Model name: model_name=EAM_Dynamo_OnatDurukanoglu_2014_CuNi__MO_592013496703_005
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=3.519999995827675
cohesive_energy=4.450349977830043
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=[2.0369753289349198e-19, 2.89005427770822e-19, 3.53933635863672e-19, 4.0663403188583394e-19, 4.5081245039175e-19, 4.88561334065424e-19, 5.21207285159808e-19, 5.496587378263799e-19, 5.7457258448508e-19, 5.9644229553918e-19, 6.15657199910742e-19, 6.32518506806958e-19, 6.47277757959366e-19, 6.60141634153752e-19, 6.712815682899539e-19, 6.808449606183e-19, 6.8895998526951e-19, 6.957323859014279e-19, 7.01267906171898e-19, 7.05641848382718e-19, 7.089327191889539e-19, 7.112110143625019e-19, 7.12537616615454e-19, 7.1296860213e-19, 7.125087774360419e-19, 7.11025161872958e-19, 7.0834632254090995e-19, 7.041149740505159e-19, 6.98906297813382e-19, 6.928180266041819e-19, 6.85544144685822e-19, 6.766937209596059e-19, 6.658005220250399e-19, 6.52308592590126e-19, 6.35516179289172e-19, 6.147615831723359e-19, 5.8911233743863e-19, 5.5727708772105e-19, 5.176200116762819e-19, 4.683226388247359e-19, 4.0889470311640795e-19, 3.3612704475339596e-19, 2.4568577594072997e-19, 1.338798021490008e-19, -6.7185034099502396e-21, -1.8409490177650198e-19, -4.1072759318570394e-19, -7.021491033205979e-19, -1.0703132720474579e-18, -1.54058095330587e-18, -2.1347401471415997e-18, -2.8258550599838397e-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: 0.0 eV

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

Energy: 0.020480072556966697
Energy: 0.16653147413690905
Energy: 0.16776366135382542
Energy: 0.16698326772390162
Energy: 0.025547875898452962
Energy: 0.02235990262008679
Energy: 0.16581776749684118
Energy: 0.16742910312040174
Energy: 0.1665058133607897
Energy: 0.02446078551767843
Energy: 0.165397340943402
Energy: 0.16526817330222915
Energy: 0.1660768573485045
Energy: 0.16751766022060877
Energy: 0.16799840767711524
Energy: 0.16576802600303261
Energy: 0.16546855338182065
Energy: 0.1657853668611464
Energy: 0.166352072083637
Energy: 0.1673044843838255
Energy: 0.1685842863922726
Energy: 0.025464672268678212
Energy: 0.021050291529119393
Energy: 0.16609445794210392
Energy: 0.16683146814310906
Energy: 0.16801582495480313
Energy: 0.024279279669587907
Energy: 0.021038562828457247
Energy: 0.16571962751717653
Energy: 0.16794976689391083
Energy: 0.1670672051612194
Energy: 0.022294715863156497
Energy: 0.022100424361459703
Energy: 0.16501696983552558
Energy: 0.16535183569944661
Energy: 0.16761090714307694
Energy: 0.02199406298469694
Energy: 0.021351826051299004
Energy: 0.16491560689290577
Energy: 0.16537313938413922
Energy: 0.16623685571311206
Energy: 0.16625416288516953
Energy: 0.1654117035939611
Energy: 0.02259586402655283
Energy: 0.021570702618294572
Energy: 0.1666163967311881
Energy: 0.16721599537654952
Energy: 0.16754958739221046
Energy: 0.02392086243848928
Energy: 0.1651456232038457
Energy: 0.16496556875039944
Energy: 0.16558750957278123
Energy: 0.16696521723967103
Energy: 0.022120206684199572
Energy: 0.021059878561209115
Energy: 0.1651128625943783
Energy: 0.16506816297078852
Energy: 0.16788129283293293
Energy: 0.021710643627650288
Energy: 0.0210890406610066
Energy: 0.02111843973972998
Energy: 0.16770192993656383
Energy: 0.16644897091361505
Energy: 0.16762032776250452
Energy: 0.16587731877739487
Energy: 0.02113035305462921
Energy: 0.1655179955595783
Energy: 0.16630580156182886
Energy: 0.1672877612371356
Energy: 0.1682831762276118

minimum gb energy = 0.020480072556966697 eV
minimum distance =  2.45703049549962 Angstroms
sigma value = 3


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

Energy: 1.6312565823506697
Energy: 1.2169030390383544
Energy: 1.2103516985455762
Energy: 1.210666775755788
Energy: 1.230410679790671
Energy: 1.324811245165488
Energy: 1.2036039653511574
Energy: 1.213062851727894
Energy: 1.2110029400245128
Energy: 1.2263881433382486
Energy: 1.197452926425833
Energy: 1.2945369330226506
Energy: 1.2133586626562336
Energy: 1.2329504976113244
Energy: 1.1624775777782026
Energy: 1.1210884813029687
Energy: 1.2680546706051512
Energy: 1.2113139449791868
Energy: 1.0738875471480493
Energy: 1.220770698158347
Energy: 1.1139512290371762
Energy: 1.323883000588454
Energy: 1.04978492589445
Energy: 1.108562420286446
Energy: 1.2166689965068391
Energy: 1.1094920282598728
Energy: 1.1629210105566459
Energy: 1.050313353321861
Energy: 1.1819632255304116
Energy: 1.2130198930758693
Energy: 1.1811955182737488
Energy: 1.212283558962909
Energy: 1.2451254638826341
Energy: 1.1091903515375814
Energy: 1.1499904475187037
Energy: 1.110029991553119
Energy: 1.2148025636248594
Energy: 1.2441220452281179
Energy: 1.1112879965662428
Energy: 1.2115690362295828
Energy: 1.3768198753063263
Energy: 1.217350606971632
Energy: 1.2903784525855309
Energy: 1.111817313651763
Energy: 1.0990797789330424
Energy: 1.3258071664219868
Energy: 1.2174141439381119
Energy: 1.3183043473328229
Energy: 1.1018681712252574
Energy: 1.0987615407383713
Energy: 1.2178448025608974
Energy: 1.2547722811440494
Energy: 1.3148855753005835
Energy: 1.0961028804762425
Energy: 1.0999710951048742
Energy: 1.2161681196403762
Energy: 1.228662006020202
Energy: 1.29087790403207
Energy: 1.093436997858991
Energy: 1.3041005720925933
Energy: 1.276444142617913
Energy: 1.2837994953234344
Energy: 1.3317115511780138
Energy: 1.1006500254821865
Energy: 1.2786733827124204
Energy: 1.2735560535681154
Energy: 1.2940976108831046
Energy: 1.2881512917158926
Energy: 1.1025416150168346
Energy: 1.2778064774421543
Energy: 1.3141552679027975
Energy: 1.261879113083057
Energy: 1.320202863919351
Energy: 1.1598791667011092
Energy: 1.262118898039301
Energy: 1.3145817652463432
Energy: 1.2621860847488067
Energy: 1.2950563524211014
Energy: 1.1583575117492557
Energy: 1.2702739489020365
Energy: 1.2844127440919182
Energy: 1.1166694628811962
Energy: 1.0194693003444943
Energy: 1.3758115651499772
Energy: 1.2621526238433192
Energy: 1.2750691668420482
Energy: 1.1045052215411129
Energy: 1.0519178649758187
Energy: 1.3402666959298004
Energy: 1.2605242182365375
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Energy: 1.0990061551086845
Energy: 1.1721239206022427
Energy: 1.26474009155322
Energy: 1.1657650183292063
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Energy: 1.0966054562884495
Energy: 1.182115497277635
Energy: 1.1097785340197404
Energy: 1.2904064633113455
Energy: 1.098274443522893
Energy: 1.0975101919855461
Energy: 1.166078114591776
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Energy: 1.1667556905840917
Energy: 1.1651158095344902
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Energy: 1.0416832651814
Energy: 1.298784629835905
Energy: 1.3537901763777669
Energy: 1.1094774134454957
Energy: 1.0348183032836942
Energy: 1.2907734024073862
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Energy: 1.3782892996048792
Energy: 1.027650879807737
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Energy: 1.2176059250944866
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Energy: 1.2514631607389062
Energy: 1.2190994692738415
Energy: 1.0475229445542873
Energy: 1.0394401385129906
Energy: 1.3245008566515701
Energy: 1.295576668951545
Energy: 1.3248217286914223
Energy: 1.0494751537709066
Energy: 1.0424180668918357
Energy: 1.3238440926548414
Energy: 1.2960578884206155
Energy: 1.3202680291889022
Energy: 1.4798975730415107
Energy: 1.3100325306159315
Energy: 1.2966987901367462
Energy: 1.2923158449571694
Energy: 1.2945197071071293
Energy: 1.4798984564919913
Energy: 1.3001735751733259
Energy: 1.3056579337400904
Energy: 1.291874989179602
Energy: 1.2951577063803918
Energy: 1.0302276744835028
Energy: 1.3311703558873809
Energy: 1.2961039795346931
Energy: 1.302424867962183
Energy: 1.0419151146336925
Energy: 1.0330180554128918
Energy: 1.3163957386204466
Energy: 1.3008576272210346
Energy: 1.3030151652626543
Energy: 1.0405613109197906
Energy: 1.0287857433611136
Energy: 1.1630416401294184
Energy: 1.0491384485764192
Energy: 1.112450361048733
Energy: 1.0307175475512778
Energy: 1.112321675111191
Energy: 1.049028396516317
Energy: 1.0521305228545876
Energy: 1.1146672255194758
Energy: 1.0300059544617008
Energy: 1.1529453238603673
Energy: 1.0495023537825212
Energy: 1.0498747536406858
Energy: 1.104582900468822
Energy: 1.1040529915510984
Energy: 1.1556345280234246
Energy: 1.0493703207092628
Energy: 1.0490428145184938
Energy: 1.104971485696797
Energy: 1.104208728786383
Energy: 1.3389890176545367
Energy: 1.2924536431805216
Energy: 1.3295916256419356
Energy: 1.297459789956295
Energy: 1.036086367994758
Energy: 1.3123230505390864
Energy: 1.2296185132276853
Energy: 1.3299642030174137
Energy: 1.0949409060868438
Energy: 1.0362410396036748
Energy: 1.216823061721929
Energy: 1.3782613424974048
Energy: 1.3349373055957012
Energy: 1.0960379898563815
Energy: 1.3381667337621572
Energy: 1.2158679102241585
Energy: 1.3223239308218768
Energy: 1.3334652595762082
Energy: 1.3128731896864738
Energy: 1.3393889230443712
Energy: 1.2721647764516653
Energy: 1.2890679656676636
Energy: 1.2322344187684204
Energy: 1.101115123643791
Energy: 1.2510738005278743
Energy: 1.2611066968214086
Energy: 1.2878663701500583
Energy: 1.2083319362109384
Energy: 1.1004939720110414
Energy: 1.3437582119940619
Energy: 1.3114988939878447
Energy: 1.2602624079101985
Energy: 1.1943580946602148
Energy: 1.1683761758709104
Energy: 1.2637524680458707
Energy: 1.311808970929704
Energy: 1.261624376072187
Energy: 1.1156860253061132
Energy: 1.1651105806082656
Energy: 1.2618365156172715
Energy: 1.2763159105745299
Energy: 1.113616728673929
Energy: 1.051414550609431
Energy: 1.3578073782607465
Energy: 1.2620057666722768
Energy: 1.2787031414102872
Energy: 1.1151185956843122
Energy: 1.051836999841152
Energy: 1.3172762293316713
Energy: 1.2602197431419804
Energy: 1.1402581030366892
Energy: 1.1671165009174167
Energy: 1.095991553077038
Energy: 1.1685725078669464
Energy: 1.2573203286212065
Energy: 1.1197560358396996
Energy: 1.1650063233938277
Energy: 1.0986422134405713
Energy: 1.0791795752238191
Energy: 1.0508413740264781
Energy: 1.3492534808269567
Energy: 1.1040202225281646
Energy: 1.1057820021999216
Energy: 1.0952418479951895
Energy: 1.0542319138991134
Energy: 1.184232836386373
Energy: 1.1017545506479316
Energy: 1.0959084740452802
Energy: 1.0960302043290937
Energy: 1.0512101847063309
Energy: 1.1105957521677585
Energy: 1.0967263259217006
Energy: 1.1138047534931965
Energy: 1.2155358976857866
Energy: 1.2031438430752543
Energy: 1.1141514703545163
Energy: 1.0155014529647433
Energy: 1.1006364029968443
Energy: 1.3719309950770595
Energy: 1.208164462654487
Energy: 1.2016100917395929
Energy: 1.3132782671993062
Energy: 1.3541382526633685
Energy: 1.321441012036377
Energy: 1.2160249976301996
Energy: 1.111699097401184
Energy: 1.2119714475562373
Energy: 1.297125884714159
Energy: 1.3232723629674217
Energy: 1.2167017923873553
Energy: 1.198228627589858
Energy: 1.2025570172165974
Energy: 1.2245100067184318
Energy: 1.2034342041784911
Energy: 1.3134879310407008
Energy: 1.1092968875412528
Energy: 1.147640170885958
Energy: 1.2270411610387564
Energy: 1.2020597124654115
Energy: 1.3042563524081732
Energy: 1.2627700336309207
Energy: 1.2144910454542777
Energy: 1.2112536457921297
Energy: 1.214547173253581
Energy: 1.2144704261140256
Energy: 1.2613700730207749
Energy: 1.2161469279397528
Energy: 1.2470180864723384
Energy: 1.2119240695238442
Energy: 1.3168030182014232

minimum gb energy = 1.0155014529647433 eV
minimum distance =  2.20502197413893 Angstroms
sigma value = 75


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

Energy: 2.1451121834101685
Energy: 1.1683287491336534
Energy: 1.1897351734391446
Energy: 1.213930898906191
Energy: 1.1516594777328022
Energy: 1.1456166818916904
Energy: 1.1672940106858622
Energy: 1.2000078725267067
Energy: 1.217997961285432
Energy: 1.35406496796588
Energy: 1.1989221560841907
Energy: 1.1365849358236573
Energy: 1.2030321643744124
Energy: 1.2148570725185686
Energy: 1.125895446130084
Energy: 1.188993360905382
Energy: 1.1790231283559756
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Energy: 1.22991066975636
Energy: 1.1491667083697532
Energy: 1.2717628590785661
Energy: 1.1682319749616823
Energy: 1.1852746841812793
Energy: 1.2559037599940328
Energy: 1.193031454762699
Energy: 1.2307062384697272
Energy: 1.1514373845827608
Energy: 1.184336198874384
Energy: 1.1391855278485643
Energy: 1.195685662642954
Energy: 1.1457815172945762
Energy: 1.1840004083398543
Energy: 1.1811533969398975
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Energy: 1.197250744374024
Energy: 1.1465754071062348
Energy: 1.162947348111346
Energy: 1.1218141965957962
Energy: 1.2783221744672502
Energy: 1.1973484009027993
Energy: 1.1872555873307624
Energy: 1.1424651901885863
Energy: 1.1901721807628203
Energy: 1.3840841546145959
Energy: 1.184833440560645
Energy: 1.182329537340864
Energy: 1.1473825363609058
Energy: 1.1685042053665973
Energy: 1.4004334146994923
Energy: 1.1812495576235453
Energy: 1.149512213026724
Energy: 1.1620935146020905
Energy: 1.1784995041274926
Energy: 1.2043037694643315
Energy: 1.1890565281094192
Energy: 1.1505015530138576
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Energy: 1.1802415320698099
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Energy: 1.1666572993521318
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Energy: 1.1250168838419023
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Energy: 1.1922198590881015
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Energy: 1.4093087750470092
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Energy: 1.271810688281758
Energy: 1.1468135011303393
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Energy: 1.2267239186982757
Energy: 1.2438543716097201
Energy: 1.1423040253050303
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Energy: 1.246831529496712
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Energy: 1.117533748975235
Energy: 1.1219202722095531
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Energy: 1.116312475834204
Energy: 1.1104630696611495
Energy: 1.2064298608105164
Energy: 1.15492208593807
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Energy: 1.4127303420272075
Energy: 1.1748275463479112
Energy: 1.1698995411534154
Energy: 1.160387903936078
Energy: 1.4353446567700177
Energy: 1.253115522177134
Energy: 1.0976429321944563
Energy: 1.161705343152707
Energy: 1.149947542918569
Energy: 1.4210670649013895
Energy: 1.3918376167126538
Energy: 1.2173043148269052
Energy: 1.152088479759704
Energy: 1.1540754189337359
Energy: 1.1770898533231817
Energy: 1.3857293831586308
Energy: 1.2167371911097529
Energy: 1.132649041157709
Energy: 1.1618401704789754
Energy: 1.2315004042050182
Energy: 1.2357167187776068
Energy: 1.1817034764131034
Energy: 1.1189043474069762
Energy: 1.225276027606721
Energy: 1.3675804106584089
Energy: 1.2145082330792936
Energy: 1.213922027933519
Energy: 1.1792856772256155
Energy: 1.1474836560335901
Energy: 1.1983361833442758
Energy: 1.2615165074512584
Energy: 1.197795198146892
Energy: 1.2241876105919782
Energy: 1.273207161452622
Energy: 1.2013706298996387
Energy: 1.271502108832741
Energy: 1.2045843114643977
Energy: 1.2251940030491422
Energy: 1.2900525088075672
Energy: 1.20654049558661
Energy: 1.24043399076903
Energy: 1.2264801136769623
Energy: 1.1712138424558753
Energy: 1.2121895572358368
Energy: 1.1488912497232462
Energy: 1.2232095316349205
Energy: 1.0995555081386108
Energy: 1.140924505753235
Energy: 1.204308482930721
Energy: 1.1907274891340385
Energy: 1.227731611587798
Energy: 1.3918831063112966
Energy: 1.1968294027342536
Energy: 1.1631766659966136
Energy: 1.1643755757514884
Energy: 1.244088127327679
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minimum gb energy = 1.0767007707284666 eV
minimum distance =  2.23025301428787 Angstroms
sigma value = 105


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

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Energy: 1.279939734798596
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Energy: 1.2091170555251731
Energy: 1.229670549933817
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Energy: 1.2231751074445434
Energy: 1.200648682570598
Energy: 1.2184038078185022
Energy: 1.2177937848497398
Energy: 1.2182665760568774
Energy: 1.2207181340353543
Energy: 1.149668764935373
Energy: 1.2180449573661114
Energy: 1.220539800159259
Energy: 1.225463922946626
Energy: 1.2966835603995635
Energy: 1.2536305937271357
Energy: 1.2353683481339899
Energy: 1.2114268116988922
Energy: 1.1977543724326742
Energy: 1.2224547690229455
Energy: 1.2491403555692517
Energy: 1.2120070080176764
Energy: 1.1765156686160656
Energy: 1.2686946008351123
Energy: 1.2559417576657883
Energy: 1.2245623371585888
Energy: 1.2249494226617497
Energy: 1.1469773580067564
Energy: 1.2155926745277819
Energy: 1.175578644172917
Energy: 1.221155834095034
Energy: 1.2217103612306162
Energy: 1.2117286162954821
Energy: 1.3016575593833446
Energy: 1.182551036848542
Energy: 1.2368334293323253
Energy: 1.1982873788034836
Energy: 1.1677210145057584
Energy: 1.232689955195417
Energy: 1.169059104579962
Energy: 1.2202772736166905
Energy: 1.2198278497867003
Energy: 1.2320384102340485
Energy: 1.2625835038083062
Energy: 1.24853216632134
Energy: 1.1994329226385148
Energy: 1.262475912237448
Energy: 1.3223182423236957
Energy: 1.1697368794384448
Energy: 1.2472605013240208
Energy: 1.2556234774259156
Energy: 1.265800654443209
Energy: 1.3081319926888144
Energy: 1.2229658158688166
Energy: 1.1777875976389787
Energy: 1.1630791925828354
Energy: 1.240747685704376
Energy: 1.2068614164669509
Energy: 1.1821341839964814
Energy: 1.164146870414044
Energy: 1.1791483197132375
Energy: 1.182737880619068
Energy: 1.2199291018790732
Energy: 1.213775407067717
Energy: 1.1490707201016652
Energy: 1.1807659076478052
Energy: 1.1779740584327982
Energy: 1.1487025315728454
Energy: 1.1502027613572416
Energy: 1.1475385774548243
Energy: 1.1809429101960303
Energy: 1.1655544911573597
Energy: 1.2085697489443379

minimum gb energy = 1.1279986676469185 eV
minimum distance =  2.21382441204844 Angstroms
sigma value = 165


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

Energy: 1.5593047531709456
Energy: 1.148750766466601
Energy: 1.1710307196947978
Energy: 1.1806578497012747
Energy: 1.1256957570567314
Energy: 1.4518494494945027
Energy: 1.1585387092872401
Energy: 1.1821324525084105
Energy: 1.1991338081817584
Energy: 1.1655057820003942
Energy: 1.2304211385872628
Energy: 1.2315942364812689
Energy: 1.1820368675405908
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Energy: 1.2358988545184666
Energy: 1.1770581169647247
Energy: 1.1964457834066464
Energy: 1.2201025817721323
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Energy: 1.155806698046035
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Energy: 1.1711637100912102
Energy: 1.2184850295212948
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Energy: 1.1396869651087083
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Energy: 1.1576313650293055
Energy: 1.230613254808909
Energy: 1.230097973027851
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Energy: 1.1584934446834763
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Energy: 1.225531444869745
Energy: 1.2102703244409858
Energy: 1.216076194456956
Energy: 1.288445210281398
Energy: 1.2236534301020123
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Energy: 1.2376695982530765
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Energy: 1.2688915420946845
Energy: 1.2152241720881685
Energy: 1.2333432920054181
Energy: 1.2356031023259497
Energy: 1.13600299261816
Energy: 1.1426213577610387
Energy: 1.1472359660783087
Energy: 1.2409014664701754
Energy: 1.162660187044085
Energy: 1.2225543306528952
Energy: 1.2234735461144908
Energy: 1.2215089590217838
Energy: 1.1864534334282328
Energy: 1.1764106349466334
Energy: 1.1317017423980287
Energy: 1.1357796354665248
Energy: 1.214964426885473
Energy: 1.172961066618303
Energy: 1.1745562675902672
Energy: 1.2131019350276118
Energy: 1.2075596603527454
Energy: 1.1864796733799567
Energy: 1.2100407537948852
Energy: 1.22322908127648
Energy: 1.183712106937786
Energy: 1.160399967407466
Energy: 1.1346111150817695
Energy: 1.1622156336280551
Energy: 1.206904351152289
Energy: 1.1868322741765642
Energy: 1.16364178927045
Energy: 1.201259104681769
Energy: 1.1552624132682718
Energy: 1.236482503881972
Energy: 1.1811513111356473
Energy: 1.1734516969367672
Energy: 1.1961533292348452
Energy: 1.1438920248850484
Energy: 1.1649669403840186
Energy: 1.1964215012472217
Energy: 1.1799778600724962
Energy: 1.234769318696625

minimum gb energy = 1.1125605727280534 eV
minimum distance =  2.2543736355047 Angstroms
sigma value = 41


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

Energy: 1.3146776282732002
Energy: 1.0943721015032353
Energy: 1.076076550658491
Energy: 1.0137818542056352
Energy: 1.0432700312221976
Energy: 1.014984800439738
Energy: 1.0799652600395355
Energy: 1.0766479502399373
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Energy: 1.0893929459751122
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Energy: 1.070346355115887
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Energy: 1.0830734738419319
Energy: 1.0394308692238379
Energy: 1.0762637264267163
Energy: 1.079799776284289
Energy: 1.057179423145987
Energy: 1.0784112185902244
Energy: 1.078633924371331
Energy: 1.108100475522215
Energy: 1.1057956042187047
Energy: 1.2179734806922702
Energy: 1.0782476386663151
Energy: 1.1112835760710087
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Energy: 1.076196313227688
Energy: 1.0869866732344686
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Energy: 1.0725567321738225
Energy: 1.0561777877568077
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Energy: 1.105038304448901
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Energy: 1.109404459874063
Energy: 1.0859605790435762
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Energy: 1.1099708009666205
Energy: 1.1217290428841233
Energy: 1.0644308353711307
Energy: 1.0646065791657708
Energy: 1.0577554752393141
Energy: 1.075586532082163
Energy: 1.0937510463570086
Energy: 1.100673356425427
Energy: 1.0795548865288789
Energy: 1.0567230724804597
Energy: 1.2323409328523658
Energy: 1.0787530925352173
Energy: 1.0961395829709466
Energy: 1.0443612705801282
Energy: 1.0574632778586257
Energy: 1.0528414793549135
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Energy: 1.1645162699477365
Energy: 1.0473219589156795
Energy: 1.0614505151520637
Energy: 1.0614358687808614
Energy: 1.0642889706483762
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Energy: 1.0502671221677857
Energy: 1.0513762155449193
Energy: 1.0287272678368273
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Energy: 1.0622483710443797
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Energy: 1.0771935539853494
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Energy: 1.0587553949413795
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Energy: 1.074315718474593
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Energy: 1.173071886973579
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Energy: 1.0891456524651797
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Energy: 1.0891818983773036
Energy: 1.044350586892909
Energy: 1.111566102982428
Energy: 1.0747893043610603
Energy: 1.1552303638925936
Energy: 1.1119851309822157
Energy: 1.1827985240531032
Energy: 1.0792311884275136
Energy: 1.078080838738364
Energy: 1.1522323317417726
Energy: 1.1124549277470903
Energy: 1.1624333640270434
Energy: 1.0790778954014624
Energy: 1.0793963245311917
Energy: 1.079905407802999
Energy: 1.085203585155558
Energy: 1.1033410905559868
Energy: 1.072280703670456
Energy: 1.0673712178712933
Energy: 1.0559733088127534
Energy: 1.0774215850885622
Energy: 1.105888666909995
Energy: 1.0776722708956266
Energy: 1.0972385701985046
Energy: 1.1218202370763535
Energy: 1.0826593331601728
Energy: 1.0908612816503835
Energy: 1.0833998882716676
Energy: 1.0700770840526896
Energy: 1.0786122868196846
Energy: 1.0853339580404955
Energy: 1.1119843318829
Energy: 1.1003184914285267
Energy: 1.0684584194763513
Energy: 1.0783963785843262
Energy: 1.1213761867026384
Energy: 1.0343029173649005
Energy: 1.0689298081507144
Energy: 1.069922485320787
Energy: 1.079036855637996
Energy: 1.0695467369486638
Energy: 1.0767485927217684
Energy: 1.0733830774007782
Energy: 1.0359870279276515
Energy: 1.0381532761869245
Energy: 1.0447276305334043
Energy: 1.0418104381234428
Energy: 1.0490330279614377
Energy: 1.0714810072101384
Energy: 1.1244597010645203
Energy: 1.0454369900133615
Energy: 1.1080086005878709
Energy: 1.0818402089105696
Energy: 1.0957380662622012
Energy: 1.0442482869778107
Energy: 1.1201067594588592
Energy: 1.045244700858638
Energy: 1.0735948325225446
Energy: 1.0369017084550116
Energy: 1.0383648676153707
Energy: 1.0800563321741041
Energy: 1.0684079285308046
Energy: 1.0753280080847254
Energy: 1.0847907286617022
Energy: 1.111720852238103
Energy: 1.0157908589719116
Energy: 1.09344086142259
Energy: 1.068676454460646
Energy: 1.0577612662165088
Energy: 1.0139985602971975
Energy: 1.0177617117887001
Energy: 1.1549609279400126
Energy: 1.0424681530830227
Energy: 1.0708243477401855

minimum gb energy = 1.0137818542056352 eV
minimum distance =  2.28225547990086 Angstroms
sigma value = 185


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

Energy: 0.5330578577673688
Energy: 0.6222120826180139
Energy: 0.6288456410611536
Energy: 0.6156434252159979
Energy: 0.48157474693383495
Energy: 0.48078394550995524
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Energy: 0.4818659685458542
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Energy: 0.6290129321170265
Energy: 0.634488529680584
Energy: 0.6286409225214004
Energy: 0.5974295587319006
Energy: 0.5988660855397727
Energy: 0.6285359587343624
Energy: 0.6323120263351659
Energy: 0.5884640736519989
Energy: 0.515253964592245
Energy: 0.5961680809490661
Energy: 0.6313019429572392
Energy: 0.6325337182130718
Energy: 0.6207969043589078
Energy: 0.5149989730474662
Energy: 0.5973758680299486
Energy: 0.6916624734464101
Energy: 0.5927060348017211
Energy: 0.5194928314239655
Energy: 0.48061854659769654
Energy: 0.6246543668163421
Energy: 0.6345002844875935
Energy: 0.6103119405073443
Energy: 0.4825811653683261
Energy: 0.4804466815683409
Energy: 0.6263786772436609
Energy: 0.6341162327406908
Energy: 0.6099483209725407
Energy: 0.6227754297511482
Energy: 0.6307099755229983
Energy: 0.5916052876440965
Energy: 0.6440376535748932
Energy: 0.6309386074439326
Energy: 0.632393527171936
Energy: 0.5978755176667886
Energy: 0.5988113834272231
Energy: 0.6320497555326189
Energy: 0.617646026756755
Energy: 0.5366682204666885
Energy: 0.599384695683259
Energy: 0.5987931153824723
Energy: 0.6278466281566699
Energy: 0.6148713984646409
Energy: 0.48156871323292294
Energy: 0.600174889426057
Energy: 0.5909795423062089
Energy: 0.6838547181701321
Energy: 0.5353296091119831

minimum gb energy = 0.47980080658091295 eV
minimum distance =  2.32126738417352 Angstroms
sigma value = 33


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

Energy: 1.0196810668991387
Energy: 0.9762685264900678
Energy: 1.010022408425974
Energy: 1.0086276073309086
Energy: 0.9448854329194118
Energy: 0.9461742614687719
Energy: 0.9567044517029684
Energy: 0.9952456557780633
Energy: 0.9798296258748357
Energy: 0.9829240385915554
Energy: 0.9741164805099465
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Energy: 1.0101332635696199
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Energy: 1.0119326722803974
Energy: 0.9577130136854476
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Energy: 1.0316830006507096
Energy: 1.0301198302069576
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Energy: 1.0200916752596314
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Energy: 0.9832237033626892
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Energy: 1.0183241479823895
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Energy: 0.9727660067191058
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Energy: 0.9714200618505494
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Energy: 0.9991949199149902
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Energy: 0.971308368003077
Energy: 0.9894087152468279
Energy: 0.9902993202819339
Energy: 0.9961578715952484
Energy: 1.0578590528720317
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Energy: 1.0101735099534546
Energy: 0.9728057403704709
Energy: 1.014936400405066
Energy: 0.9968292842870174
Energy: 0.9705545024561131
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Energy: 0.9725001369200887
Energy: 0.9886031250994937
Energy: 0.9960449878809166
Energy: 0.9706419017822762
Energy: 0.9714134403297969
Energy: 1.0130055332947123
Energy: 0.9601517921823852
Energy: 0.9947922924240196
Energy: 1.0121300689742732
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Energy: 1.0116596577512578
Energy: 0.9632962633167748
Energy: 1.058732834599462
Energy: 1.0244456490273066
Energy: 0.9576909676502673
Energy: 1.0268502099490298
Energy: 0.9736990962025582
Energy: 0.970460326367942
Energy: 0.9708426119957393
Energy: 0.9932900826479855
Energy: 0.9925171859930928
Energy: 1.0988264942757786
Energy: 0.9704875229298253
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Energy: 0.9578300119032747
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Energy: 0.9440707558026028
Energy: 0.9590452194310367
Energy: 0.9767861628895333
Energy: 0.9963082973242997
Energy: 1.004786194617809

minimum gb energy = 0.9440707558026028 eV
minimum distance =  2.25582076271691 Angstroms
sigma value = 219


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

Energy: 1.7102527863045107
Energy: 1.1858282981520867
Energy: 1.1972288180889887
Energy: 1.1981708838864882
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Energy: 1.197624057833396
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Energy: 1.200631011628246
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Energy: 1.1585775407184256
Energy: 1.1884310709376138
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Energy: 1.1607346428260101
Energy: 1.1891160936092382
Energy: 1.1993965186283846
Energy: 1.2005883293102528
Energy: 1.182360896998475

minimum gb energy = 1.157581322284606 eV
minimum distance =  2.25752345962161 Angstroms
sigma value = 15


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

Energy: 1.9707578602976652
Energy: 1.3471486753162796
Energy: 1.351042467400019
Energy: 1.3290491036981218
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Energy: 1.3135810122629241
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Energy: 1.3033336473162678
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Energy: 1.336079504835751
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Energy: 1.3272120162458605
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Energy: 1.385716948536423
Energy: 1.3239443097749708
Energy: 1.3288941838898771
Energy: 1.370526840740804
Energy: 1.3412424808768142
Energy: 1.3451275491971573
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Energy: 1.3175423249575091
Energy: 1.3285420189321921
Energy: 1.3301330280981722
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minimum gb energy = 1.2870978107545836 eV
minimum distance =  2.22782294411598 Angstroms
sigma value = 293


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

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Energy: 1.3752949588232415
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Energy: 1.377951649293987
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Energy: 1.3040524895902443
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Energy: 1.3445441690843603
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Energy: 1.3052350615532793
Energy: 1.3353512493257247
Energy: 1.2637829739543849
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Energy: 1.3026633709583637
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Energy: 1.3092486388992803
Energy: 1.3416894495599796
Energy: 1.3423962175174333
Energy: 1.3029841311111003
Energy: 1.3030987025065033
Energy: 1.308915250538229
Energy: 1.3429122882340705
Energy: 1.3379612198166693
Energy: 1.3218990637215775
Energy: 1.3006308133446625
Energy: 1.3106980353830153
Energy: 1.3417142509369875
Energy: 1.3053602369264767
Energy: 1.3092952797862487
Energy: 1.3820688585983572
Energy: 1.3481723101362455
Energy: 1.340865263931226
Energy: 1.305985017040778
Energy: 1.3049253765735864
Energy: 1.353698273262141
Energy: 1.3090154051136407
Energy: 1.3426271541558765
Energy: 1.4212965273083848
Energy: 1.3091591696127665
Energy: 1.4312029781064903
Energy: 1.3117669761617226
Energy: 1.3448092234724789
Energy: 1.425557960572185
Energy: 1.3090445766683936
Energy: 1.432099679074213
Energy: 1.37825308923914
Energy: 1.325435856349501
Energy: 1.3110360873778908
Energy: 1.3054661096079854
Energy: 1.3563114259671056
Energy: 1.3201449302080273
Energy: 1.329943555158713
Energy: 1.3107064775332067
Energy: 1.3065168206525797
Energy: 1.3306287585432754

minimum gb energy = 1.259765805268807 eV
minimum distance =  2.22366744808032 Angstroms
sigma value = 293


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

Energy: 1.1951110604133655
Energy: 1.2260019845451338
Energy: 1.3445557445120955
Energy: 1.2237993469599966
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Energy: 1.1958009486464465
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Energy: 1.2029778594955725
Energy: 1.2244956343324473
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Energy: 1.2014687533392454
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Energy: 1.22178590636353
Energy: 1.2230752242483323
Energy: 1.2223997426037503
Energy: 1.20160545228033
Energy: 1.1981570369383565
Energy: 1.2215372930500175
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Energy: 1.2202451563332037
Energy: 1.3533979582210514
Energy: 1.233839948227372
Energy: 1.2225424046308402
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Energy: 1.2207474454323992
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Energy: 1.2223913632555796
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Energy: 1.2031341857851996
Energy: 1.2231633370601993
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Energy: 1.2193456427758689
Energy: 1.2243581079439352
Energy: 1.3054110595248882
Energy: 1.235118318335538
Energy: 1.196644904232382
Energy: 1.201495292744111
Energy: 1.2267890230425094
Energy: 1.307741030619287
Energy: 1.2275675451659083
Energy: 1.1961504114412518
Energy: 1.200541478988266
Energy: 1.2210150180471007
Energy: 1.2013310813201004
Energy: 1.2203898518723624
Energy: 1.2007986062883982
Energy: 1.3120795295603862
Energy: 1.2200951342471087
Energy: 1.2179279557777947
Energy: 1.2195925966053842
Energy: 1.2006126973911857
Energy: 1.2222078507492846
Energy: 1.2254193213508318
Energy: 1.223473352252105
Energy: 1.3095636359771912
Energy: 1.220424760650526
Energy: 1.228918176406915
Energy: 1.2450285660425058
Energy: 1.2238860845948105
Energy: 1.3126706535565535
Energy: 1.228376054478701
Energy: 1.224750732746732
Energy: 1.199183625637358
Energy: 1.246572145304329
Energy: 1.2211956183381834
Energy: 1.223040594802891
Energy: 1.311522936712984
Energy: 1.2003304774947186
Energy: 1.2245488549894186
Energy: 1.2020213994386897
Energy: 1.2247983773480748
Energy: 1.3099388278086104

minimum gb energy = 1.1951110604133655 eV
minimum distance =  2.23584374566872 Angstroms
sigma value = 15


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

Energy: 2.1872361967076692
Energy: 1.332204415528656
Energy: 1.3497660433992442
Energy: 1.264200534213881
Energy: 1.2610176073092596
Energy: 1.2555703191297103
Energy: 1.3227273189385431
Energy: 1.3568579693369502
Energy: 1.2597041695343394
Energy: 1.3896861441644117
Energy: 1.263280415339998
Energy: 1.3047206733649857
Energy: 1.3236297672770503
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Energy: 1.3120373117360757
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Energy: 1.2906600365818244
Energy: 1.2715659386109586
Energy: 1.3202232372425275
Energy: 1.292145765385448
Energy: 1.2583111180798956
Energy: 1.2626750142610246
Energy: 1.458939712795014
Energy: 1.459959295461455
Energy: 1.4147775612492497
Energy: 1.2315271091274351
Energy: 1.3053766706497691
Energy: 1.458656044100129
Energy: 1.3147783666253607
Energy: 1.4158592576228317
Energy: 1.296550405887087
Energy: 1.3964176015336822
Energy: 1.3565338058086314
Energy: 1.3778092496638126
Energy: 1.2238901864220315
Energy: 1.2566042000075897
Energy: 1.2993931652457922
Energy: 1.3569714682016525
Energy: 1.2954227215429235
Energy: 1.2570275991544941
Energy: 1.3471123921290558
Energy: 1.3214385190044649
Energy: 1.317843763988391
Energy: 1.3119269003423049
Energy: 1.3438963237602863
Energy: 1.2544602851260445
Energy: 1.3174786760603745
Energy: 1.3174295223114683
Energy: 1.3204314915761028
Energy: 1.3149252025847953
Energy: 1.4079761902168861
Energy: 1.3451846575591515
Energy: 1.3096767711731903
Energy: 1.3673332207572846
Energy: 1.288078544512066
Energy: 1.4055471103798296
Energy: 1.338444756168004
Energy: 1.3073538049900413
Energy: 1.2782191874350437
Energy: 1.4384917555880905
Energy: 1.2807940985921626
Energy: 1.442489310683575
Energy: 1.3567274613996103
Energy: 1.4219683836149308
Energy: 1.4498442475127529
Energy: 1.2896696458852277
Energy: 1.4420979489184067
Energy: 1.3984152292074705
Energy: 1.4197348588323517
Energy: 1.4410303027197164
Energy: 1.4369346859960526
Energy: 1.2407677133480013
Energy: 1.2982757253276465
Energy: 1.2666013100200437
Energy: 1.34384367254264
Energy: 1.428196132640601
Energy: 1.2978522065999636
Energy: 1.2940525778199563
Energy: 1.266934557663332
Energy: 1.378458467531969
Energy: 1.4348418783989665
Energy: 1.264605028075972
Energy: 1.26439387594592
Energy: 1.437011909978611
Energy: 1.4395547808943794
Energy: 1.4510156868514925
Energy: 1.2646234366160498
Energy: 1.2650513470394202
Energy: 1.456632791462065
Energy: 1.442380904180962
Energy: 1.2674868448524774
Energy: 1.269512634872908
Energy: 1.2656670219756687
Energy: 1.2702096908153528
Energy: 1.363019941994618
Energy: 1.2673971959632229
Energy: 1.269859573434898
Energy: 1.2653185606795943
Energy: 1.3702836654379726
Energy: 1.4131282671289331
Energy: 1.2711999953983606
Energy: 1.2688206067494299
Energy: 1.2749994696278968
Energy: 1.253153702089888
Energy: 1.386188336264997
Energy: 1.2689636508459705
Energy: 1.2661386421010667
Energy: 1.2750363315440847
Energy: 1.358929795938986
Energy: 1.3015477667287516
Energy: 1.2646792351413276
Energy: 1.3631603592975887
Energy: 1.3411393933052391
Energy: 1.3625147070098225
Energy: 1.2431212853308389
Energy: 1.3491782857233812
Energy: 1.2973560334182932
Energy: 1.3457481140343863
Energy: 1.3618031067198022
Energy: 1.240440172545072
Energy: 1.2581413838974702
Energy: 1.4355558294493074
Energy: 1.3057981230407203
Energy: 1.2836014424262305
Energy: 1.2861199809276371
Energy: 1.2587469143713501
Energy: 1.434891584793549
Energy: 1.318784045969176
Energy: 1.2850120872570794
Energy: 1.288203530344352
Energy: 1.3520653043470636
Energy: 1.3041935724111418
Energy: 1.279578207309304
Energy: 1.2838974964126115
Energy: 1.2843863475846762
Energy: 1.357312025394817
Energy: 1.3299407677072759
Energy: 1.2810837934234955
Energy: 1.2855999557887716
Energy: 1.2854815583464732
Energy: 1.4617306521555
Energy: 1.314340009818968
Energy: 1.265353678340132
Energy: 1.2407687545068937
Energy: 1.287982347136302
Energy: 1.4606159735678679
Energy: 1.3283272924588658
Energy: 1.2659249117827074
Energy: 1.2275184531303325
Energy: 1.2872409429525777
Energy: 1.3602080370098026
Energy: 1.247040703984217
Energy: 1.2561215175859464
Energy: 1.2667578715571284
Energy: 1.343545265144456
Energy: 1.359998758392069
Energy: 1.2461156098173698
Energy: 1.2560489589069341
Energy: 1.256631484155383
Energy: 1.3414924328913111
Energy: 1.3167043193789172
Energy: 1.3256538713635913
Energy: 1.4393213710905082
Energy: 1.2857703701868668
Energy: 1.2911215942887362
Energy: 1.3167938384020466
Energy: 1.3205431467114
Energy: 1.269980972069201
Energy: 1.284723628078402
Energy: 1.2860108239595196
Energy: 1.3041225387118425
Energy: 1.3443305440376412
Energy: 1.4424272375724152
Energy: 1.3104454272888952
Energy: 1.321771733727954
Energy: 1.2832963523829908
Energy: 1.3488847902203633
Energy: 1.4430530478181365
Energy: 1.2913043134938877
Energy: 1.320951569611659
Energy: 1.4256742425802937
Energy: 1.4447207239569935
Energy: 1.4440453567909648
Energy: 1.4045601256832467
Energy: 1.3229878459035307
Energy: 1.404231080515641
Energy: 1.4436114084394431
Energy: 1.4436404852905198
Energy: 1.4029165994832205
Energy: 1.30306413608508
Energy: 1.2352979706381815
Energy: 1.3947259148528561
Energy: 1.336052437941129
Energy: 1.4584993375830855
Energy: 1.293446610449843
Energy: 1.2392650184266738
Energy: 1.4122339200768075
Energy: 1.503394518659486
Energy: 1.4693833577931463
Energy: 1.2943475905030482
Energy: 1.464769409487205
Energy: 1.4561523207371385
Energy: 1.45486608812585
Energy: 1.4468847224241403
Energy: 1.267455521536369
Energy: 1.4436525426007514
Energy: 1.4554485728110593
Energy: 1.453957009351918
Energy: 1.3404386357683482
Energy: 1.2648936223745864
Energy: 1.2644344930282645
Energy: 1.4255358954073247
Energy: 1.2751074812622305
Energy: 1.2651559270216854
Energy: 1.2723844878461659
Energy: 1.2667646164717443
Energy: 1.44253955560588
Energy: 1.2732913666708983
Energy: 1.2665960491935695
Energy: 1.2731820352169412
Energy: 1.2791736756167538
Energy: 1.3618040920113692
Energy: 1.3590822366502573
Energy: 1.2640503280337263
Energy: 1.266734828048417
Energy: 1.3261327215573
Energy: 1.3624720489829332
Energy: 1.2721295972841127
Energy: 1.2623012313390363
Energy: 1.2665374591763485
Energy: 1.4085772592365287
Energy: 1.3589759828744812
Energy: 1.2863378058377564
Energy: 1.3314180739758072
Energy: 1.3223701251839577
Energy: 1.3827647970472934
Energy: 1.253430609708866
Energy: 1.2732006562153306
Energy: 1.376894277054126
Energy: 1.3833776050971043
Energy: 1.2703770248767519
Energy: 1.265997365509371
Energy: 1.336205348320102
Energy: 1.500845848483455
Energy: 1.25940291346706
Energy: 1.224844376157722
Energy: 1.2817169901208183
Energy: 1.3262009844580107
Energy: 1.5044253674047265
Energy: 1.2607066443499502
Energy: 1.268737262521699
Energy: 1.2668338998491184
Energy: 1.2719981829969305
Energy: 1.3223334105920586
Energy: 1.282285867632943
Energy: 1.2874907697308067
Energy: 1.285585933998754
Energy: 1.2869354417766554
Energy: 1.3272007859532522
Energy: 1.283223635164662
Energy: 1.2697799908480756
Energy: 1.324600324441982
Energy: 1.4646139697668554
Energy: 1.4587944414217107
Energy: 1.2863532304393581
Energy: 1.2778543619358982
Energy: 1.282678104295849
Energy: 1.4633202232473357
Energy: 1.3087652528935751
Energy: 1.3227305480148122
Energy: 1.3144539519927878
Energy: 1.31740566801189
Energy: 1.3012903871939385
Energy: 1.2579047642644072
Energy: 1.2187827103358484
Energy: 1.2588409143714365
Energy: 1.3187876251378117
Energy: 1.3005565290955163
Energy: 1.295966712949103
Energy: 1.238649962366097

minimum gb energy = 1.2187827103358484 eV
minimum distance =  2.20426848473523 Angstroms
sigma value = 437


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

Energy: 1.6779101709706383
Energy: 1.2543765281983963
Energy: 1.218129523254392
Energy: 1.3051526733943077
Energy: 1.1847117229249264
Energy: 1.675060685660951
Energy: 1.2540804228058207
Energy: 1.2172722013649229
Energy: 1.305309197076526
Energy: 1.1887714588825122
Energy: 1.2857446646120605
Energy: 1.331829600607929
Energy: 1.3764992178213193
Energy: 1.3872545738180486
Energy: 1.3320576209542814
Energy: 1.286863268014455
Energy: 1.3286950678565752
Energy: 1.3822271028484465
Energy: 1.3259705223285008
Energy: 1.2113032897579068
Energy: 1.2856603959794122
Energy: 1.306858200035035
Energy: 1.324000357930452
Energy: 1.2135096621954822
Energy: 1.2871993912010147
Energy: 1.2854102898765987
Energy: 1.3085871064668344
Energy: 1.3240744899507801
Energy: 1.2113583646209831
Energy: 1.2896684858508194
Energy: 1.2102416279277575
Energy: 1.2113937181013685
Energy: 1.3201346408827825
Energy: 1.222120001968162
Energy: 1.285519709517827
Energy: 1.211679587152928
Energy: 1.2135369365929647
Energy: 1.320478998864917
Energy: 1.2872616622447803
Energy: 1.2868601523301233
Energy: 1.2233524783984357
Energy: 1.3235378111907456
Energy: 1.222387709545708
Energy: 1.2112424916624087
Energy: 1.2247942207069906
Energy: 1.2220752016455025
Energy: 1.3236018116594845
Energy: 1.209482093984405
Energy: 1.2234875804794936
Energy: 1.267908926034496
Energy: 1.2294410665266553
Energy: 1.2105212920117443
Energy: 1.178666787436762
Energy: 1.2269725137406535
Energy: 1.260107453201134
Energy: 1.229897110793458
Energy: 1.2093002968436664
Energy: 1.1782229501326038
Energy: 1.2243833362861185
Energy: 1.6808751515768945
Energy: 1.2912653476505807
Energy: 1.2844397296383572
Energy: 1.2846817739923435
Energy: 1.212736447157717
Energy: 1.3248608084605122
Energy: 1.2895547610157394
Energy: 1.2853099412866131
Energy: 1.285359642093684
Energy: 1.2138477189295758
Energy: 1.3288014563895092
Energy: 1.3050311531810006
Energy: 1.2866590647953537
Energy: 1.2094419740559268
Energy: 1.2219616399880298
Energy: 1.3261580794160217
Energy: 1.3079386279746423
Energy: 1.2854020132861006
Energy: 1.209962638920342
Energy: 1.2137586210796536
Energy: 1.3262668584851052
Energy: 1.2093406623999603
Energy: 1.321290229332162
Energy: 1.1836235605292558
Energy: 1.324237258880416
Energy: 1.2097215653288187
Energy: 1.2077928327691274
Energy: 1.319575240534079
Energy: 1.1817604111412574
Energy: 1.224772385372569
Energy: 1.2079910381443484
Energy: 1.1814049327947125
Energy: 1.2266505988839054
Energy: 1.189398615696439
Energy: 1.1857248823238276
Energy: 1.2551135131334772
Energy: 1.2202176201379284
Energy: 1.205737133484129
Energy: 1.1901850565374066
Energy: 1.1863031023052297
Energy: 1.263884335246267
Energy: 1.1813195717161025
Energy: 1.1802098277798434
Energy: 1.1811236254517818
Energy: 1.2607067368816134
Energy: 1.1818155043268437
Energy: 1.179684533272587
Energy: 1.17976919536134
Energy: 1.182273823759796
Energy: 1.2610416530830002
Energy: 1.2099763898087228
Energy: 1.1801971500335735
Energy: 1.1864613599313072
Energy: 1.1865928103231775
Energy: 1.3453564751941955
Energy: 1.184074427946905
Energy: 1.1817644561696545
Energy: 1.1893050307682056
Energy: 1.1882103771208476
Energy: 1.243472601145403
Energy: 1.1820520566373858
Energy: 1.1813450790558822
Energy: 1.1887273828135516
Energy: 1.3194919429281569
Energy: 1.3219944644345563
Energy: 1.1820172254750554
Energy: 1.1827647329602808
Energy: 1.2097957680266693
Energy: 1.3222275805653687
Energy: 1.3220259871608941
Energy: 1.180756925406866
Energy: 1.3773539727542883
Energy: 1.1820763189414074
Energy: 1.3747065222337365
Energy: 1.1869577177266253
Energy: 1.1899830395280688
Energy: 1.2215005310157654
Energy: 1.1829635948276165
Energy: 1.3781597401950998
Energy: 1.1888164163089328
Energy: 1.2252284596177454

minimum gb energy = 1.1782229501326038 eV
minimum distance =  2.28067482273813 Angstroms
sigma value = 33