594507147
Energy: 1.3344080135211898
Energy: 1.2501855077356123
Energy: 1.2292489077441138
Energy: 1.3241933815181726
Energy: 1.2434210130452001
Energy: 1.3005983824328338
Energy: 1.2446557793534805
Energy: 1.2729871463566471
Energy: 1.1300224175391618
Energy: 1.3044912276064735
Energy: 1.3282837266542151
Energy: 1.2064436242287104
Energy: 1.333280349429379
Energy: 1.348227484415789
Energy: 1.4269086453830533
Energy: 1.2455062206567367
Energy: 1.1725916420478038
Energy: 1.1400659423654884
Energy: 1.281828610232799
Energy: 1.286906404340828
Energy: 1.2774804101458055
Energy: 1.3712795195826488
Energy: 1.2557704316432794
Energy: 1.2579356344173944
Energy: 1.10723693354529
Energy: 1.3031759862986698
Energy: 1.1245221221347612
Energy: 1.1753495525953925
Energy: 1.3432322482747947
Energy: 1.172143717988048
Energy: 1.254394065749564
Energy: 1.2013031397826082
Energy: 1.0981590914765185
Energy: 1.2242791354083464
Energy: 1.2670650600409186
Energy: 1.146347884890685
Energy: 0.9821936156063873
Energy: 1.0461747542230755
Energy: 1.310127233176818
Energy: 1.2107664833604337
Energy: 1.3847135084820326
Energy: 1.3906365381610246
Energy: 1.1554223141255744
Energy: 1.1283579073535388
Energy: 1.0841634316638276
Energy: 1.244653224266899
Energy: 1.116018314411404
Energy: 0.9911490468759488
Energy: 0.9958114792086057
Energy: 1.1329986245313586
Energy: 1.1557003930887007
Energy: 1.1166634007487888
Energy: 1.2711021336831856
Energy: 1.2016369715555622
Energy: 1.0372330076618796
Energy: 1.1192251016515526
Energy: 1.1485905582567337
Energy: 1.0788825186374396
Energy: 1.1217271939100182
Energy: 1.2467653221323973
Energy: 1.2482594380847811
Energy: 1.2525975427061131
Energy: 1.3700849670947106
Energy: 1.2035253789353122
Energy: 1.230535491867838
Energy: 1.3004696668489586
Energy: 1.1058959629702696
Energy: 1.186535366037568
Energy: 1.2053824285572825
Energy: 1.3246790885738928
Energy: 1.2503643721140743
Energy: 1.2425938051607455
Energy: 1.2661766508642025
Energy: 1.4012995391158831
Energy: 1.3759403280167837
Energy: 1.2519707633263615
Energy: 1.350319193007426
Energy: 1.360343864705043
Energy: 1.2834128710893464
Energy: 1.3592537492466397
Energy: 1.1832973279146985
Energy: 1.4217223092086446
Energy: 1.2395820209630577
Energy: 1.245287951373676
Energy: 1.4745322027465415
Energy: 1.130093949025554
Energy: 1.2494432298278608
Energy: 1.2408482402981476
Energy: 1.2028191337318983
Energy: 1.2490944479234314
Energy: 1.1875694373528651
Energy: 1.4265669451424485

minimum gb energy = 0.9816318149945057 eV
minimum distance =  2.27518573555232 Angstroms
sigma value = 113


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

Energy: 1.238176196356502
Energy: 1.4189408872362135
Energy: 1.3012030315532557
Energy: 1.3470097309053701
Energy: 1.2740058073709215
Energy: 1.2707944971533853
Energy: 1.395297937598647
Energy: 1.4133544773346658
Energy: 1.3909949896173655
Energy: 1.3282910415188207
Energy: 1.351790641780926
Energy: 1.34882191934426
Energy: 1.3728139620191018
Energy: 1.3879414262971521
Energy: 1.4202944097438395
Energy: 1.3529520732006795
Energy: 1.2439610523013929
Energy: 1.2969655546199
Energy: 1.3341324752976411
Energy: 1.2903964513179393
Energy: 1.377105184732675
Energy: 1.196691202199336
Energy: 1.423380739620086
Energy: 1.2575155396503568
Energy: 1.3145084809414305
Energy: 1.2934495767168261
Energy: 1.217336503403616
Energy: 1.4455539425961024
Energy: 1.2226958361552354
Energy: 1.3487101442005809
Energy: 1.4227459583284667
Energy: 1.434295395393566
Energy: 1.3223374103308538
Energy: 1.3764147678696286
Energy: 1.3381988043470472
Energy: 1.1155213544535987
Energy: 1.2817628017005518
Energy: 1.2546775651647515
Energy: 1.3308954368563446
Energy: 1.2747763923756708
Energy: 1.2796529680587352
Energy: 1.2111051625997977
Energy: 1.2858419365909588
Energy: 1.4678759348233232
Energy: 1.3151034851275354
Energy: 1.2858899678513709
Energy: 1.3005975782334127
Energy: 1.36212896486748
Energy: 1.3740859310656701
Energy: 1.3681030751928858
Energy: 1.2857183906361065
Energy: 1.3030225964661275
Energy: 1.3193862680842365
Energy: 1.3653763135766288
Energy: 1.3224843010214435
Energy: 1.17787568760688
Energy: 1.1322468767601446
Energy: 1.2974100211875257
Energy: 1.2896185282494437
Energy: 1.3470130562132774
Energy: 1.2853428645236171
Energy: 1.2636706058969787
Energy: 1.315929360055171
Energy: 1.2567934139866621
Energy: 1.2894021176652883
Energy: 1.3838930657031645
Energy: 1.338904625459249
Energy: 1.388404106434738
Energy: 1.2595696845224449
Energy: 1.2580045363199972
Energy: 1.2931933275342127
Energy: 1.2302088873576544
Energy: 1.2819686392716776
Energy: 1.2989708855835227
Energy: 1.4051551676002039
Energy: 1.2373899370064119
Energy: 1.2214232704632026
Energy: 1.1876075263319348
Energy: 1.3250494573098566
Energy: 1.2720829991845872
Energy: 1.2962873258829612
Energy: 1.270368231819876
Energy: 1.285869257751619
Energy: 1.2845277561901889
Energy: 1.377684439078372
Energy: 1.1845293279355869
Energy: 1.2400417223921891
Energy: 1.294575080804018
Energy: 1.3534293351697755
Energy: 1.2632488409346285
Energy: 1.2010958936666256
Energy: 1.29825292044187
Energy: 1.324280351562243
Energy: 1.3981341594715886
Energy: 1.2959089288137926
Energy: 1.3230730000321216
Energy: 1.3655472194723084
Energy: 1.3505154456286979
Energy: 1.1250726691332669
Energy: 1.2856001510712531
Energy: 1.2753852843641873
Energy: 1.3046707991980366
Energy: 1.2995211317618571
Energy: 1.3072809121794777
Energy: 1.255546428462009
Energy: 1.2111891450011003
Energy: 1.2913919664334585
Energy: 1.3564677086599495
Energy: 1.3879273184778202
Energy: 1.3607149900196778
Energy: 1.3349405311310498
Energy: 1.323152808247217
Energy: 1.2456687551327281
Energy: 1.420003238012627
Energy: 1.2708499321179254
Energy: 1.3026316643757807
Energy: 1.2799477085210316
Energy: 1.3072433596106765
Energy: 1.4354743522721496
Energy: 1.2076076561394447
Energy: 1.331243574327429
Energy: 1.1839035580146056
Energy: 1.275422385841045
Energy: 1.2460794159748143
Energy: 1.2490786399436957
Energy: 1.3089105198671853
Energy: 1.3789684103257587
Energy: 1.4062763684775037
Energy: 1.3815539213682702
Energy: 1.4582282871966799
Energy: 1.456926841438104
Energy: 1.4719651666153686
Energy: 1.428083953160948
Energy: 1.1944315514782056
Energy: 1.4181720208939688
Energy: 1.2686951888265574
Energy: 1.3458996521880426
Energy: 1.2926997784235625
Energy: 1.2882855018266257
Energy: 1.3571534432700245
Energy: 1.3832872589544554
Energy: 1.4122877600556574
Energy: 1.341564363067669
Energy: 1.3647319635276833
Energy: 1.3523905041028126
Energy: 1.2446241689551294
Energy: 1.3395966955995349
Energy: 1.3611874612514778
Energy: 1.3865164767429419
Energy: 1.2905886933253559
Energy: 1.4569326833833376
Energy: 1.3295787176082334
Energy: 1.2413564226859173
Energy: 1.3423302407392697
Energy: 1.2007996807898937
Energy: 1.357581977165497
Energy: 1.3017102407417038
Energy: 1.30517771828865
Energy: 1.2961829663135915
Energy: 1.2978969491951378
Energy: 1.3552777226299504
Energy: 1.4108155089168497
Energy: 1.4512849589645258
Energy: 1.3238593271878458
Energy: 1.419005979367772
Energy: 1.3662518940917425
Energy: 1.4016566942136528
Energy: 1.321947528883724
Energy: 1.3110841547741203
Energy: 1.3488512667522643
Energy: 1.2250675086361162
Energy: 1.3080790528137836
Energy: 1.2680561130009915
Energy: 1.2520272861669046
Energy: 1.3858397362812431
Energy: 1.1855749100119415
Energy: 1.4114719522940293
Energy: 1.2632191998110704
Energy: 1.2855948315657098
Energy: 1.2810218396067357
Energy: 1.2473017893135807
Energy: 1.4223644243544549
Energy: 1.208679032702652
Energy: 1.3597686232436215
Energy: 1.3998896851568137
Energy: 1.307997225156241
Energy: 1.3323513158520708
Energy: 1.3676746688477464
Energy: 1.3361378678600349
Energy: 1.128536883158403
Energy: 1.264534285937023
Energy: 1.28389456649373
Energy: 1.3358688138104489
Energy: 1.2804575325300926
Energy: 1.2669674262524453
Energy: 1.2727237792641448
Energy: 1.3476209345052035
Energy: 1.30871005368191
Energy: 1.3478520144833617
Energy: 1.3310680120857952
Energy: 1.3188897380093514
Energy: 1.3560800690413928
Energy: 1.394142691502755
Energy: 1.357312407925661
Energy: 1.287287487318678
Energy: 1.241358581848975
Energy: 1.307090234304187
Energy: 1.3446269884392605
Energy: 1.2619366947432535
Energy: 1.2501418697816185
Energy: 1.1194271134801737
Energy: 1.3054928996773194
Energy: 1.3068289295872595
Energy: 1.3485950984125974
Energy: 1.2790596742341338
Energy: 1.2683624400298603
Energy: 1.3002621328811526
Energy: 1.2825280848538452
Energy: 1.2966600676904174
Energy: 1.3403094897262424
Energy: 1.3632626828119498
Energy: 1.3859242619727767
Energy: 1.2624530903859055
Energy: 1.265949444770855
Energy: 1.2891422101936696
Energy: 1.23365795033274
Energy: 1.258127996229754
Energy: 1.3894191221117211
Energy: 1.3965048735136574
Energy: 1.2333910502370622
Energy: 1.2699622051979707
Energy: 1.2410284316877216
Energy: 1.3419076399213468
Energy: 1.2902110540046214
Energy: 1.3043674283589215
Energy: 1.2695947956930722
Energy: 1.289426744574077
Energy: 1.3551288127167351
Energy: 1.3795871237598896
Energy: 1.286830894753784
Energy: 1.242486268231754
Energy: 1.2850567563578437
Energy: 1.349711958443812
Energy: 1.2964664439614721
Energy: 1.2329535038645523
Energy: 1.2987883854411724
Energy: 1.2915091910057201
Energy: 1.3846562939430116
Energy: 1.3579876947780405
Energy: 1.303956342556747
Energy: 1.3406443988751215
Energy: 1.324821862575036
Energy: 1.1199868406838078
Energy: 1.305411323051645
Energy: 1.2751923133208771
Energy: 1.2785470130375853
Energy: 1.3148650320252804
Energy: 1.2975425079418788
Energy: 1.2634152617176024
Energy: 1.228266454670009
Energy: 1.2826069905086497
Energy: 1.330066791852913
Energy: 1.361615063368728
Energy: 1.3562362501829566
Energy: 1.3295564375548805
Energy: 1.3166560041878974
Energy: 1.2015591452928407
Energy: 1.420826653864997
Energy: 1.257346896892103
Energy: 1.2956966525973637
Energy: 1.2761811649190824
Energy: 1.224150411551506
Energy: 1.452178645852001
Energy: 1.1909485629910044
Energy: 1.3545975914936896
Energy: 1.2334415170209863
Energy: 1.245750305919292
Energy: 1.3090861739461623
Energy: 1.238189072365517
Energy: 1.2846151029538135
Energy: 1.3859035228173928
Energy: 1.4049491810329717
Energy: 1.3917220139279822
Energy: 1.4321103732856657
Energy: 1.42948430101361
Energy: 1.4335918107299717
Energy: 1.306644667649684
Energy: 1.2054629898784532
Energy: 1.4003986109800188
Energy: 1.2594099467000714
Energy: 1.3556812525584816
Energy: 1.290755505722943
Energy: 1.2858245920596885
Energy: 1.383042130717721
Energy: 1.3738939064673035
Energy: 1.4757893338140542
Energy: 1.2715744070448822
Energy: 1.4646353597123756
Energy: 1.3091082808192016
Energy: 1.2444926391485513
Energy: 1.346407880490092
Energy: 1.3818391325805996
Energy: 1.3980353102196448
Energy: 1.2897382696850375
Energy: 1.3741022179902618
Energy: 1.3300967175961553
Energy: 1.2625090465460556
Energy: 1.3409922117794615
Energy: 1.2400540348820936
Energy: 1.465763036446931
Energy: 1.302479889625883
Energy: 1.3499159801680274
Energy: 1.2757758373192787
Energy: 1.2870292284017555
Energy: 1.4087168756434203

minimum gb energy = 1.1155213544535987 eV
minimum distance =  2.22172252422978 Angstroms
sigma value = 365


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

Energy: 1.106942604636521
Energy: 1.0768132359062756
Energy: 1.081494242187672
Energy: 1.11065948225758
Energy: 1.1105480891508992
Energy: 1.0811804204718862
Energy: 1.0768697970268826
Energy: 1.1108919970065947
Energy: 1.3189961738631117
Energy: 1.0223805694133339
Energy: 1.0246493887257062
Energy: 1.024203799572014
Energy: 1.023834148691715
Energy: 1.3077519127904262
Energy: 1.0877934184444304
Energy: 1.277384244770617
Energy: 1.0247320353435114
Energy: 1.0231103894841378
Energy: 1.0228490068674003
Energy: 1.0239067428914985
Energy: 1.0263661004731246
Energy: 1.0613972249555912
Energy: 1.2792990776977478
Energy: 1.0600953560457684
Energy: 1.0236989133182801
Energy: 1.0230448501978788
Energy: 1.024056882367699
Energy: 1.079837470742068
Energy: 1.1052943341297405
Energy: 1.3189132109592752
Energy: 1.0708705018473115
Energy: 1.3743336321251711
Energy: 1.0242284886555455
Energy: 1.0698399001800827
Energy: 1.319263109458694
Energy: 1.0889684355845346
Energy: 1.2788933293239741
Energy: 1.060252885214253
Energy: 1.0794666977367924
Energy: 1.1106580899540768
Energy: 1.0806533372458316
Energy: 1.0772178366698084
Energy: 1.0615629582422463
Energy: 1.3191877177834446
Energy: 1.0241473223710178
Energy: 1.0234516808259067
Energy: 1.023540313988057
Energy: 1.0242158889777166
Energy: 1.3075535567690468
Energy: 1.0613723107265487
Energy: 1.3212028984799526
Energy: 1.0250376650712278
Energy: 1.0230793689394615
Energy: 1.0229456563775288
Energy: 1.0246215765171014
Energy: 1.3206330707898155
Energy: 1.0886231612213786
Energy: 1.2796639386655526
Energy: 1.05997098228884
Energy: 1.0244674823003066
Energy: 1.0236864912647448
Energy: 1.0602033625398142
Energy: 1.0780878676838603
Energy: 1.1050132930805359
Energy: 1.389983037982072
Energy: 1.0706771915856532
Energy: 1.3741126425867567
Energy: 1.3739831427118732
Energy: 1.0695100438709493
Energy: 1.3885080713984403
Energy: 1.0884477998350985
Energy: 1.2796960452919175
Energy: 1.0603762006127515
Energy: 1.0239302468239366
Energy: 1.0239476041549018
Energy: 1.024302074585852
Energy: 1.0786985373390683
Energy: 1.0603613701861008
Energy: 1.306706026336563
Energy: 1.024302214290348
Energy: 1.0231763867473627
Energy: 1.022692517519009
Energy: 1.0246914945948802
Energy: 1.3083994608438454
Energy: 1.0604183750687477
Energy: 1.318085686743173
Energy: 1.0242975881358485
Energy: 1.0239057977414392
Energy: 1.0235203682097567
Energy: 1.0236693070255911
Energy: 1.3220150629144285
Energy: 1.107936461474466
Energy: 1.2798349424966136
Energy: 1.0815341136837748
Energy: 1.0229515891515422
Energy: 1.1108813029921563
Energy: 1.0813081559614655
Energy: 1.0780389208363133
Energy: 1.1050309665051994
Energy: 1.3185665033835094
Energy: 1.0712117301159405
Energy: 1.0242527849763714
Energy: 1.023331103447473
Energy: 1.0225163972452023
Energy: 1.320281474935752
Energy: 1.087763550229714
Energy: 1.2783620192162664
Energy: 1.024806580926531
Energy: 1.0234085742054075
Energy: 1.0230114287801093
Energy: 1.0243714776515298
Energy: 1.0806414919137084
Energy: 1.087692154799318
Energy: 1.2783688860016322
Energy: 1.0254273421502764
Energy: 1.0231721067411041
Energy: 1.0228572942565284
Energy: 1.0244586277326209
Energy: 1.0805934879753658
Energy: 1.1113827494008262
Energy: 1.3187057136115707
Energy: 1.0226003329391962
Energy: 1.0245321213198375
Energy: 1.0248937107924088
Energy: 1.024315933260763
Energy: 1.3203720701766466
Energy: 1.107256362907522
Energy: 1.279320295541125
Energy: 1.0815571200787446
Energy: 1.1109534460678887
Energy: 1.1107918492837427
Energy: 1.0812481309829387
Energy: 1.0767338227960024
Energy: 1.0608504837866013
Energy: 1.318861818835496
Energy: 1.0244962903307562
Energy: 1.0239528205167854
Energy: 1.0238564322352774
Energy: 1.0238949082700426
Energy: 1.3215464210875651

minimum gb energy = 1.0223805694133339 eV
minimum distance =  2.27525294346973 Angstroms
sigma value = 23