Model name: model_name=MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_001
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.176897808909416
cohesive_energy=7.38391435376031
mass=55.845
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=[3.1990660851077996e-19, 4.60371036190194e-19, 5.68582046050554e-19, 6.570606484865699e-19, 7.316147337964919e-19, 7.955640119659679e-19, 8.51031367035048e-19, 8.99484392800476e-19, 9.41994945430398e-19, 9.793721241249839e-19, 1.012250390831298e-18, 1.041132829012416e-18, 1.066439208946446e-18, 1.0908643917317758e-18, 1.11042857060955e-18, 1.1270062922415479e-18, 1.141091027031042e-18, 1.152867025290942e-18, 1.1624961068612818e-18, 1.1701224676391219e-18, 1.1758726795785479e-18, 1.1798588950439399e-18, 1.182183653339874e-18, 1.182939880711122e-18, 1.182129179334318e-18, 1.1795128248909959e-18, 1.1747751885842579e-18, 1.1675445654350158e-18, 1.157378754692286e-18, 1.143752242420116e-18, 1.1260289644948079e-18, 1.103449489191846e-18, 1.0750861562401439e-18, 1.039812635466e-18, 9.962462484342718e-19, 9.42675870499848e-19, 8.7697541326941e-19, 7.96472446117446e-19, 6.9777195675651e-19, 5.765432617449e-19, 4.2716272109727597e-19, 2.42255515767336e-19, 1.2017093799784318e-20, -2.76812863586082e-19, -6.425000672367779e-19, -1.110712155873768e-18, -1.71839852703036e-18, -2.5203039541137e-18, -3.60021907072872e-18, -5.09168529931932e-18, -7.218222302094839e-18, -1.037760247197846e-17, -1.533661152423624e-17, -2.3741534015602197e-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: 0.02413498839285668
Energy: 0.1399400002148553
Energy: 0.14367404700825295
Energy: 0.14185135580138072
Energy: 0.030142405304576604
Energy: 0.025840097879172214
Energy: 0.13983186089084723
Energy: 0.14527169677716978
Energy: 0.14125355897652633
Energy: 0.029212721590795396
Energy: 0.1402288586177682
Energy: 0.15105321093371538
Energy: 0.13964564368945345
Energy: 0.14710053181513127
Energy: 0.143820920551718
Energy: 0.1401838380922595
Energy: 0.14899049431879177
Energy: 0.1395854972675969
Energy: 0.14583004689755952
Energy: 0.1431549962331066
Energy: 0.14367137007195518
Energy: 0.032939452744358826
Energy: 0.024747485135239788
Energy: 0.141000027694952
Energy: 0.14227364852730756
Energy: 0.1424838654303554
Energy: 0.03182152969918802
Energy: 0.02467414027294789
Energy: 0.1408480153019364
Energy: 0.1444272286189891
Energy: 0.14258657460526772
Energy: 0.025796878787371597
Energy: 0.025865358512714057
Energy: 0.14815770922433122
Energy: 0.1401645544291336
Energy: 0.14380323652574792
Energy: 0.02609620031876654
Energy: 0.0251125066947939
Energy: 0.14533410311876382
Energy: 0.14028789024078747
Energy: 0.14182993521136994
Energy: 0.14168661529186774
Energy: 0.14497130316866208
Energy: 0.026322749608387982
Energy: 0.025012772391192012
Energy: 0.14134504065045683
Energy: 0.1424771191837405
Energy: 0.14445813526986043
Energy: 0.03257843463989286
Energy: 0.14882022721107038
Energy: 0.14494507397859324
Energy: 0.1403815650722715
Energy: 0.1421504160944478
Energy: 0.025519566750452697
Energy: 0.029668073598265513
Energy: 0.1455469343940128
Energy: 0.1395982795216006
Energy: 0.14343466431961052
Energy: 0.026318470535935747
Energy: 0.03092575402219262
Energy: 0.03071147749082329
Energy: 0.14668140000883795
Energy: 0.14530656808900033
Energy: 0.14019678818535325
Energy: 0.14719908181194355
Energy: 0.03521891331276535
Energy: 0.14826766252231952
Energy: 0.14232584579033666
Energy: 0.14107134293035054
Energy: 0.14537203887955857

minimum gb energy = 0.02413498839285668 eV
minimum distance =  2.90476224769684 Angstroms
sigma value = 3


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

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Energy: -0.1247413351714117
Energy: -0.09051807302843694
Energy: -0.12312386075871151
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Energy: 0.9575592284006835
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Energy: -0.09760367967263311
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Energy: 0.8765278941106945
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Energy: -0.461657978072624
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Energy: 1.2920507747418981
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Energy: 1.1492763844656941
Energy: 1.0822767173659014
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Energy: 1.0848113946768836
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Energy: 1.065150438740269
Energy: 1.1822729933950613
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Energy: 0.6828659039824834
Energy: 1.2524351581691866
Energy: 1.0632852071045558
Energy: 1.1816661359766534
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Energy: 1.1390691082087452
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Energy: 0.9935178322229021
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Energy: 0.8318753155247605
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Energy: 0.9341421496389797
Energy: 0.9519610513719378
Energy: 0.6822671849564361
Energy: 1.1644727430942565
Energy: 1.0645967051805463
Energy: 0.9447126806783747
Energy: 1.082000572489236
Energy: 0.7780840527729515
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Energy: 0.8841046615052112
Energy: 0.9451936921847415
Energy: 0.8743339868974022
Energy: 0.8135758885637033
Energy: 0.9421167523194209
Energy: 0.8409407712351025
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Energy: 0.7965125591365236
Energy: 0.9743907389223148
Energy: 0.9060730304318713
Energy: 1.0374172131206882
Energy: 0.8353693872020308
Energy: 0.9947479469791168
Energy: 0.9393154909024113
Energy: 0.938603624128222
Energy: 0.9410559173951102
Energy: 0.8268220283858415
Energy: 0.8473634781643293
Energy: 0.9207573684682349
Energy: 0.8436541070925395
Energy: -0.9651698613145837
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Energy: 0.40004761342308187
Energy: 1.1717978040318908
Energy: 0.8611356560499903
Energy: 1.1015764543325053
Energy: -0.13792256139206402
Energy: 0.9353040120329877
Energy: 0.9436733554692666
Energy: 0.04213027378421484
Energy: -0.02117048517624225
Energy: 0.9427486387019568
Energy: 1.037076772624297
Energy: 0.9903814545340172
Energy: 1.0031921659701788
Energy: -0.9683852143630566
Energy: 1.0662363900975018
Energy: -0.011760071181483851
Energy: 0.986050985879633
Energy: 1.0071003892089285
Energy: 0.9267811827617437
Energy: 0.9890307851145906
Energy: 0.8636767837430224
Energy: -0.6854266019328069
Energy: 1.0195756121096335
Energy: -0.15830594850607888
Energy: -0.46356826192198264
Energy: -0.2179511094707472
Energy: 1.3228073187689178
Energy: 1.17466085264976
Energy: 0.9341638734418697
Energy: 0.8649084259135958
Energy: -0.8946166655980748
Energy: -0.10605401500813962
Energy: 0.8842568760134132
Energy: -0.3090255129287489
Energy: 0.00860400106304062
Energy: -0.2938954519396878
Energy: 0.05194886232606311
Energy: 0.9554385314127805

minimum gb energy = -1.0918495467380787 eV
minimum distance =  2.59673316318176 Angstroms
sigma value = 75


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

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Energy: 1.2046770756396865
Energy: 1.23020003176437
Energy: 1.1678806719077997
Energy: 1.0948341997148556
Energy: 1.1800133321326784
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Energy: 1.1911301536836267
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Energy: 1.1578461839788172
Energy: 1.2334623726283398
Energy: 0.9828845711897388
Energy: 1.2082861032853667
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Energy: 0.991715601161332
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Energy: 1.3054428902854438
Energy: 1.191685123874228
Energy: 1.1920207464703318
Energy: 1.1938538544539525
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Energy: 1.1638773618014204
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Energy: 1.2339935624161453
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Energy: 1.2135040401853803
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Energy: 1.1803949123859334
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minimum gb energy = 0.8132369709855609 eV
minimum distance =  2.55260821247291 Angstroms
sigma value = 105


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

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Energy: 1.1488954412986438
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Energy: 1.030412692260372
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Energy: 1.032079494366793
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Energy: 1.159045783901823
Energy: 1.1591729802943163
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Energy: 1.041535002543805
Energy: 1.1810285649978596
Energy: 1.13083659623539
Energy: 1.127434345041468
Energy: 1.0170179819493552
Energy: 1.0286595468179214
Energy: 1.1574184198846627
Energy: 1.1743715765583227
Energy: 1.064648809748824
Energy: 1.0735129527060328
Energy: 1.014368804714201
Energy: 1.1264016041589904
Energy: 1.0575601046045024
Energy: 1.053416038549714
Energy: 1.0514768220328343
Energy: 1.0297579256192992
Energy: 1.1376972113776298
Energy: 1.0500454780895154
Energy: 1.028832718629462
Energy: 1.0594303183507505
Energy: 1.0490808319254614
Energy: 1.2662279443619882
Energy: 1.0116919658230574
Energy: 1.0633537440003535
Energy: 1.0478336826503551
Energy: 1.1655478620004045
Energy: 1.1765001750064383
Energy: 1.1657502163349203
Energy: 0.9440011102782648
Energy: 1.1189048681893297
Energy: 1.1100113207233322
Energy: 1.1183945075552781
Energy: 1.1710591161086705
Energy: 0.932816560565913
Energy: 1.1566278316313614
Energy: 1.1688515283105083
Energy: 1.120463473409389
Energy: 1.1731482695324305
Energy: 1.1537394058601018
Energy: 1.1157006182737286
Energy: 1.1328296939699096
Energy: 1.1485467322792178
Energy: 1.1383729748449116
Energy: 1.1544382704097778
Energy: 1.1392197145032326
Energy: 1.1353101641562138
Energy: 1.1203823245009348
Energy: 1.0953508360418285
Energy: 1.2049379915282963
Energy: 1.0116358845673148
Energy: 0.9637870829694797
Energy: 1.0958444985244975
Energy: 1.0507810010997698
Energy: 1.1629139622930171
Energy: 0.9809038348352576
Energy: 1.0986639083425083
Energy: 1.1519764160903054
Energy: 1.1043973066835748
Energy: 0.9636986046388651
Energy: 0.9819584332056238
Energy: 0.9846236392418702
Energy: 0.9634886219237048
Energy: 1.2849406388624331
Energy: 0.9676471866515056
Energy: 0.9767569457997941
Energy: 0.984751573951608
Energy: 1.027833339731995

minimum gb energy = 0.7877023041745161 eV
minimum distance =  2.62191939645067 Angstroms
sigma value = 165


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

Energy: 1.9986534736639703
Energy: 0.49229730543613875
Energy: 0.3464831775472295
Energy: 0.3466676331458946
Energy: 1.0613595999316439
Energy: 1.1587643470632285
Energy: 1.072497455016387
Energy: 1.1584694482495579
Energy: 0.34690731876815384
Energy: 1.1067517239484206
Energy: 1.2046706271776075
Energy: 1.2153286513332673
Energy: 1.1462763512893273
Energy: 0.44697728243382684
Energy: 1.1197771617121592
Energy: 1.1039888564183005
Energy: 0.2919045012918278
Energy: 0.34662435204079994
Energy: 1.1851795549999142
Energy: 1.1480046155675598
Energy: 1.193729302162589
Energy: 1.2391147822384196
Energy: 1.2053712626701374
Energy: 1.1774284958691466
Energy: 1.128999322273645
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Energy: 0.00657814031765846
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Energy: 1.0894502118789369
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Energy: 1.1985556562800725
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Energy: 1.080434598468188
Energy: 1.2471991442175936
Energy: 1.1643413840432228
Energy: 1.1956867109344358
Energy: 1.1669917943717347
Energy: 1.189875100287739
Energy: 1.2806628065766827
Energy: 1.1883401387537436
Energy: 1.1849221807478154
Energy: 1.1820184699959053
Energy: 1.1423997526037128
Energy: 1.111776676563321
Energy: 1.1727883923246292
Energy: 1.195825567834088
Energy: 1.1945053713198772
Energy: 1.1265393272094109
Energy: 1.1428913403509027
Energy: 1.131093236879784
Energy: 1.1891425591512559
Energy: 1.2327246493213595
Energy: 1.1272633948554311
Energy: 1.1830879248969943
Energy: 1.1942346076144756
Energy: 1.2005239345631409
Energy: 1.2252068329189065
Energy: 1.1851650729857275
Energy: 1.1829517421694102
Energy: 1.1060313731883369
Energy: 1.189276879864829
Energy: 1.1909774424294708
Energy: 1.2010110097762363
Energy: 1.1837411869429164
Energy: 1.2402836481589856
Energy: 1.146266325491356
Energy: 0.00675125318564132
Energy: 0.2851501597080388
Energy: 1.1113947431218127
Energy: 1.1223109817574415
Energy: 1.1105796807632042
Energy: 1.2192197228527557
Energy: 1.1660506831350832
Energy: 1.2075353500616604
Energy: 1.1562499708786285
Energy: 1.2069572676735056
Energy: 1.1141143627098484
Energy: 0.006527269849166844
Energy: 1.1612012444169144
Energy: 1.1348715744394682
Energy: 1.1471865195452888
Energy: 1.114627571124369
Energy: 1.111118774856145
Energy: 1.1078377722703474
Energy: 1.2787857480030032
Energy: 1.0962821352199805
Energy: 0.3463607460022999
Energy: 0.29424426703077383
Energy: 1.067873455090215
Energy: 1.218971523115798
Energy: 0.34673891198491025
Energy: 0.3463939828277318
Energy: 1.2153427817631686

minimum gb energy = 0.006527269849166844 eV
minimum distance =  2.57454071611964 Angstroms
sigma value = 41


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

Energy: 1.30310988271336
Energy: 0.8464383651370693
Energy: 0.8628712825913487
Energy: 0.870805002387276
Energy: 0.8766825500030989
Energy: 0.9509794083813133
Energy: 0.8686286399002766
Energy: 0.8878525184086417
Energy: 0.9030474246540701
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Energy: 0.962220189415099
Energy: 0.9580045275734547
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Energy: 1.011648786095402
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Energy: 1.0005504275751478
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Energy: 0.9728840058640652
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Energy: 0.9885557073484242
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Energy: 0.9841405557274897
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Energy: 1.0174149071592469
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Energy: 0.9928416031400946
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Energy: 1.0006441631912997
Energy: 0.9603538980209922
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Energy: 0.9636230903798645
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Energy: 0.9464580166577503
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Energy: 1.1065091632742796
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Energy: 0.8978449379733493
Energy: 0.9881438828813672
Energy: 0.9396264866622106
Energy: 0.948455906705231
Energy: 0.9919790051178596
Energy: 1.1568845399194725
Energy: 1.0147282091235055
Energy: 1.0274597444961668
Energy: 0.9587626202177718
Energy: 0.9762846183375669
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Energy: 1.014417630343811
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Energy: 0.9578380195913696
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Energy: 0.9603858554764813
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Energy: 0.952697761075136
Energy: 0.9544509213802954
Energy: 0.9684572550240056
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Energy: 0.9578674669971949
Energy: 0.969075439450305
Energy: 1.0132243657773938
Energy: 0.992089909742776
Energy: 0.9486610447300557
Energy: 0.9193974431077948
Energy: 0.9671163010828823
Energy: 1.024122207299781
Energy: 1.0205290384873478
Energy: 0.9545355528970348
Energy: 0.9010990918127346
Energy: 0.9814322335769444
Energy: 1.0049574535617698
Energy: 0.9686347661793312
Energy: 0.9558517430281661
Energy: 0.9375160561651587
Energy: 0.9505367619785754
Energy: 1.1577696883915245
Energy: 0.876917570792324
Energy: 0.9538575137737215
Energy: 0.9209100064261746
Energy: 0.9603918901187853
Energy: 1.0295631301819252
Energy: 0.9046621756204793
Energy: 0.8674883791593846
Energy: 0.8949567646754673
Energy: 0.9338467970096295
Energy: 0.9869453416896157
Energy: 0.8855251739268454
Energy: 0.9166371712158836
Energy: 0.9054287525155865
Energy: 0.99113813714671
Energy: 0.9988520300297905
Energy: 0.9195596710327582
Energy: 0.8642668394795073
Energy: 0.8985354719317712
Energy: 0.9400871061213878
Energy: 0.9620321048232697
Energy: 0.9220434177794791
Energy: 0.8645311182210362
Energy: 0.9345002645727181
Energy: 0.9694748430570985
Energy: 0.8689952573773992
Energy: 0.9060752826892613
Energy: 0.9282035362225989
Energy: 0.9056026609704397
Energy: 0.9507118326686895
Energy: 0.8693135057189606
Energy: 0.9102885514604373
Energy: 0.9109507300024369
Energy: 0.9033973788855474

minimum gb energy = 0.8453054038135418 eV
minimum distance =  2.62350198590733 Angstroms
sigma value = 185


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

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Energy: 0.8303182087896962
Energy: 0.5710756013296785
Energy: 0.7679969488820526
Energy: 0.5215424393410917
Energy: 0.5204712350243073
Energy: 0.7607965627735743
Energy: 1.440306296077294
Energy: 0.589334529276044
Energy: 0.7214065279250521
Energy: 0.7240351971307216
Energy: 0.6518608649273118
Energy: 0.7607020130500727
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Energy: 0.6601996523894595
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Energy: 0.9388638839599575
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Energy: 0.46888409922013075
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Energy: 0.6968677805112886
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Energy: 0.9437659294081476
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Energy: 0.7752683392163576
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Energy: 0.8610055200405963
Energy: 0.6986812776875054
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Energy: 0.7148201171812498
Energy: 0.6641925933183059
Energy: 0.9415107381956261
Energy: 0.7307283752233531
Energy: 0.5428197326746603
Energy: 0.837371894005472
Energy: 0.7211131248333631
Energy: 0.8529013619564502
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Energy: 0.40834561515986767
Energy: 0.871881911978124
Energy: 0.7860413319407618
Energy: 0.9277230721213925
Energy: 0.47110337251865736
Energy: 0.4697598703281848
Energy: 0.6607240954830393
Energy: 0.9414162753763432
Energy: 0.865672898947521
Energy: 0.4052967969241806
Energy: 0.3984099706010864
Energy: 0.8674633455254523
Energy: 1.4324083368164438
Energy: 0.7702750166767461
Energy: 0.46767852691719003
Energy: 0.46923414727370977
Energy: 0.8897450456473366
Energy: 0.7912414693954404
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Energy: 0.7019279389517109
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Energy: 0.8221691586091143
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Energy: 0.9739369014273053
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Energy: 0.4680476999495918
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Energy: 1.623359405255048
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Energy: 0.40541023233589185
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Energy: 0.8812658480832044
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Energy: 0.9276943746354666
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Energy: 0.8950728676305029
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Energy: 0.8082977505847178
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Energy: 0.3974945436840533
Energy: 0.9780126537044127
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Energy: 1.0080148024001696
Energy: 0.9205890747779631
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Energy: 0.8598238483143897
Energy: 1.6522618855917188
Energy: 0.7906180638632564
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Energy: 0.8629147703042664
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Energy: 1.0276615748960605
Energy: 0.7556991040642747
Energy: 0.4060654691949815
Energy: 0.8739370401274167
Energy: 0.8765592222046327
Energy: 0.8979238180513893
Energy: 0.8579950660720456
Energy: 0.4701950284454039
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Energy: 0.9873963478838149
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Energy: 0.40895814951778625
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Energy: 0.898605674920759
Energy: 0.4662010350692363
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Energy: 0.9029615182766377
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Energy: 0.7077989336591787
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Energy: 0.7146386626115956
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Energy: 0.668508966360695
Energy: 0.648820418259857
Energy: 0.7010562016301832
Energy: 0.712817429454252
Energy: 0.7656931653351301
Energy: 0.7559446514063005
Energy: 0.4686837856175891
Energy: 0.4682726277621145
Energy: 0.707121409903636
Energy: 1.5186605270782791
Energy: 0.726272088941929
Energy: 0.5396054963133489
Energy: 0.5389476392280859
Energy: 0.728525598982265
Energy: 0.9010063465271838
Energy: 0.7450579791178261
Energy: 0.7332713934472536
Energy: 0.46984940610001147
Energy: 0.7268537967144727
Energy: 0.8991693198390818
Energy: 0.6303935987941455
Energy: 0.6613767537625068
Energy: 0.6294188143181889
Energy: 0.7315235104593533
Energy: 0.8511070147230043
Energy: 0.6960764306314523
Energy: 0.5370857691574568
Energy: 0.6994578151316981
Energy: 0.7561028305268197
Energy: 0.7818310988517477
Energy: 0.7851618649004475
Energy: 0.5268682640959993
Energy: 0.7910820216780219
Energy: 0.8982755482393963
Energy: 0.7028089428814955
Energy: 0.5393694389513062
Energy: 0.5305941334729045
Energy: 0.6289128119921535
Energy: 0.5157319373779382
Energy: 0.7231621075291912
Energy: 0.5308331388296381
Energy: 0.5216622794491605
Energy: 0.7205308126284405
Energy: 1.482304369868569
Energy: 0.8198700682737982
Energy: 0.6945118509084471
Energy: 0.6954022104573913
Energy: 0.7647321121063079
Energy: 0.820602704776942
Energy: 0.7027615504407031
Energy: 0.6995925506985518
Energy: 0.6928835191653963
Energy: 0.695932999818869
Energy: 0.822188038542631
Energy: 0.6892793031453034
Energy: 0.816194479983646
Energy: 0.8420336652069832
Energy: 0.5614206461973317
Energy: 0.8178028306774481
Energy: 0.5714891443547311
Energy: 0.5185080040454314
Energy: 0.5447668112351255
Energy: 0.7615723666230907
Energy: 0.7254921194601306
Energy: 0.7110578128678222

minimum gb energy = 0.31329630852532864 eV
minimum distance =  2.64054796459881 Angstroms
sigma value = 33


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

Energy: 0.8572494027077234
Energy: 0.8538901049387253
Energy: 0.8217222190856228
Energy: 0.80100374558741
Energy: 0.8135785226070092
Energy: 0.8128437744643774
Energy: 0.8345117909548452
Energy: 0.8187782544861958
Energy: 0.830551892164047
Energy: 0.8233125736103932
Energy: 1.0801061223265642
Energy: 0.8229265179177573
Energy: 0.8773042895380064
Energy: 0.8791589211515709
Energy: 0.8340555948755746
Energy: 0.9472682505901152
Energy: 0.8982872436932413
Energy: 0.8595028128752042
Energy: 0.9013229341661958
Energy: 0.8188824394864413
Energy: 0.8322449712758626
Energy: 0.7810032902725135
Energy: 0.8996309025634842
Energy: 0.8261356078808677
Energy: 0.9137161830497472
Energy: 0.8108512984180476
Energy: 0.8135524691219943
Energy: 0.8306633975119156
Energy: 0.7831023961725982
Energy: 1.0118542901011274
Energy: 0.8886605283253091
Energy: 0.8654660256071192
Energy: 0.8379662728191601
Energy: 0.8417786141961117
Energy: 0.9953512248387928
Energy: 0.844342030773706
Energy: 0.8588491056312723
Energy: 0.8563681286443278
Energy: 0.865059667050748
Energy: 0.9078102249732309
Energy: 0.85686676709987
Energy: 0.838404275201016
Energy: 0.8585166002052567
Energy: 0.8429684356621675
Energy: 1.00552861961883
Energy: 0.861363876191245
Energy: 0.8381240927808342
Energy: 0.858978463285274
Energy: 0.8567793364551108
Energy: 0.9425626094130326
Energy: 0.7700383244238839
Energy: 0.8389305491217618
Energy: 0.947949773075219
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Energy: 0.8113142364340481
Energy: 0.8168965774536466
Energy: 0.8698433467546464
Energy: 0.7696629017384184
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Energy: 0.8296270300788456
Energy: 0.920665459903544
Energy: 0.7692672142705107
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Energy: 1.1042308237088545
Energy: 0.8283098335707484
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Energy: 0.8285222980207394
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Energy: 0.8242708038924802
Energy: 0.8458574527720424
Energy: 0.7823532018216074
Energy: 0.7722930525083767
Energy: 0.8215605952289837
Energy: 0.8188748665272366
Energy: 0.8576442660637353
Energy: 0.8095512245970123
Energy: 0.8223270745144176
Energy: 0.8166238379814768
Energy: 0.8221978719446856
Energy: 0.7539412923469456
Energy: 0.7836773553657039
Energy: 0.8241363193752597
Energy: 0.8167159088398915
Energy: 0.8209369530820677
Energy: 0.7535959496202888
Energy: 0.7730021383422342
Energy: 0.8217282134893983
Energy: 0.8087096032430104
Energy: 0.8225932745124743
Energy: 0.8117522462880442
Energy: 0.7449079436624558
Energy: 0.8205003569147163
Energy: 1.0116554978921872
Energy: 0.8217954976088737
Energy: 0.8209212730855652
Energy: 0.8073323227247236
Energy: 0.7929929427881256
Energy: 0.8493980935244438
Energy: 0.8247028681414483
Energy: 0.8217644927340689
Energy: 0.8465325277018727
Energy: 0.7922876561836556
Energy: 0.8567505905204869
Energy: 0.8223944897126333
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Energy: 0.9542040212173951
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Energy: 0.820691127698301
Energy: 0.7781987799946666
Energy: 0.8231445088297074

minimum gb energy = 0.7423495056816247 eV
minimum distance =  2.64691668834102 Angstroms
sigma value = 219


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

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Energy: 1.177101091965966
Energy: 1.0551758463946437
Energy: 1.1491654332545116
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Energy: 1.0984228562477298
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Energy: 0.9620435083151926
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Energy: 1.1951696631848694
Energy: 1.0563368503595867
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Energy: 1.1346971577725626
Energy: 1.0713430163195146
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Energy: 1.132475406638228
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Energy: 0.9603907477795592
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Energy: 0.960234361942046
Energy: 1.1498318559206877
Energy: 1.1477992601460667
Energy: 1.0844747543829591
Energy: 1.1758217143315222

minimum gb energy = 0.960234361942046 eV
minimum distance =  2.67343740603154 Angstroms
sigma value = 15


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

Energy: 1.4155922226706883
Energy: 1.3876910777994347
Energy: 1.4754525361760942
Energy: 1.4535775156227704
Energy: 1.313539885181584
Energy: 1.5284690172403763
Energy: 1.366476012832427
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Energy: 1.3264875315652866
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Energy: 1.407529462172343
Energy: 1.4788517717240452
Energy: 1.5588185817470823
Energy: 1.3071760291624888
Energy: 1.4959227597335356
Energy: 1.3735141600065435
Energy: 1.530366950143298
Energy: 1.4410665100466216
Energy: 1.2846026718659775
Energy: 1.636553067244186
Energy: 1.504159200556039
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minimum gb energy = 1.1625407898439801 eV
minimum distance =  2.62475604134644 Angstroms
sigma value = 293


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

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Energy: 1.1983023494168228
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Energy: 1.2566424152749003
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Energy: 1.587404943710214
Energy: 1.3859770970634426
Energy: 1.49840659836373
Energy: 1.2557330176213546
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Energy: 1.6087602146290592
Energy: 1.2554885626329313
Energy: 1.3981804155622732
Energy: 1.4150474907446577
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Energy: 1.2588332150702861
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Energy: 1.2777046799198561
Energy: 1.2953627615713614
Energy: 1.277506705556367
Energy: 1.258969203380002
Energy: 1.5091765862832944
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Energy: 1.317796520515323
Energy: 1.405867550890896
Energy: 1.2572591339551398
Energy: 1.57530716303167
Energy: 1.2604496302175625
Energy: 1.4754055964532822
Energy: 1.2438839982164245
Energy: 1.2568351311927777
Energy: 1.2817300068237274
Energy: 1.2642280761336229
Energy: 1.4740559462078235
Energy: 1.2438137640407005
Energy: 1.2822053881822986
Energy: 1.5735239823667013
Energy: 1.2841351699264507
Energy: 1.276660233084256
Energy: 1.2816713471048613
Energy: 1.115518636515048
Energy: 1.5765107120351962
Energy: 1.2839397649408966
Energy: 1.2447412741145527
Energy: 1.2817475039733708
Energy: 1.2932360826582325
Energy: 1.5186458129315894
Energy: 1.4962079186030097
Energy: 1.423219096381522
Energy: 1.4238315688645482
Energy: 1.293471942019614
Energy: 1.455968330438405
Energy: 1.4968857839485163
Energy: 1.4230643211688416
Energy: 1.288805858585481
Energy: 1.4369797535016158
Energy: 1.2595411511784125
Energy: 1.422392402274918
Energy: 1.5203500730080421
Energy: 1.2679846410920845
Energy: 1.4287818148279858
Energy: 1.2578171602067907
Energy: 1.4223303125396534
Energy: 1.489147512681007
Energy: 1.4242070376890203

minimum gb energy = 1.0828008480378606 eV
minimum distance =  2.64852018181457 Angstroms
sigma value = 293


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

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Energy: 1.4276165085907855
Energy: 1.525344797848799
Energy: 1.4283557832710745
Energy: 1.4233011348166866
Energy: 1.6027136825491382
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Energy: 1.426347824711614
Energy: 1.527520237206539
Energy: 1.426952411105088
Energy: 1.4266627731109758
Energy: 1.6035952798716793
Energy: 1.5183660199486475
Energy: 1.429050877237993
Energy: 1.426603001406976
Energy: 1.4265435840305496
Energy: 1.6049530190951524
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Energy: 1.4279862235901344
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Energy: 1.5255796780290234
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Energy: 1.5188200370267864
Energy: 1.4254313692960952
Energy: 1.4279242759646933
Energy: 1.5264052803758157
Energy: 1.4269304074691804
Energy: 1.517641155833901
Energy: 1.4236730532487814
Energy: 1.4286741513773815
Energy: 1.5219610889111574
Energy: 1.4260539280788747
Energy: 1.4272589690309514
Energy: 1.628885293573031
Energy: 1.4252742006533026
Energy: 1.5238827322803217
Energy: 1.4256386389374454
Energy: 1.4270174736163044
Energy: 1.519883237738047
Energy: 1.4260682127563558
Energy: 1.524758795678064
Energy: 1.4278103309454244
Energy: 1.603120621801161
Energy: 1.4256661640833892
Energy: 1.4269526416174727
Energy: 1.626743105992039
Energy: 1.42792821929359
Energy: 1.602577157159916
Energy: 1.425133765867245
Energy: 1.4266091170722288
Energy: 1.4238488512161183
Energy: 1.4259045396268952
Energy: 1.4252797706358893
Energy: 1.5253384312342817
Energy: 1.427730503039138
Energy: 1.4272111481411975
Energy: 1.4256803847165929
Energy: 1.4249724927133764
Energy: 1.4271502358085022
Energy: 1.5174786708421182
Energy: 1.4271657344762068
Energy: 1.6275894726333637
Energy: 1.4280729612335317
Energy: 1.4272890430719902
Energy: 1.5171117699090642
Energy: 1.5168927506490566
Energy: 1.6295604662142111
Energy: 1.4276922237725722
Energy: 1.4292228769308946
Energy: 1.5251321084819551
Energy: 1.4254592297319537
Energy: 1.4241672398931517
Energy: 1.5255617497978766
Energy: 1.5261399039618602
Energy: 1.4254422426931508
Energy: 1.4252395216740326
Energy: 1.526115622105252
Energy: 1.5249403152050536
Energy: 1.6268950299699965

minimum gb energy = 1.42311463001814 eV
minimum distance =  2.60288315216556 Angstroms
sigma value = 15


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

Energy: 1.4204942486788092
Energy: 1.3720513005963382
Energy: 1.5116806529615516
Energy: 1.3739806691321836
Energy: 1.4093740750962027
Energy: 1.3875762814029258
Energy: 1.3954602059402172
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Energy: 1.4260922557007933
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Energy: 1.3920904607620894
Energy: 1.4273347858212329
Energy: 1.5083615576522114
Energy: 1.458453500400077
Energy: 1.3890354068755624
Energy: 1.4147132215575577
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Energy: 1.4490768740146416
Energy: 1.454329944592814
Energy: 1.6509359184604027
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Energy: 1.4321449993909152
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Energy: 1.4227816043550223
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Energy: 1.4742694259896778
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Energy: 1.451314940969779
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Energy: 1.4047082994582747
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Energy: 1.402990479830907
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Energy: 1.5014334206651325
Energy: 1.5869575628945802
Energy: 1.4922553678355055
Energy: 1.3415607196469457
Energy: 1.4643565067620183
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Energy: 1.5973252090947248
Energy: 1.5121119790221027
Energy: 1.343076513461721
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Energy: 1.3233407617790245
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Energy: 1.4767924458110935
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Energy: 1.598385140205945
Energy: 1.475221669831044
Energy: 1.4069117297031546
Energy: 1.3928739773125822
Energy: 1.3270845827665458
Energy: 1.5938167811305302
Energy: 1.486842779378736
Energy: 1.4423774418947202
Energy: 1.382591009415823
Energy: 2.0756246063684762
Energy: 1.4000602259766348
Energy: 1.4087917621416925
Energy: 1.3986087357203127
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Energy: 1.399461377862875
Energy: 1.3995913741954984
Energy: 1.387855921175126
Energy: 1.6002654745177705
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Energy: 1.4027898654003452
Energy: 1.4743062181096964
Energy: 1.5285357089658795
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Energy: 1.4321305323809426
Energy: 1.4953650649263355
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Energy: 1.4297292789401927
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Energy: 1.4315981399771558
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Energy: 1.4806835944487844
Energy: 1.4142100394952892
Energy: 1.6523454995860098
Energy: 1.4644991438059791
Energy: 1.422247574351462
Energy: 1.4583964995154153
Energy: 1.4170096559367171
Energy: 1.6730293457895016
Energy: 1.4590875736891602
Energy: 1.4204338640916012
Energy: 1.4181125682780649
Energy: 1.470600193406733
Energy: 1.3669084189624507
Energy: 1.4196873469162756
Energy: 1.4359237158258658
Energy: 1.4209390123369485
Energy: 1.3631262866460792
Energy: 1.4187538723602815
Energy: 1.4175184917233967
Energy: 1.4340589232372993
Energy: 1.4283702524112163
Energy: 1.4670324972339805
Energy: 1.4336110779528006
Energy: 1.3934358112896978
Energy: 1.3715374879195472
Energy: 1.5283501411485374
Energy: 1.4446283817086207
Energy: 1.4314269816130876
Energy: 1.351524101482661
Energy: 1.3682691089268606
Energy: 1.4346711173064968
Energy: 1.506198754039477
Energy: 1.463036757558725
Energy: 1.423305310103257
Energy: 1.3797995599251227
Energy: 1.3903140420571745
Energy: 1.5537172743191698
Energy: 1.4456104063879864
Energy: 1.4215622661430474
Energy: 1.3793435421572067
Energy: 1.3965732455031274
Energy: 1.4898936394873317
Energy: 1.4244279106893833
Energy: 1.3760026072253515
Energy: 1.4176566389230107
Energy: 1.516413224212678
Energy: 1.475077901154862
Energy: 1.4381199968606961
Energy: 1.3824427476134613
Energy: 1.4226529748071568
Energy: 1.4938701885428405
Energy: 1.5602388327831698
Energy: 1.51076194673622
Energy: 1.5205008842772254
Energy: 1.4225535736639296
Energy: 1.4324785260776836
Energy: 1.52012390835719
Energy: 1.4283528646947674
Energy: 1.5165904030064534
Energy: 1.474639138337191
Energy: 1.3917884967909995
Energy: 1.5547488097903615
Energy: 1.3129200951271423
Energy: 1.415364069903224
Energy: 1.3386857649911166
Energy: 1.3559985503924925
Energy: 1.5528453817068628
Energy: 1.3473965206058065
Energy: 1.384989254528683
Energy: 1.3635051689848703
Energy: 1.4594530270651833
Energy: 1.4116870344450014
Energy: 1.361834409733421
Energy: 1.6417251198869234
Energy: 1.4785061184372077
Energy: 1.4445617792591985
Energy: 1.4114525511373932
Energy: 1.3452164573517047
Energy: 1.641162360457905
Energy: 1.4499449895211098
Energy: 1.5649221114089746
Energy: 1.3974637823726015
Energy: 1.374250746261077
Energy: 1.3754795122743162
Energy: 1.5384959310846158
Energy: 1.4050831964136243
Energy: 1.3838927650748372
Energy: 1.5044003397352317
Energy: 1.399420038727235
Energy: 1.5082733976155944
Energy: 1.411237923058682
Energy: 1.4138353016805172
Energy: 1.4034389414648225
Energy: 1.48822945500152
Energy: 1.4031802934639603
Energy: 1.400851933343388
Energy: 1.3921257813696886
Energy: 1.5509143235654643
Energy: 1.4675888417268368
Energy: 1.4096029955503628
Energy: 1.404608552918358
Energy: 1.4611471020728177
Energy: 1.5040367756275244
Energy: 1.429843136822905
Energy: 1.3934135257587361
Energy: 1.3805208771031665
Energy: 1.4580725478899572
Energy: 1.4953130538505741
Energy: 1.4334365298467278
Energy: 1.4117588086589294
Energy: 1.4031176247049872
Energy: 1.412623526239806
Energy: 1.5045026951613605
Energy: 1.47435630446648
Energy: 1.4381869722835643
Energy: 1.4075924619237292
Energy: 1.435845627874625
Energy: 1.517541720001132
Energy: 1.4688898567838746
Energy: 1.458530801134363
Energy: 1.421332650204273
Energy: 1.4040271441095147
Energy: 1.4420675000188665
Energy: 1.4323696445102478
Energy: 1.3285090811415559
Energy: 1.4145750615688517
Energy: 1.4279694277823403
Energy: 1.3829275214711376
Energy: 1.4162634891172903
Energy: 1.3283854579987404
Energy: 1.4039387323435701
Energy: 1.406521160565299
Energy: 1.4248815783155961
Energy: 1.4054473219595294
Energy: 1.3715151200159155
Energy: 1.4024989707603321
Energy: 1.4085063135827522
Energy: 1.4350791198633257
Energy: 1.4464298843609784
Energy: 1.403146940010591
Energy: 1.4098477667994516
Energy: 1.4069782921288068
Energy: 1.5067575572124798
Energy: 1.4171190738594774
Energy: 1.3995443989646057
Energy: 1.4210523795062437
Energy: 1.3661563841837836
Energy: 1.5076314588929955
Energy: 1.4177392222476755
Energy: 1.4391038955316102
Energy: 1.3987854859094833
Energy: 1.4550780111187254
Energy: 1.432345672582026
Energy: 1.518574135769446
Energy: 1.4033750945167256
Energy: 1.4738994006929445
Energy: 1.379841803467687
Energy: 1.4346149178353094
Energy: 1.560121987031424
Energy: 1.4784968339562987
Energy: 1.4487224856456533

minimum gb energy = 1.3129200951271423 eV
minimum distance =  2.61331497230002 Angstroms
sigma value = 437


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

Energy: 1.3978199867958183
Energy: 1.2169300487974846
Energy: 1.3403657540441127
Energy: 1.3395464387569729
Energy: 1.2523316666151971
Energy: 1.3787240416961402
Energy: 1.2266627164438264
Energy: 1.4346676725752143
Energy: 1.3409627507725435
Energy: 1.1850475897837496
Energy: 1.3661896317875828
Energy: 1.3953269582583765
Energy: 1.5359363434882316
Energy: 1.3982502723266534
Energy: 1.429455613982601
Energy: 1.366449779816646
Energy: 1.3909406885827367
Energy: 1.5363070188975723
Energy: 1.3834542804575758
Energy: 1.509277504850949
Energy: 1.282410014744611
Energy: 1.2916200329354852
Energy: 1.3909605155702713
Energy: 1.2939139673812219
Energy: 1.436239256481762
Energy: 1.2815067290073596
Energy: 1.4074257905053784
Energy: 1.4290321914690323
Energy: 1.3260124921601188
Energy: 1.4390935742566335
Energy: 1.2813109799109446
Energy: 1.2957012622496782
Energy: 1.2454440871877437
Energy: 1.2455330322240301
Energy: 1.4378312179494834
Energy: 1.329869399067504
Energy: 1.2663984312879744
Energy: 1.2457078397823516
Energy: 1.2468218461462066
Energy: 1.431953993608784
Energy: 1.2323325975072548
Energy: 1.237400577498997
Energy: 1.2621741197707619
Energy: 1.3134251297588937
Energy: 1.1887531459921103
Energy: 1.2296893124495583
Energy: 1.2381026928795222
Energy: 1.2639211577411653
Energy: 1.3146042693516267
Energy: 1.1868021536106053
Energy: 1.2588381230038035
Energy: 1.2977781286452403
Energy: 1.3027685582279958
Energy: 1.2273567552095128
Energy: 1.612229078309465
Energy: 1.2891840255727882
Energy: 1.3209828767496143
Energy: 1.3033357149839242
Energy: 1.2278491012403503
Energy: 1.6124089634203167
Energy: 1.3266375134192718
Energy: 1.3114516297183645
Energy: 1.3518443979452628
Energy: 1.357314074137827
Energy: 1.345887635094911
Energy: 1.3230024025512126
Energy: 1.3142761007033046
Energy: 1.3508249720427994
Energy: 1.3449687039849807
Energy: 1.2606354905700214
Energy: 1.4057254067609353
Energy: 1.281450984149738
Energy: 1.3129568779293022
Energy: 1.6207664133830055
Energy: 1.3394087338525533
Energy: 1.2885404304239285
Energy: 1.363816461965054
Energy: 1.3185862842097336
Energy: 1.589741931077663
Energy: 1.3905696876790299
Energy: 1.2692144389797673
Energy: 1.38014740748757
Energy: 1.218632911292011
Energy: 1.6389735555245752
Energy: 1.2961764492294479
Energy: 1.2690962104114738
Energy: 1.3787265276728848
Energy: 1.2194301053791436
Energy: 1.581218002710473
Energy: 1.26823144799121
Energy: 1.2627830755135176
Energy: 1.4476830338705002
Energy: 1.2836601769484068
Energy: 1.5908229446321684
Energy: 1.268821877886158
Energy: 1.2387042222799534
Energy: 1.4425998111432476
Energy: 1.283167764325198
Energy: 1.5873530979231856
Energy: 1.269704623881094
Energy: 1.286878337297089
Energy: 1.2674743139528142
Energy: 1.215811688721894
Energy: 1.3780484648791815
Energy: 1.2940407619059877
Energy: 1.2984259890358796
Energy: 1.2520383313076546
Energy: 1.2147076339483058
Energy: 1.3808857043246767
Energy: 1.2868117347686305
Energy: 1.2611999299916863
Energy: 1.261898927454598
Energy: 1.2477212599701457
Energy: 1.3035961257018034
Energy: 1.2406092189606055
Energy: 1.2616900104447153
Energy: 1.2635075121543018
Energy: 1.366297789873755
Energy: 1.302239462297678
Energy: 1.240911262150764
Energy: 1.365992969342659
Energy: 1.2845195876770565
Energy: 1.5475016165682178
Energy: 1.5444427828601501
Energy: 1.2998668064063694
Energy: 1.3637838957354813
Energy: 1.2834873824152895
Energy: 1.6154294840317125
Energy: 1.543401520153519
Energy: 1.3009367000121501
Energy: 1.1927780026456245
Energy: 1.3505585774035436
Energy: 1.4085496634437278
Energy: 1.3771747967825294
Energy: 1.2546769091924845
Energy: 1.354666582023349
Energy: 1.3503674828949601
Energy: 1.447176318534589
Energy: 1.2669070195024696
Energy: 1.3482748698790754

minimum gb energy = 1.1850475897837496 eV
minimum distance =  2.64051671502897 Angstroms
sigma value = 33