Model name: model_name=EAM_CubicNaturalSpline_AngeloMoodyBaskes_1995_Ni__MO_800536961967_003
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5199999883770943
cohesive_energy=4.450349977830181
mass=58.6934
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=[2.0615366967341399e-19, 2.9134941218636397e-19, 3.56125413498984e-19, 4.0865277444467394e-19, 4.526549535208499e-19, 4.90224393411516e-19, 5.22692502899526e-19, 5.509709204896259e-19, 5.7571814077839e-19, 5.974308385223579e-19, 6.164951382903239e-19, 6.332186579960159e-19, 6.47852939370972e-19, 6.606014588477099e-19, 6.7164045585597e-19, 6.8111733064608e-19, 6.891570529954919e-19, 6.95870173091952e-19, 7.01354423710134e-19, 7.05691515858372e-19, 7.08958354015098e-19, 7.112222295989399e-19, 7.125408209687219e-19, 7.1296860213e-19, 7.12510379612676e-19, 7.1102996840286e-19, 7.08352731247446e-19, 7.04270385184014e-19, 6.9853939936419595e-19, 6.9086176893406805e-19, 6.80886617210784e-19, 6.68192571739602e-19, 6.522637316443739e-19, 6.32476850214474e-19, 6.080660870188499e-19, 5.780845556668079e-19, 5.413610650388939e-19, 4.96420010455194e-19, 4.41398060490366e-19, 3.73906369783116e-19, 2.9086074831299397e-19, 1.8822531313895396e-19, 6.06270047012136e-20, -9.917825843319479e-20, -3.01151528833176e-19, -5.592653889238439e-19, -8.93607608906964e-19, -1.33387613487036e-18]
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: 7.7715611723761e-16 eV

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

Energy: 0.020480072615182594
Energy: 0.16565961386142336
Energy: 0.16722408786590612
Energy: 0.16698362092884847
Energy: 0.025696621147278706
Energy: 0.022387214785138984
Energy: 0.16527239883055114
Energy: 0.1678175463301641
Energy: 0.16632967176855795
Energy: 0.024687109543395414
Energy: 0.16487574913126848
Energy: 0.16502855507794023
Energy: 0.16569310679733404
Energy: 0.1666970169370313
Energy: 0.1670273068848553
Energy: 0.1648693090433607
Energy: 0.16516864616881446
Energy: 0.1654609352205255
Energy: 0.1674282214941561
Energy: 0.16708662965516405
Energy: 0.16781635420471894
Energy: 0.025597515089659233
Energy: 0.02089151782599715
Energy: 0.16522748687714686
Energy: 0.16660667830317907
Energy: 0.1674390856722711
Energy: 0.024172676627115974
Energy: 0.02092320411766279
Energy: 0.16488833535373673
Energy: 0.1671284561557057
Energy: 0.16609551208923365
Energy: 0.02271654181291535
Energy: 0.022085681119644974
Energy: 0.1646801908697502
Energy: 0.1652379661944543
Energy: 0.1667868581905712
Energy: 0.022122051588976593
Energy: 0.021345414120134104
Energy: 0.16408311464119196
Energy: 0.16466611962454406
Energy: 0.16542285752687874
Energy: 0.16622882805109315
Energy: 0.1668305278132821
Energy: 0.02290106990121977
Energy: 0.021375156359457293
Energy: 0.16484146937094538
Energy: 0.1666940788814728
Energy: 0.1674411528505407
Energy: 0.02405102447779091
Energy: 0.16425104521706108
Energy: 0.16466330148253586
Energy: 0.16546893115498673
Energy: 0.16628052616356223
Energy: 0.021911338253548546
Energy: 0.021225729121080558
Energy: 0.16479234445152957
Energy: 0.16476071794139802
Energy: 0.16694903558617255
Energy: 0.021877487038443708
Energy: 0.0211649830144372
Energy: 0.021235019633565538
Energy: 0.1673133245578365
Energy: 0.16591323936700245
Energy: 0.16734331033192038
Energy: 0.16781145032469177
Energy: 0.02125743877429044
Energy: 0.16778872870737377
Energy: 0.16523637655824172
Energy: 0.1684711189258677
Energy: 0.16784053451617378

minimum gb energy = 0.020480072615182594 eV
minimum distance =  2.45623161865585 Angstroms
sigma value = 3


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

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Energy: 1.1708239338882707
Energy: 1.1704726807971284
Energy: 1.1729593797292726
Energy: 1.2355498343638782
Energy: 1.4043708124763308
Energy: 1.1691302926349827
Energy: 1.1737035982023951
Energy: 1.1720199011951329
Energy: 1.2515503919802338
Energy: 0.9620654262716696
Energy: 1.2385842279430053
Energy: 1.1788363196104423
Energy: 1.220691278526042
Energy: 0.9389899501871639
Energy: 1.0284422484704008
Energy: 1.268248087614379
Energy: 1.170815222124989
Energy: 1.238496598512765
Energy: 0.9374911200838643
Energy: 1.022974090177832
Energy: 1.2155858896793459
Energy: 1.0480153063660955
Energy: 0.9347769546354942
Energy: 0.9336069509691582
Energy: 0.9347650400019298
Energy: 1.2494161252824985
Energy: 1.0534413453576137
Energy: 0.997636617501409
Energy: 1.1774845294818128
Energy: 1.027003447019286
Energy: 1.1821798097277763
Energy: 1.055841759882627
Energy: 0.9350563283315824
Energy: 0.9358090061967463
Energy: 0.9353053170806562
Energy: 1.1767257929784405
Energy: 1.0572665898981726
Energy: 0.9382830869585275
Energy: 1.1038732758347412
Energy: 1.2205652218977434
Energy: 1.301679451870901
Energy: 1.23774346042624
Energy: 1.0460556106150685
Energy: 0.9725465508981818
Energy: 1.2977576184969415
Energy: 1.1851956361640439
Energy: 1.240254500650672
Energy: 1.1289906277529242
Energy: 1.1829097212645927
Energy: 1.2337820682877494
Energy: 1.2140522384039742
Energy: 1.1602165868857484
Energy: 1.0459158305887655
Energy: 1.2617778267531619
Energy: 1.2336837401927554
Energy: 1.2104487641446335
Energy: 1.1697437171465197
Energy: 1.0424361485706763
Energy: 1.178601737519596
Energy: 1.2120169192264383
Energy: 1.2574309858805417
Energy: 1.1301764124255747
Energy: 1.0542612951672157
Energy: 1.2191807669663621
Energy: 1.3082627577093946
Energy: 1.219145768813041
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Energy: 0.975247996834257
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Energy: 1.3017188840316878
Energy: 1.2176252092091449
Energy: 1.2158399103397857
Energy: 1.1049756928512962
Energy: 1.2178675649943587
Energy: 1.2086293497752993
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Energy: 1.2058430477052213
Energy: 1.281248670270447
Energy: 1.2156055121826057
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Energy: 1.2215786662150594
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Energy: 0.9677488052985109
Energy: 1.0453526021613644
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Energy: 1.260380171643635
Energy: 1.211750189520454
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Energy: 1.273978573757975
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Energy: 1.0676371605583346
Energy: 0.9812532412914603
Energy: 1.2684217397484252
Energy: 1.2165824721786285
Energy: 1.258445122170381
Energy: 0.9623191215360161
Energy: 0.9780373535906991
Energy: 1.2576176932143426
Energy: 1.2189472454065864
Energy: 1.1810876141594102
Energy: 1.5035285828884724
Energy: 1.2652350659464384
Energy: 1.20701141891399
Energy: 1.208779446693715
Energy: 1.1958207079937173
Energy: 1.4073725112125461
Energy: 1.2153314852376673
Energy: 1.2070077581815088
Energy: 1.2066613397901476
Energy: 1.2145537999340874
Energy: 0.9676265008481615
Energy: 1.324143109813833
Energy: 1.2123575570512053
Energy: 1.2555123998450464
Energy: 0.9750230405662654
Energy: 0.8943876098545068
Energy: 1.2977469897513936
Energy: 1.213500931947136
Energy: 1.2732666396102115
Energy: 0.974135797448786
Energy: 0.977411191970415
Energy: 1.24841327713453
Energy: 1.0493600686559605
Energy: 1.0232906293128052
Energy: 0.9706910623774624
Energy: 0.9703508690550885
Energy: 1.021957922547763
Energy: 1.0477365770381024
Energy: 0.9685073205025339
Energy: 0.9687940607110591
Energy: 0.9743179555603367
Energy: 1.0194783278723702
Energy: 1.0552976206007132
Energy: 0.9734870366812888
Energy: 1.0041702324236368
Energy: 0.9715641780318583
Energy: 1.054116172406552
Energy: 1.056753637213118
Energy: 0.9756032354530645
Energy: 1.0034665374958298
Energy: 1.1885281594949793
Energy: 1.3086016853082933
Energy: 1.215125454379241
Energy: 1.127877787799345
Energy: 0.9363827824237733
Energy: 1.2424546597886192
Energy: 1.2175706849556338
Energy: 1.227454194087844
Energy: 1.0444262045423596
Energy: 0.9846052622094134
Energy: 1.2304713800791054
Energy: 1.172536383223447
Energy: 1.2190672296263516
Energy: 1.0507877929878537
Energy: 1.253011970291834
Energy: 1.2124447533172913
Energy: 1.1721847255372715
Energy: 1.115572383343417
Energy: 1.263731816190611
Energy: 1.1583577477614757
Energy: 1.2118397144730364
Energy: 1.276635318598148
Energy: 1.1356716012392112
Energy: 0.9734990551875968
Energy: 1.1769052261942334
Energy: 1.209796224033002
Energy: 1.2602731376346836
Energy: 1.2737929791547602
Energy: 1.0499270806173597
Energy: 1.1440237787308851
Energy: 1.3005452669424125
Energy: 1.2153550595877378
Energy: 1.0336426838249535
Energy: 1.099950784686574
Energy: 1.2178585459353168
Energy: 1.30119793466942
Energy: 1.2144795375392472
Energy: 0.9411312282943334
Energy: 1.2835732518181564
Energy: 1.2159567599619827
Energy: 1.270062279813179
Energy: 1.0910465023111258
Energy: 0.9407502530531023
Energy: 0.9316129757722895
Energy: 1.2789127577354351
Energy: 1.2697350004225283
Energy: 1.0850130867442578
Energy: 0.9410692132260209
Energy: 1.303340458999579
Energy: 1.2180682089254624
Energy: 1.0525003697778927
Energy: 0.9696846793148902
Energy: 0.9697917497784521
Energy: 1.0990537483632408
Energy: 1.0559079356628984
Energy: 1.1153210813635692
Energy: 0.9725801641769146
Energy: 1.0437049376939902
Energy: 1.0543253528043386
Energy: 1.0663352610586962
Energy: 0.9966186020913305
Energy: 1.0436691325379794
Energy: 0.9731409625329754
Energy: 0.9727261812247968
Energy: 1.0802430186992735
Energy: 1.0106231283204494
Energy: 1.0442633744645613
Energy: 1.0512559460122246
Energy: 0.9730034291814986
Energy: 1.0564312340535562
Energy: 1.2297561979818752
Energy: 1.0464261689736551
Energy: 1.05371534710959
Energy: 1.2613645979561068
Energy: 1.1655969356513347
Energy: 1.1411598626974964
Energy: 0.9435365950723656
Energy: 1.0486520625055016
Energy: 1.2898176175394225
Energy: 1.175871321351088
Energy: 1.2389949860969658
Energy: 1.160653521890805
Energy: 1.1165953518840457
Energy: 1.1724918564905955
Energy: 1.212372692104722
Energy: 1.137974463682188
Energy: 0.936780843835549
Energy: 1.1160895600636906
Energy: 1.1669388821609583
Energy: 1.2137097393837144
Energy: 1.082942547365461
Energy: 1.0431840442976825
Energy: 1.2288020208654782
Energy: 1.1676548191584586
Energy: 1.201726085169437
Energy: 0.9427984850591327
Energy: 0.9371867879694217
Energy: 1.2204766961387552
Energy: 1.1704582948149271
Energy: 1.2098803653730394
Energy: 1.4004932202591025
Energy: 1.2264016641877793
Energy: 1.1744504488484173
Energy: 1.1775678037172483
Energy: 1.1950715800228373
Energy: 1.4111903949593536
Energy: 1.1667074218956115
Energy: 1.171143391838216
Energy: 1.1700923816677469
Energy: 1.1749577673767901

minimum gb energy = 0.8943876098545068 eV
minimum distance =  2.17134882689056 Angstroms
sigma value = 75


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

Energy: 2.3369174245360953
Energy: 1.0590783941526571
Energy: 1.0782826180861815
Energy: 1.254976401128751
Energy: 1.236061676539257
Energy: 1.0848028185348844
Energy: 1.06896202255443
Energy: 1.0747222774322733
Energy: 1.2589570369313519
Energy: 1.233101731814787
Energy: 1.088503003554892
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Energy: 1.0749385459809473
Energy: 1.1020386180682304
Energy: 1.0886969203106842
Energy: 1.1431305574348247
Energy: 1.0705897012873635
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Energy: 1.1042599533034945
Energy: 1.0808424175349207
Energy: 1.1282524081086736
Energy: 1.3624543914490443
Energy: 1.3300193653026025
Energy: 1.2191767669841962
Energy: 1.0834929194467706
Energy: 1.0937084449706413
Energy: 1.3629052068188003
Energy: 1.3301580203216297
Energy: 1.1827533552372809
Energy: 1.083575697818638
Energy: 1.1538393108757397
Energy: 1.1069154887788986
Energy: 1.1719009959995883
Energy: 1.0971385812357537
Energy: 1.0355623942212107
Energy: 1.1797177358860196
Energy: 1.0780642464774612
Energy: 1.145521247855815
Energy: 1.065874849394673
Energy: 1.052684286618903
Energy: 1.1448578950268142
Energy: 1.1073407705308786
Energy: 1.2508238353155845
Energy: 1.2707699382988897
Energy: 1.0894456940678459
Energy: 1.0960677844379778
Energy: 1.070193229814772
Energy: 1.2551408614016095
Energy: 1.2998340032087659
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Energy: 1.0827762733237252
Energy: 1.1023348636372206
Energy: 1.254257556945371
Energy: 1.093634753437378
Energy: 1.1103464340470852
Energy: 1.0622881715722299
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Energy: 1.1083864583774126
Energy: 1.0972988098339744
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Energy: 1.0569413081149561
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Energy: 1.1133130201587274
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Energy: 1.1575293165114198
Energy: 1.2617970499989106
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Energy: 1.1386406061948648
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Energy: 1.1022970274046564
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Energy: 1.1351306879324476
Energy: 1.2545805521338853
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Energy: 1.1903014408062325
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Energy: 1.2553760921413286
Energy: 1.337906691171312
Energy: 1.2522236427648183
Energy: 1.0930820943757449
Energy: 1.1406338706843293
Energy: 1.1239232187029875
Energy: 1.1360104669345803
Energy: 1.1247013213123587
Energy: 1.073233144296441
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Energy: 1.4654437392286095
Energy: 1.1040155451002927
Energy: 1.2695940913696377
Energy: 1.1258543276808914
Energy: 1.2677219176081098
Energy: 1.278736327591497
Energy: 1.1071657704069287
Energy: 1.2655732661731072
Energy: 1.1152188332582544
Energy: 1.2658113535445892
Energy: 1.3110592088669215
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Energy: 1.0977616589109735
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Energy: 1.088394462716285
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Energy: 1.1156568667768825
Energy: 1.1218822901658367
Energy: 1.1322014485937466
Energy: 1.0687628227752226
Energy: 1.1213974859216256
Energy: 1.1219708591260045
Energy: 1.136796285670993
Energy: 1.1005795749935292
Energy: 1.047561243605774
Energy: 1.1313534578054432
Energy: 1.116111137166689
Energy: 1.1369742180375888
Energy: 1.1744182579693052
Energy: 1.0478467778275926
Energy: 1.2514915568721439
Energy: 1.2089302775844448
Energy: 1.1608491789960758
Energy: 1.2387130423740544
Energy: 1.0332120299625047
Energy: 1.2551226565380003
Energy: 1.209015804992986
Energy: 1.1610688941589125
Energy: 1.2607524290816319
Energy: 1.045300174936894
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Energy: 1.1429760664269886
Energy: 1.1520297084801931
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Energy: 1.1247702203768584
Energy: 1.1056268362320527
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Energy: 1.272794526655628
Energy: 1.096680109323179
Energy: 1.1097209734120101
Energy: 1.2689511412128476
Energy: 1.2533854161283327
Energy: 1.1069323328959344
Energy: 1.258629682756267
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minimum gb energy = 1.020028215446597 eV
minimum distance =  2.21665148916007 Angstroms
sigma value = 105


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

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Energy: 1.1426502631188722
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Energy: 1.1252239080598587
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Energy: 1.2147484980311465
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Energy: 1.4904261122599765
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Energy: 1.105870857471665
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Energy: 1.2218061532476556
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Energy: 1.2231064260628741
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Energy: 1.2698379391548187
Energy: 1.191593591634783
Energy: 1.2007430568621416
Energy: 1.1623193521487987
Energy: 1.2548544016951502
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Energy: 1.1983478121042528
Energy: 1.1656883114878474
Energy: 1.2659354788538522
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Energy: 1.1943496347728997
Energy: 1.1733843819815304
Energy: 1.1936009747988015
Energy: 1.264077977348507
Energy: 1.1989327174950979
Energy: 1.1928637932818795
Energy: 1.169733336409161
Energy: 1.1963208622147925
Energy: 1.266441087672691
Energy: 1.1937779989626514
Energy: 1.2134463708322325
Energy: 1.1931784882372192
Energy: 1.2032339551915554
Energy: 1.2183212588007972
Energy: 1.1979613847447683
Energy: 1.2076765309392286
Energy: 1.1659157824922417
Energy: 1.177261953201613
Energy: 1.1292664607802345
Energy: 1.2189451300960692
Energy: 1.1890247329798371
Energy: 1.192629754189393
Energy: 1.1960036809009071
Energy: 1.1295445576122038
Energy: 1.198789178235753
Energy: 1.1657331072442765
Energy: 1.191884762253778
Energy: 1.193993907507928
Energy: 1.10506811806838
Energy: 1.2931088232021581
Energy: 1.1259506847490857
Energy: 1.2295248261883744
Energy: 1.2469258711466762
Energy: 1.1600096427468358
Energy: 1.2064225435390874
Energy: 1.1311014164179163
Energy: 1.1918041927456584
Energy: 1.1938925242155292
Energy: 1.1917961480153947
Energy: 1.2552855098803717
Energy: 1.2464513483298916
Energy: 1.2446175841246843
Energy: 1.230272864029267
Energy: 1.2298461838038013
Energy: 1.269829285378918
Energy: 1.2509298190135156
Energy: 1.2646639386280094
Energy: 1.2356366215962507
Energy: 1.2357117340477466
Energy: 1.1935049507762425
Energy: 1.2743348150973213
Energy: 1.1094094621054968
Energy: 1.0898649888920942
Energy: 1.2444504322632692
Energy: 1.091685791969696
Energy: 1.2674755671187539
Energy: 1.1198103774287804
Energy: 1.0986550609962182
Energy: 1.2534604331551602
Energy: 1.103483198294227
Energy: 1.1200556447583236
Energy: 1.123338340719205
Energy: 1.1222416830182322
Energy: 1.1382097753448197
Energy: 1.1321388813844213
Energy: 1.1199866715874827
Energy: 1.1141944748945931
Energy: 1.1141223670338394
Energy: 1.2230697073446843

minimum gb energy = 1.061630257183926 eV
minimum distance =  2.20882466603898 Angstroms
sigma value = 165


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

Energy: 1.4016676278644205
Energy: 1.0432161191109945
Energy: 1.041058454286103
Energy: 1.1284423418932543
Energy: 1.0270169275832728
Energy: 1.4000793539385394
Energy: 1.0429770913129905
Energy: 1.0407495179773034
Energy: 1.1283330654915995
Energy: 1.026586653132168
Energy: 1.1142507732985876
Energy: 1.1149584100639747
Energy: 1.1162637859612488
Energy: 1.1164479359800705
Energy: 1.207129770542712
Energy: 1.114228567550608
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Energy: 1.1173289639007618
Energy: 1.117046682004527
Energy: 1.2047944188853312
Energy: 1.1256353367849632
Energy: 1.2070445009302577
Energy: 1.040553918659915
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Energy: 1.1251968111694293
Energy: 1.1156036643025975
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Energy: 1.192371946354921
Energy: 1.2743375770575724
Energy: 1.1266663558472692
Energy: 1.1304129637127225
Energy: 1.0421117796862895
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Energy: 1.0418918485708961
Energy: 1.0266306775353136
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Energy: 1.1322639440156061
Energy: 1.025863944584608
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Energy: 1.0286390928772884
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Energy: 1.11495094591136
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Energy: 1.1159207309701795
Energy: 1.0441288947865042
Energy: 1.1183454945113545
Energy: 1.0442950798503632
Energy: 1.1134561053315672
Energy: 1.1822434806921578
Energy: 1.208568032541374
Energy: 1.1318523102856841
Energy: 1.1318052839254158
Energy: 1.1258654462911781
Energy: 1.1140322473638467
Energy: 1.2064716701399205
Energy: 1.1148138417608795
Energy: 1.1286259049042247
Energy: 1.126924463580245
Energy: 1.1139509885072443
Energy: 1.1836679949623041
Energy: 1.1254019514728253
Energy: 1.1284925315645504
Energy: 1.126541779124065
Energy: 1.4100820381825998
Energy: 1.1310108707766569
Energy: 1.1322165511866409
Energy: 1.12826623963679
Energy: 1.249796490609907
Energy: 1.406504014846759
Energy: 1.1327297335815751
Energy: 1.1153198903240344
Energy: 1.1280278762059044
Energy: 1.129104369417767
Energy: 1.0278852644012586
Energy: 1.1318943958530867
Energy: 1.1143195813422326
Energy: 1.1316276970381594
Energy: 1.124957082158846
Energy: 1.131192693277515
Energy: 1.237766680981049
Energy: 1.1271023523613506
Energy: 1.047575917790601
Energy: 1.1137959026181046
Energy: 1.0410462806487744
Energy: 1.1536903558926068
Energy: 1.1204797927127434
Energy: 1.0480779388451968
Energy: 1.1138312671461357
Energy: 1.040847699959628
Energy: 1.204868802920747
Energy: 1.1124296577828874
Energy: 1.1136302444090769
Energy: 1.0233886174300248
Energy: 1.1132890164644107
Energy: 1.1155378879493993
Energy: 1.1248862838171372
Energy: 1.0486604629882694
Energy: 1.0271507176446344
Energy: 1.1145475188025638
Energy: 1.026663468415959
Energy: 1.1144118896566109
Energy: 1.1286247739059987
Energy: 1.0490577299707329
Energy: 1.1147316463582202
Energy: 1.1158850196988308
Energy: 1.1237071507024898
Energy: 1.1272772250359995
Energy: 1.0428850996072274
Energy: 1.114629021965707

minimum gb energy = 1.0225714739562868 eV
minimum distance =  2.22735919532267 Angstroms
sigma value = 41


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

Energy: 1.3582682187024206
Energy: 1.0021819417256665
Energy: 0.9788078254052576
Energy: 0.9782968069172634
Energy: 0.9588066527145612
Energy: 0.9816041086641503
Energy: 0.993774592420098
Energy: 0.9748711362278787
Energy: 1.0210029944471788
Energy: 0.973376762355763
Energy: 1.1000074658425663
Energy: 1.0028696480366148
Energy: 0.9792258300109707
Energy: 0.9788720110134963
Energy: 1.0308054182618522
Energy: 1.0017196044351275
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Energy: 1.0047003541940915
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Energy: 1.082861138552709
Energy: 1.006433985615198
Energy: 1.0682360827270685
Energy: 1.0701725832868016
Energy: 1.023268634724693
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Energy: 1.0095067159224709
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Energy: 1.0382504176213012
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Energy: 1.0941988578893906
Energy: 0.9845361812660586
Energy: 1.0639337380570713
Energy: 1.0629316955223418
Energy: 1.1111941645226686
Energy: 1.0567247010855962
Energy: 1.0015557967790467
Energy: 1.0090963958669732
Energy: 1.0781497650218346
Energy: 1.110855092069895
Energy: 1.098425916815093
Energy: 1.0567214702817673
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Energy: 1.0838544442028417
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Energy: 0.9788950157369951
Energy: 1.0076612500032498
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Energy: 1.089139589243292
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Energy: 1.1306670897563604
Energy: 1.0001683864566517
Energy: 1.0409117987212448
Energy: 0.9989684650377173
Energy: 1.0995557738437196
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Energy: 1.0078186199173391
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Energy: 0.9979575006173206
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Energy: 1.1004456446574322
Energy: 1.0674032478086886
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Energy: 1.0680465635466938
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Energy: 0.9734664584199205
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Energy: 1.0025643244610005
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Energy: 0.9760467910799538
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Energy: 1.0204620869041825
Energy: 1.0010338687937084
Energy: 0.9860227525432644
Energy: 1.0922501540271026
Energy: 1.0243571096156974
Energy: 1.0469167536743216
Energy: 0.9678700402164881
Energy: 1.0042619240025337
Energy: 1.0913230291921197
Energy: 1.0004761886062596
Energy: 1.080723669220723
Energy: 0.9525081887125507
Energy: 1.0506893837234879
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Energy: 1.0205706064179547
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Energy: 1.0753595847396775
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Energy: 1.0313141420794372
Energy: 1.0294257709656822
Energy: 0.9596619930808719
Energy: 0.9765976854127716
Energy: 1.0107913733145144
Energy: 1.023856904366549
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Energy: 0.9795372028782543
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Energy: 0.985353072957364
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Energy: 1.0383310314302476
Energy: 1.149864665585884
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Energy: 1.0480813836552392
Energy: 1.0025957184340055
Energy: 1.0005810216254736
Energy: 1.0806199878051095
Energy: 1.0082922624874102
Energy: 1.1024161055897246
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Energy: 1.0336617701605104
Energy: 1.0542266691734807
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Energy: 1.1189445321721199
Energy: 1.0802876666862051
Energy: 1.0333470994776088
Energy: 1.0542559546759493
Energy: 1.0876232916218738
Energy: 1.0582731202258524
Energy: 1.0334416369751533
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Energy: 1.0423407207164643
Energy: 1.0561538448429233
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Energy: 1.0390665559576024
Energy: 1.0330602584485604
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Energy: 1.035810624773089
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Energy: 1.2522688656772374
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Energy: 1.0643889140290905
Energy: 1.0633210320931166
Energy: 1.0846247943802434
Energy: 1.1269787329719088
Energy: 1.0764103057967496
Energy: 1.0903195738895277
Energy: 1.0782436978167345
Energy: 1.1410422267077593
Energy: 1.089045758683924
Energy: 1.1023699393084028
Energy: 1.1258051168563208
Energy: 1.097923142007854
Energy: 1.1010259632169608
Energy: 1.0897402082901118
Energy: 1.1002813108163871
Energy: 1.114955870701561
Energy: 1.0497871995100485
Energy: 1.0611631073307939
Energy: 0.9769615496487779
Energy: 1.0709525843456777
Energy: 1.0955514189358924
Energy: 1.0638641401528357
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Energy: 0.993165286285545
Energy: 1.0734771016761424
Energy: 1.078078572028209
Energy: 1.0334671391033332
Energy: 1.0684318525079548
Energy: 1.0788872659112738
Energy: 1.008862628236404
Energy: 1.0602297770698614
Energy: 1.0587552105437765
Energy: 1.0679740618989715
Energy: 1.0708507548564488
Energy: 1.0105865125695646
Energy: 1.060345738121589
Energy: 1.0950269286811145
Energy: 1.0803812368383106
Energy: 1.0588550764223144
Energy: 1.0918235901232038
Energy: 1.0895276319426408
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Energy: 1.0810556169922998
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Energy: 0.9763905092563284
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Energy: 1.059597957765238
Energy: 1.0125631751808468
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Energy: 1.004663681853178
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Energy: 0.9995779864180152
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Energy: 1.0449781755135426
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Energy: 1.0994695625904376
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Energy: 1.071125975472457
Energy: 0.9992385653906851
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Energy: 1.0636223564005802
Energy: 1.114503736522568
Energy: 1.0684437545220478
Energy: 1.0614335158291281
Energy: 1.0017673033742824
Energy: 1.0634938997287637
Energy: 1.0045906204475104
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Energy: 0.9926739666208485
Energy: 1.037130013107671
Energy: 1.058778096203358
Energy: 0.9992668111360138
Energy: 1.0917645182261904
Energy: 1.0718175685029605
Energy: 1.0476157922545528
Energy: 1.0574985635600924
Energy: 1.033955828097567
Energy: 1.0865340483574577
Energy: 1.1103615762043921
Energy: 1.0627444962504498
Energy: 1.0607390579461826
Energy: 1.0064471283750487
Energy: 1.126469461833919
Energy: 1.0828775194356581
Energy: 0.988080780534259
Energy: 1.0242488548681197
Energy: 0.978589537251194
Energy: 1.0305376550413539
Energy: 1.0697796931532848
Energy: 1.0418470447140191
Energy: 1.062039196803143
Energy: 1.0637748641554332
Energy: 1.0640904429424172
Energy: 1.0680893138830174
Energy: 1.0440199809706503
Energy: 0.9931540056332592
Energy: 1.0594487842524805
Energy: 1.0657384894342898
Energy: 1.0862646451495197
Energy: 1.0486316319774962
Energy: 1.0229933658756563
Energy: 1.0599033861251888
Energy: 1.0260335578708784
Energy: 0.9504439534481403
Energy: 1.0045590573460743
Energy: 1.0007460373116488
Energy: 1.0021256990866938
Energy: 1.1261661344670142
Energy: 0.9964378185491446
Energy: 1.0033166335466475
Energy: 0.9839357643124633
Energy: 0.9759473621456962
Energy: 1.0470612554053762
Energy: 0.97877558510011
Energy: 0.9682494482673695
Energy: 0.9729073010273646
Energy: 0.9755765133574033
Energy: 1.0016547821464628
Energy: 0.9803584824275333
Energy: 1.0158626086580436
Energy: 1.0015916841902444
Energy: 0.9762404223679254
Energy: 1.061169914765506
Energy: 0.978760291853648
Energy: 0.9782401351427283
Energy: 0.9695616946670947
Energy: 1.0129766075932065
Energy: 1.0650497482621277
Energy: 1.0036262287136062
Energy: 0.9527458112632279
Energy: 1.0138604344649773
Energy: 1.031557820113993
Energy: 0.9703001875888132
Energy: 1.0163386057243706
Energy: 1.0144945840597026
Energy: 0.9560383244635776
Energy: 1.0972341434944126
Energy: 0.9757791891224125
Energy: 1.0598170856936049
Energy: 0.9785782769875553
Energy: 1.0148214668309805

minimum gb energy = 0.9504439534481403 eV
minimum distance =  2.24311035174582 Angstroms
sigma value = 185


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

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Energy: 0.6973292829771024
Energy: 0.6850557750438402
Energy: 0.6653238128041981
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Energy: 0.40054514001462743
Energy: 0.6747880128674866
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Energy: 0.40402061492543034
Energy: 0.40022252421770294
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Energy: 0.4605543512642125
Energy: 0.45579300033780457
Energy: 0.8576984663370955
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Energy: 0.841207945705494
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Energy: 0.7560684456729502
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Energy: 0.7398131251997094
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Energy: 0.7673752603430499
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Energy: 0.40089351581880783
Energy: 0.7366871248249235
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Energy: 0.707196620404408
Energy: 0.6708187361877922
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Energy: 0.7336459983335238
Energy: 0.6834531113964796
Energy: 0.6801071176649001
Energy: 0.665948386021484
Energy: 0.7256336917932427
Energy: 0.7166099407063882
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Energy: 0.674167527271304
Energy: 0.6216459423179158
Energy: 0.6727321700443769
Energy: 0.6970226698835399
Energy: 0.697793993109901
Energy: 0.6725666067682374
Energy: 0.44463306186439044
Energy: 0.6840688872435989
Energy: 0.7247641818128159
Energy: 0.6872457141712831
Energy: 0.567949996996058
Energy: 0.6099116118900987
Energy: 0.6806968950434654
Energy: 0.7796713648132355
Energy: 0.6761625156516416
Energy: 0.40364207652537687
Energy: 0.40034049508899255
Energy: 0.682688857144507
Energy: 0.6773542581918612
Energy: 0.6983772658536488
Energy: 0.692891083751986
Energy: 0.6776649516609567
Energy: 0.6833203289574534
Energy: 0.6899531742429005
Energy: 0.6639032790467347
Energy: 0.6623922369999286
Energy: 0.6698244233228219
Energy: 0.6795867489948789
Energy: 0.6532309817068918
Energy: 0.6634037220058857
Energy: 0.6521961840269025
Energy: 0.7139842105474695
Energy: 0.6714510302363618
Energy: 0.6950366371450013
Energy: 0.6676591965472198
Energy: 0.40254132248854424
Energy: 0.6613644302777244
Energy: 0.6459287365545479
Energy: 0.6934051197071548
Energy: 0.6446351967808936

minimum gb energy = 0.3996187930817752 eV
minimum distance =  2.34360580879447 Angstroms
sigma value = 33


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

Energy: 0.9427491087756726
Energy: 0.913094847955175
Energy: 0.8832553069924719
Energy: 0.8853888155487221
Energy: 0.915959557760425
Energy: 0.913143675723667
Energy: 0.913408641826255
Energy: 0.882999690274215
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Energy: 0.8963088196628443
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Energy: 0.9217498679642229
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Energy: 0.9156320811756092
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Energy: 0.9183408597956232
Energy: 0.9199363348894901
Energy: 0.9354351364415965
Energy: 0.917576333664775
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Energy: 0.9445149343608503
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Energy: 0.9359896413445047
Energy: 0.916613298005199
Energy: 0.9351063432763131
Energy: 0.9455126894222903
Energy: 0.9151088531047432
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Energy: 0.9376780594630372
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Energy: 0.9363199585924704
Energy: 0.9411094319921008
Energy: 0.9147747105934545
Energy: 0.9153639290658159
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Energy: 0.9153787964315038
Energy: 0.9152340532730721
Energy: 0.954130535312519
Energy: 0.9163411307907134
Energy: 0.9133954568177832
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Energy: 0.9290618321507919
Energy: 0.9336610576641812
Energy: 0.9159543475715225
Energy: 0.9214873426874916
Energy: 0.9777488281178629
Energy: 0.9330221166069376
Energy: 0.9206625194220072
Energy: 0.9159010086338745
Energy: 0.9207913167896258
Energy: 1.0081331302024399
Energy: 0.9159373489377511
Energy: 0.9531159766825116
Energy: 0.8994491771360953
Energy: 0.9133834081858658
Energy: 0.9178907116827612
Energy: 0.9163583232946302
Energy: 0.9118812009675195
Energy: 0.9212604369817798
Energy: 0.9132304373378444
Energy: 0.9197692503338526
Energy: 0.9222333570791962
Energy: 0.9160570025416892
Energy: 0.9092552520449332
Energy: 0.8847499708912487
Energy: 0.9139263268203802
Energy: 0.9158800383318841
Energy: 0.9154728974125235
Energy: 0.9095895197145132
Energy: 0.9263402871618741
Energy: 0.9136091607295052
Energy: 0.9188585760904817
Energy: 0.9139904772058716
Energy: 0.8838079813153902
Energy: 0.9242516815876488
Energy: 0.9132558604322268
Energy: 0.9195240226012416
Energy: 0.9142178620837899
Energy: 0.8832483778535886
Energy: 0.9239152190834524
Energy: 0.9132312507979907

minimum gb energy = 0.8558978153845314 eV
minimum distance =  2.29046111530162 Angstroms
sigma value = 219


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

Energy: 1.6960672432152115
Energy: 1.183969870043694
Energy: 1.1160575621680757
Energy: 1.1203384824610434
Energy: 1.1909612277338713
Energy: 1.1509363754494855
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Energy: 1.0989697658242674
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Energy: 1.148801918534948
Energy: 1.1175711330154223
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Energy: 1.1180095445466198
Energy: 1.2131094219280896
Energy: 1.2122459799352483
Energy: 1.119387133292193
Energy: 1.115921844664893
Energy: 1.1813739777924686
Energy: 1.1815872455412821
Energy: 1.1873648379643127
Energy: 1.1193964182601603
Energy: 1.1158316025831896
Energy: 1.1812261529472616
Energy: 1.1798526759897692
Energy: 1.1577635324876687
Energy: 1.1847959040068252
Energy: 1.1183841682495057
Energy: 1.1838562977652642
Energy: 1.1806314010456187
Energy: 1.1822301720465553
Energy: 1.1843877033356598
Energy: 1.1208282882805265
Energy: 1.1836615806833464
Energy: 1.1396053438332328
Energy: 1.1845898651595754
Energy: 1.185438771990565
Energy: 1.065969911337727
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Energy: 1.1485708553604534
Energy: 1.1837649625067252
Energy: 1.070490384323422
Energy: 1.0657264535997593
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Energy: 1.1855773448250233
Energy: 1.18619526866602
Energy: 1.1855345969842686
Energy: 1.1723152115310593
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Energy: 1.1862409888657661
Energy: 1.3261649807110667
Energy: 1.1733909884058884
Energy: 1.2145246512996963
Energy: 1.0652360290247123
Energy: 1.1543488540379934
Energy: 1.2139277412020426
Energy: 1.1654407840873862
Energy: 1.182958406877579
Energy: 1.0658527404691707
Energy: 1.1526680626405583
Energy: 1.2136052929506889
Energy: 1.0901470613938005
Energy: 1.1832042239734308
Energy: 1.2129304189763617
Energy: 1.153691584156714
Energy: 1.117874663025216
Energy: 1.1874781395448595
Energy: 1.186380607637969
Energy: 1.2134060948238299
Energy: 1.1522407686071052
Energy: 1.1215611545698925
Energy: 1.186428363833489
Energy: 1.1862745982612373
Energy: 1.186843130117045
Energy: 1.213690949825177
Energy: 1.1148436223797438
Energy: 1.117550606542204
Energy: 1.184025513264461
Energy: 1.1858462120412214
Energy: 1.2140972549795714
Energy: 1.1174780166508618
Energy: 1.1173092878811335
Energy: 1.1839378057370031

minimum gb energy = 1.0652360290247123 eV
minimum distance =  2.27573864163655 Angstroms
sigma value = 15


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

Energy: 2.0072241898666094
Energy: 1.289286005646594
Energy: 1.3080352791194112
Energy: 1.2702520619695854
Energy: 1.2882517858475544
Energy: 1.2667658854585175
Energy: 1.296707839383144
Energy: 1.3037164677483477
Energy: 1.2892904166975516
Energy: 1.3025684842793448
Energy: 1.2902042455326128
Energy: 1.2960162446891748
Energy: 1.253948934787785
Energy: 1.2577209060027306
Energy: 1.300619024982149
Energy: 1.2914330129539735
Energy: 1.2840153061023807
Energy: 1.2667228156790333
Energy: 1.2621609969570324
Energy: 1.30223148257946
Energy: 1.2741843259352057
Energy: 1.2853026122180053
Energy: 1.2969444079034984
Energy: 1.254567993747751
Energy: 1.2946289758962355
Energy: 1.3791674603931474
Energy: 1.2855532558458134
Energy: 1.3004212697877764
Energy: 1.2385588790831394
Energy: 1.2886031725740807
Energy: 1.2884955650179697
Energy: 1.3660345236648095
Energy: 1.2633923471133202
Energy: 1.3695172255141654
Energy: 1.2815121305963288
Energy: 1.2781780256421573
Energy: 1.3514141748459803
Energy: 1.2501005488669898
Energy: 1.2767107079016091
Energy: 1.2486698588349003
Energy: 1.3103580217427648
Energy: 1.266670749582014
Energy: 1.2376074678373359
Energy: 1.290228081329961
Energy: 1.2922732546345266
Energy: 1.3212259719733552
Energy: 1.2831753871133438
Energy: 1.264284656746851
Energy: 1.2823611597388036
Energy: 1.2987568335866004
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minimum gb energy = 1.2181517112587368 eV
minimum distance =  2.2420766220779 Angstroms
sigma value = 293


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

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Energy: 1.3554787187758648
Energy: 1.2146544945205502
Energy: 1.3642333016446846
Energy: 1.2492437026343424
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Energy: 1.2144591215134595
Energy: 1.3457346518772104
Energy: 1.2495768728303212
Energy: 1.2740888631543774
Energy: 1.3023053861783696
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Energy: 1.296608352017964
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Energy: 1.3582146467182243
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Energy: 1.2724679395825698
Energy: 1.321374210221446
Energy: 1.2837145229968734
Energy: 1.2341727308384474
Energy: 1.3094114002256088
Energy: 1.3165525530004443
Energy: 1.2817191795382499
Energy: 1.2256809572699372
Energy: 1.3075871791367233
Energy: 1.2789621185615518
Energy: 1.3547737945493366
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Energy: 1.2258532361027692
Energy: 1.3667156100419715
Energy: 1.2817660952452627
Energy: 1.281667147818696
Energy: 1.3551983896490023
Energy: 1.2260927967840205
Energy: 1.266183254989953
Energy: 1.2802879951263173
Energy: 1.2802257647422746
Energy: 1.3594746946918213
Energy: 1.228131264403149
Energy: 1.2679714858535542
Energy: 1.262249890580165
Energy: 1.2853039409957556
Energy: 1.3535549598718535
Energy: 1.2599451479374764
Energy: 1.2639450395770597
Energy: 1.2613744196225394
Energy: 1.2824228710857466
Energy: 1.2759070885444797
Energy: 1.323013630672193
Energy: 1.3320455674166438
Energy: 1.3250234540032106
Energy: 1.3249616743394232
Energy: 1.2740322888411004
Energy: 1.2735148627272732
Energy: 1.2973884286092492
Energy: 1.3231043640469917
Energy: 1.3184154400882568
Energy: 1.2733204176609791
Energy: 1.3586982254423532
Energy: 1.2845397825508666
Energy: 1.2990813129127352
Energy: 1.3654856451064123
Energy: 1.2802887098412767
Energy: 1.3612237942889533
Energy: 1.2713181444287498
Energy: 1.2990003347824641
Energy: 1.3651508474259109
Energy: 1.3197146007722595
Energy: 1.3390043522919322
Energy: 1.3185930772007404
Energy: 1.3331351728456309
Energy: 1.2459363686073337
Energy: 1.2991152264373567
Energy: 1.3414589236114616
Energy: 1.30532834591402
Energy: 1.3551132754849415
Energy: 1.2457159184770388
Energy: 1.278604857617578
Energy: 1.3511389463345502
Energy: 1.2195557869329028
Energy: 1.3676246810882242
Energy: 1.2947359526432225
Energy: 1.2463961812148976
Energy: 1.3503161476299097
Energy: 1.3346697050815604
Energy: 1.3625146509338586
Energy: 1.2675253249341771
Energy: 1.266569102267578
Energy: 1.328686953739424

minimum gb energy = 1.2141397661718947 eV
minimum distance =  2.22984339690257 Angstroms
sigma value = 293


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

Energy: 1.203836483539422
Energy: 1.2633286140093616
Energy: 1.3821227485308394
Energy: 1.2609450658309123
Energy: 1.2101266652761506
Energy: 1.2050995513048641
Energy: 1.2689814749630892
Energy: 1.3819124145069237
Energy: 1.2644035932819992
Energy: 1.2090458115630942
Energy: 1.3297968165619878
Energy: 1.2483104656388628
Energy: 1.2376663595222053
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Energy: 1.2558855767987578
Energy: 1.2573931223119694
Energy: 1.2565331757849212
Energy: 1.2555185231426909
Energy: 1.2635674514888637
Energy: 1.324288599747811
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Energy: 1.2519299311746976
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Energy: 1.3259053444371056
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Energy: 1.3235938822209745
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Energy: 1.2622452109459494
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Energy: 1.2079029397112562
Energy: 1.2085138002693532
Energy: 1.2541296910794404
Energy: 1.3236857088725793
Energy: 1.3937421628978206
Energy: 1.2076447837102458
Energy: 1.2088024017232049
Energy: 1.2556669164094272
Energy: 1.324777679112267
Energy: 1.2569292811712136
Energy: 1.2143051209413454
Energy: 1.2066527547624943
Energy: 1.2391047373434965
Energy: 1.262772396638761
Energy: 1.2550035184469832
Energy: 1.2125779003165975
Energy: 1.2074215611947363
Energy: 1.2374175815056796
Energy: 1.2545664514057087
Energy: 1.2515187731099018
Energy: 1.3893668883410715
Energy: 1.2715412268562913
Energy: 1.2553070376522322
Energy: 1.212135276246688
Energy: 1.2542426435251035
Energy: 1.3927916874273176
Energy: 1.2678518211845369
Energy: 1.2576879603294815
Energy: 1.2636716369236236
Energy: 1.2598478129071535
Energy: 1.2150705723023232
Energy: 1.2522797973142774
Energy: 1.2361407984715749
Energy: 1.2431281069900493
Energy: 1.2571128359778427
Energy: 1.2136036639569339
Energy: 1.2545536974822196
Energy: 1.2371616448511733
Energy: 1.2374348255065315
Energy: 1.2629562204687392
Energy: 1.3240063816510317
Energy: 1.2689702239353684
Energy: 1.2067071480090137
Energy: 1.2135151014231307
Energy: 1.252633785677139
Energy: 1.3171628286779329
Energy: 1.2650852739609817
Energy: 1.205864181865404
Energy: 1.2136192350567678
Energy: 1.250597522763237
Energy: 1.2125910491250305
Energy: 1.25308712958163
Energy: 1.2113149518949642
Energy: 1.327860501502075
Energy: 1.2462782661247773
Energy: 1.2387430883470116
Energy: 1.2511655571769698
Energy: 1.2091717738845662
Energy: 1.2404885022586316
Energy: 1.2580003986588142
Energy: 1.2576885573457712
Energy: 1.3176666294187431
Energy: 1.3952535767312118
Energy: 1.2633703910385967
Energy: 1.2601451409532214
Energy: 1.2615060227890151
Energy: 1.3225054709066335
Energy: 1.2614161278561462
Energy: 1.2560127288064793
Energy: 1.2081780990969455
Energy: 1.2622754233147775
Energy: 1.2508192156676832
Energy: 1.2491930664236817
Energy: 1.328151749925453
Energy: 1.2088937582060875
Energy: 1.256833068779588
Energy: 1.2142400351783182
Energy: 1.2541240346616067
Energy: 1.3297916465313855

minimum gb energy = 1.203836483539422 eV
minimum distance =  2.24583845144307 Angstroms
sigma value = 15


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

Energy: 1.2099922092851032
Energy: 1.4098172633328463
Energy: 1.3826625792739677
Energy: 1.2959008924004316
Energy: 1.395068768252914
Energy: 1.3604362204938893
Energy: 1.4110801688177632
Energy: 1.3818989221216393
Energy: 1.2114667234447283
Energy: 1.359896660439942
Energy: 1.213726683183329
Energy: 1.3852415716933062
Energy: 1.2158867288623372
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Energy: 1.4615673351571563
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Energy: 1.3861279031755447
Energy: 1.2240198501882265
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Energy: 1.3613097809969694
Energy: 1.3874486369177264
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Energy: 1.3789015062675434
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Energy: 1.3677121093680278
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Energy: 1.2120829987494253
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Energy: 1.3030920259382113
Energy: 1.4249040158777455
Energy: 1.3876418415517204
Energy: 1.2101121637956074
Energy: 1.268854555876295
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Energy: 1.2079404750425888
Energy: 1.291312795537211
Energy: 1.2064183675532474
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Energy: 1.2073834835785509
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Energy: 1.2030285688116722
Energy: 1.2238819577894282
Energy: 1.214593083434115
Energy: 1.2174850459456286
Energy: 1.3326183607922912
Energy: 1.2071535729552663
Energy: 1.2252274491237594
Energy: 1.509360402056335
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Energy: 1.2126279049460544
Energy: 1.207156820485514
Energy: 1.3977255643329094
Energy: 1.511889151820638
Energy: 1.2215095765687498
Energy: 1.2098794104260076
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Energy: 1.2236049012581283
Energy: 1.2270253818464663
Energy: 1.2106149737337817
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Energy: 1.2955555425657486
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Energy: 1.2866061784492737
Energy: 1.3062642859744145
Energy: 1.2056737516674843
Energy: 1.2101216847522147
Energy: 1.358916050828262
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Energy: 1.2987522712254531
Energy: 1.4019543615929528
Energy: 1.2132092500533027
Energy: 1.2112001378939012
Energy: 1.3844698538451
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Energy: 1.423469802502359
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Energy: 1.2148074725993663
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Energy: 1.3377673219053365
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Energy: 1.2093856126292586
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Energy: 1.371264129661689
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Energy: 1.2896134251495024
Energy: 1.2068471322155576
Energy: 1.216128506421595
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Energy: 1.2986301095208432
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Energy: 1.216113964103308
Energy: 1.3693336089828454
Energy: 1.3119515921019158
Energy: 1.3771234433767674
Energy: 1.37277933948488
Energy: 1.3786117198646552
Energy: 1.3245797306012286
Energy: 1.3759028418712824
Energy: 1.2084485062397807
Energy: 1.3043156315494469
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Energy: 1.2099249497394413
Energy: 1.300846243147033
Energy: 1.5142114340110362
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Energy: 1.2060564002055147
Energy: 1.376430770638313
Energy: 1.5314889014550899
Energy: 1.4489965302639727
Energy: 1.206877442886399
Energy: 1.2068523073085704
Energy: 1.3764236670697811
Energy: 1.5302623938636983
Energy: 1.214186167355497
Energy: 1.2059434942418994
Energy: 1.207825086626372
Energy: 1.2818625195307443
Energy: 1.2998712097666039
Energy: 1.2101038586238029
Energy: 1.2056930413944515
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Energy: 1.2812568624124787
Energy: 1.319552346548534
Energy: 1.2179745712185772
Energy: 1.2115915039580756
Energy: 1.2265943370478456
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Energy: 1.3404001191336004
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Energy: 1.2059464573034968
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Energy: 1.3679621566426032
Energy: 1.3421348144303233
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Energy: 1.2174816099879713
Energy: 1.3975589179166963
Energy: 1.3689077509928875
Energy: 1.225479382095185
Energy: 1.2237569145633815
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Energy: 1.4004168000186732
Energy: 1.3685620021317664
Energy: 1.2240787055004605
Energy: 1.2177153423688138
Energy: 1.5127607601943818
Energy: 1.2549181717138909
Energy: 1.2063141579150438
Energy: 1.2291597279670583
Energy: 1.2171917946562756
Energy: 1.1986676296086636
Energy: 1.290438177736752
Energy: 1.2121594180212651
Energy: 1.219877090732916
Energy: 1.3707606614542032
Energy: 1.2823257349754662
Energy: 1.206998473260022
Energy: 1.2053987729662572
Energy: 1.2114862690592199
Energy: 1.2993555890042436
Energy: 1.3259340726778144
Energy: 1.2099872521907054
Energy: 1.2049653685279453
Energy: 1.215918962448012
Energy: 1.3703393786610847
Energy: 1.4650389524244345
Energy: 1.2061868256104256
Energy: 1.2069733093169877
Energy: 1.3784590086640425
Energy: 1.3711236075339603
Energy: 1.4096920958119692
Energy: 1.2061887525043695
Energy: 1.2067528564557175
Energy: 1.3776756198904743
Energy: 1.379336815359836
Energy: 1.2082513704617621
Energy: 1.2118324857086942
Energy: 1.2110184988658872
Energy: 1.4644787770634966
Energy: 1.3803039204990544
Energy: 1.206850052721718
Energy: 1.2118541776810547
Energy: 1.2116214896835307
Energy: 1.378889725252007
Energy: 1.2136881500717838
Energy: 1.3761280676331553
Energy: 1.321802737998973
Energy: 1.2160967268168097
Energy: 1.2151223520648575
Energy: 1.214186879525446
Energy: 1.364143413780231
Energy: 1.2133580802738415
Energy: 1.2162750747714037
Energy: 1.2151378284229382
Energy: 1.2079637477984573
Energy: 1.2891395798708447
Energy: 1.3737012581532169
Energy: 1.36833015104171
Energy: 1.336740019934729
Energy: 1.210353943051275
Energy: 1.2947390121736402
Energy: 1.3815224710100698
Energy: 1.3711809614354975
Energy: 1.3379856379374089
Energy: 1.476824171318919
Energy: 1.3867323251547254
Energy: 1.2128510180526386
Energy: 1.3843330448410462
Energy: 1.2750108920572356
Energy: 1.4539429777379484
Energy: 1.390314556658625
Energy: 1.2084643754313087
Energy: 1.3851416250097026
Energy: 1.27763344548916
Energy: 1.215296615201313
Energy: 1.3833950075202504
Energy: 1.2974120349550384
Energy: 1.409137707408861
Energy: 1.3696199650603647
Energy: 1.2159814705599092
Energy: 1.4073630422084353
Energy: 1.3026950089622509
Energy: 1.4088841565373877
Energy: 1.3695838356084638
Energy: 1.4439174469155782
Energy: 1.5142164034481438
Energy: 1.515045045209318
Energy: 1.3670692719178965
Energy: 1.2113853005599158
Energy: 1.4228456214171032
Energy: 1.515439108636617
Energy: 1.514640427569704
Energy: 1.3614010876224203
Energy: 1.2106808882974955
Energy: 1.2072850440669523
Energy: 1.2359204843682663
Energy: 1.224571349638445
Energy: 1.2076176298445267
Energy: 1.2216319784887324
Energy: 1.2085381972304812
Energy: 1.294306769489679
Energy: 1.2247821221912083
Energy: 1.2104160218837943
Energy: 1.2278809043062389
Energy: 1.2262106024731647
Energy: 1.368596144984069
Energy: 1.3975362297806901
Energy: 1.207066305202201
Energy: 1.2102933391240873
Energy: 1.321254698133209
Energy: 1.3688058415377797
Energy: 1.3985843013510777
Energy: 1.207130622830176
Energy: 1.2127730284255245
Energy: 1.3399006043428838
Energy: 1.367713190935674
Energy: 1.222277980420726
Energy: 1.2148216068235504
Energy: 1.318715123912742
Energy: 1.3393746637824577
Energy: 1.207252652629218
Energy: 1.2250364649750172
Energy: 1.2139369544717282
Energy: 1.3253051641258027
Energy: 1.2133892940792854
Energy: 1.2074040720822818
Energy: 1.397682139128115
Energy: 1.5123520314724554
Energy: 1.2179125881452584
Energy: 1.2111532927877198
Energy: 1.2080174828510177
Energy: 1.3984055678525555
Energy: 1.5136145468129965
Energy: 1.2194519627791904
Energy: 1.2237741078505096
Energy: 1.2083133282971057
Energy: 1.225972449786722
Energy: 1.2065187866173879
Energy: 1.2084643396848351
Energy: 1.2202018585495866
Energy: 1.2056324193777492
Energy: 1.2269843672710081
Energy: 1.2828572822714475
Energy: 1.2061125312887033
Energy: 1.2108216287579712
Energy: 1.2168083285285036
Energy: 1.3778102040494633
Energy: 1.3700942365943618
Energy: 1.4567365574442348
Energy: 1.2168935649613288
Energy: 1.3066070705506538
Energy: 1.3802243561154097
Energy: 1.3908830996210606
Energy: 1.4569078944207439
Energy: 1.505316170580158
Energy: 1.4247254859249572
Energy: 1.21663468336065
Energy: 1.354879596236452
Energy: 1.2024315948386524
Energy: 1.2166004015784122
Energy: 1.424413962425359
Energy: 1.207520819651129
Energy: 1.211257876820386
Energy: 1.1950567396710794

minimum gb energy = 1.190702723642713 eV
minimum distance =  2.23327305607558 Angstroms
sigma value = 437


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

Energy: 1.666524303326916
Energy: 1.2136076566303127
Energy: 1.330347735061854
Energy: 1.2298301748134053
Energy: 1.1524942756902126
Energy: 1.6668744674651597
Energy: 1.1997588905302972
Energy: 1.3549429023871484
Energy: 1.2254807908232548
Energy: 1.3196149030680466
Energy: 1.1366369760579942
Energy: 1.2936280681879315
Energy: 1.1980829222105704
Energy: 1.364675750317832
Energy: 1.1730270137850651
Energy: 1.1332914780527177
Energy: 1.2930805263709781
Energy: 1.131645321442981
Energy: 1.293185739474884
Energy: 1.1714653829392183
Energy: 1.2606766670808176
Energy: 1.2808846871264674
Energy: 1.29185417544923
Energy: 1.1806654564232002
Energy: 1.2452151859961178
Energy: 1.259210043245158
Energy: 1.282277551235432
Energy: 1.1718419739940458
Energy: 1.1775953654940094
Energy: 1.2461407356436451
Energy: 1.1764016064290628
Energy: 1.1768281380721288
Energy: 1.168108049187658
Energy: 1.257975202869593
Energy: 1.2522175969800318
Energy: 1.1782587620803369
Energy: 1.179535477507802
Energy: 1.2880364343522501
Energy: 1.2583384725801365
Energy: 1.25109234059612
Energy: 1.4224525742936625
Energy: 1.3185081535083694
Energy: 1.1729802597520236
Energy: 1.1807174598100516
Energy: 1.1397236418667531
Energy: 1.4206948870572433
Energy: 1.3191245205135858
Energy: 1.1732670255791784
Energy: 1.1879230215778298
Energy: 1.1426828404884086
Energy: 1.197580079253667
Energy: 1.1755324552519957
Energy: 1.1296021730495336
Energy: 1.2845397645161833
Energy: 1.2095704586271903
Energy: 1.198365587384345
Energy: 1.1728476995803503
Energy: 1.1292356347338501
Energy: 1.2855773340064043
Energy: 1.209833136322348
Energy: 1.2693063173940895
Energy: 1.2540327075280702
Energy: 1.247685734273076
Energy: 1.1756177781212165
Energy: 1.2923492537058088
Energy: 1.2676659694412131
Energy: 1.2511350430708292
Energy: 1.2487240958668158
Energy: 1.1751700463822499
Energy: 1.2929295591490053
Energy: 1.2885905149610064
Energy: 1.2598564464905861
Energy: 1.1713822084314174
Energy: 1.173746486849326
Energy: 1.2912414771012621
Energy: 1.2791177189582292
Energy: 1.2532171228281153
Energy: 1.1752618427129644
Energy: 1.1857696264135313
Energy: 1.3076961273941505
Energy: 1.1760350471947103
Energy: 1.2886762343049802
Energy: 1.3256923316976157
Energy: 1.171215541341269
Energy: 1.1766100213566952
Energy: 1.1738977766613303
Energy: 1.2884217676401652
Energy: 1.325288252533602
Energy: 1.3075739412495924
Energy: 1.1740779969486193
Energy: 1.2076830855404552
Energy: 1.2654910487265072
Energy: 1.1415433834886957
Energy: 1.3110526616058473
Energy: 1.3217436763500838
Energy: 1.28976375287575
Energy: 1.1635507240848162
Energy: 1.145595034306612
Energy: 1.3868595978992146
Energy: 1.3221598207940075
Energy: 1.1345342696703469
Energy: 1.1324460743218758
Energy: 1.3225927719192547
Energy: 1.2110300983343127
Energy: 1.1421667414521695
Energy: 1.1330181871249883
Energy: 1.1313169033496226
Energy: 1.321057194453697
Energy: 1.2116748678039955
Energy: 1.176729074105511
Energy: 1.1449664556552186
Energy: 1.1455346322415527
Energy: 1.145841129479788
Energy: 1.268294195137397
Energy: 1.138292786963216
Energy: 1.1454123221534003
Energy: 1.1323135228390995
Energy: 1.148338940544587
Energy: 1.2681208675123767
Energy: 1.1351740512893478
Energy: 1.1351185735074996
Energy: 1.144515765210667
Energy: 1.2093665178693997
Energy: 1.2905673983619597
Energy: 1.3222325283678995
Energy: 1.1368540405275438
Energy: 1.1681686367225674
Energy: 1.207516798307121
Energy: 1.289457054108579
Energy: 1.2865615582589358
Energy: 1.1286211103351036
Energy: 1.203948968362044
Energy: 1.2689700718764632
Energy: 1.179104245155305
Energy: 1.1318885564239924
Energy: 1.3729288944045617
Energy: 1.2026090363034743
Energy: 1.3979439933725435
Energy: 1.1321917073594834
Energy: 1.1934625099203007

minimum gb energy = 1.1286211103351036 eV
minimum distance =  2.30368832531924 Angstroms
sigma value = 33