Model name: model_name=MEAM_LAMMPS_KimJungLee_2010_FeNbC__MO_072689718616_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.176897808909416
cohesive_energy=7.383914292925778
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.02618254036774798
Energy: 0.6449602142475181
Energy: 0.3762559071539069
Energy: 0.6449653827981483
Energy: 0.02618254036774798
Energy: 0.6449602142475181
Energy: 0.3762559071557822
Energy: 0.6945760959122778
Energy: 0.027081662260144464
Energy: 0.31323199458583306
Energy: 0.027043233836794252
Energy: 0.6945760959141531
Energy: 0.027081662260144464
Energy: 0.31323199458770845
Energy: 0.02618254036774798
Energy: 0.6449602142475181
Energy: 0.3762559071557822
Energy: 0.6449653827981483
Energy: 0.02618254036774798
Energy: 0.6449602142475181
Energy: 0.3762559071557822
Energy: 0.6945760959122778
Energy: 0.027081662262019846
Energy: 0.31323199458583306
Energy: 0.027043233834918863
Energy: 0.6945760959141531
Energy: 0.027081662262019846
Energy: 0.31323199458583306
Energy: 0.02618254036774798
Energy: 0.6449602142475181
Energy: 0.3762559071557822
Energy: 0.6449653827981483
Energy: 0.02618254036587259
Energy: 0.6449602142475181
Energy: 0.3762559071557822
Energy: 0.6945760959122778
Energy: 0.027081662262019846
Energy: 0.31323199458583306
Energy: 0.027043233836794252
Energy: 0.6945760959141531
Energy: 0.027081662262019846
Energy: 0.31323199458583306

minimum gb energy = 0.02618254036587259 eV
minimum distance =  2.9258693783211 Angstroms
sigma value = 5


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

Energy: 1.296783062024818
Energy: 1.2831651354790874
Energy: 1.1953511657506914
Energy: 1.2827370085992518
Energy: 1.2967830620202356
Energy: 1.2831651354814202
Energy: 1.2105042625216251
Energy: 1.1590090484356788
Energy: 1.1537556570183012
Energy: 1.2016700776537754
Energy: 1.2587819360764918
Energy: 1.1590090484310966
Energy: 1.1537556570068872
Energy: 1.2016700776561082
Energy: 1.1726225393270802
Energy: 1.2106206633001755
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Energy: 1.2106206633024248
Energy: 1.1719066803901343
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Energy: 1.2075758669231158
Energy: 1.220219327038636
Energy: 1.2570860515068312
Energy: 1.3135821203070177
Energy: 1.2075758669185337
Energy: 1.2202193270408854
Energy: 1.3211340651778196
Energy: 1.1781868048776083
Energy: 1.1565092705920528
Energy: 1.1296107076005613
Energy: 1.321134065170988
Energy: 1.1781868048753588
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Energy: 1.2257909081133656
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Energy: 1.2257909081064504
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Energy: 1.235817437223682
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Energy: 1.1280021714626394
Energy: 1.1771141705459336
Energy: 1.2358174372328468
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Energy: 1.2148992225287245
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Energy: 0.732084374751896
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Energy: 1.3014264035142675
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Energy: 1.2351075616628413
Energy: 1.1998975387103223
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Energy: 1.2079684843422867
Energy: 1.227551274248779
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Energy: 1.1761262437104496
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Energy: 1.2700636208829574
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Energy: 1.1963310031818815
Energy: 1.2586092021882382
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Energy: 1.2477454575845672
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Energy: 1.2617223258997614
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Energy: 1.1759126701480125
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Energy: 1.2485473265159086
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Energy: 1.2267263552054755
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Energy: 1.223162626072906
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Energy: 1.1859230687580056
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Energy: 1.2635601427887317
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Energy: 1.2879120526737586
Energy: 1.2635601427955634
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Energy: 1.2666879057064002
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Energy: 1.1604757000894121
Energy: 1.2666879057018177
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Energy: 1.2194019888796446
Energy: 1.2597153626595292
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Energy: 1.1843131074021593
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Energy: 1.2152658484034544
Energy: 1.2176114572079062
Energy: 1.24152781001711
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Energy: 1.2503856579500006
Energy: 1.0832058462753618
Energy: 0.8365448071205491
Energy: 1.2511436460063636
Energy: 1.2503856579545827
Energy: 1.0832058461448912
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Energy: 1.2117094819914345
Energy: 1.1637904146475977
Energy: 1.2419743987705154
Energy: 1.2292091517817054
Energy: 1.2117094820028487
Energy: 1.16379041465218
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Energy: 1.1978887409445431
Energy: 1.1508153640139305
Energy: 1.2035019286104534
Energy: 1.227061534100175
Energy: 1.1978887409353787
Energy: 1.1508153640093481
Energy: 1.235046817783276
Energy: 1.2279544282108628
Energy: 1.2579686426703023
Energy: 1.2095426488075882
Energy: 1.23504681779469
Energy: 1.2279544282131123
Energy: 1.25796864266572
Energy: 1.3166859023935287
Energy: 0.7569401570574165
Energy: 1.1697575406751128
Energy: 1.3409542970942707
Energy: 1.3166859023958615
Energy: 0.756940157066581
Energy: 1.1697575406773626
Energy: 1.181442512849387
Energy: 1.222960873958557
Energy: 1.172463258434189
Energy: 1.1588830333963147
Energy: 1.1814425128539694
Energy: 1.2229608739539746
Energy: 1.172463258441104
Energy: 1.2584329184870622
Energy: 1.221855419425192
Energy: 1.2018498884245066
Energy: 1.2193519805416628
Energy: 1.2584329184939773
Energy: 1.221855419425192
Energy: 1.201849888413009
Energy: 1.2898896008849503
Energy: 1.1517733717553866
Energy: 1.1327290088947168
Energy: 1.176504194642049
Energy: 1.2898896008757854
Energy: 1.1517733717622185
Energy: 1.1327290089062143
Energy: 1.2336968190346904
Energy: 1.1959864357753351
Energy: 1.2354247921911603
Energy: 1.1796539226602236
Energy: 1.2336968190277753
Energy: 1.1959864357798342
Energy: 1.235424792159084

minimum gb energy = 0.732084374751896 eV
minimum distance =  2.58028224260842 Angstroms
sigma value = 401


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

Energy: 1.1840653566647337
Energy: 1.3187211569562387
Energy: 1.2029872305780653
Energy: 1.339462865267298
Energy: 1.1840653566647337
Energy: 1.3187211569536854
Energy: 1.2029872305807132
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Energy: 1.3538156911865151
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Energy: 1.216925308209265
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Energy: 1.1832549042424936
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Energy: 1.3116015731029123
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Energy: 1.137126322028004
Energy: 1.2983681013443529
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Energy: 1.3046837304910672
Energy: 1.3356546273522705
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Energy: 1.3356546273574719
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Energy: 1.3744566264619933
Energy: 1.2691094938655447
Energy: 1.2939287261514336
Energy: 1.1844234500391233
Energy: 1.264487900876957
Energy: 1.232128943934829
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Energy: 1.2644879008821583
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Energy: 1.2545873783280748
Energy: 1.2899683249676976
Energy: 1.2963151238641384
Energy: 1.2984894787155767
Energy: 1.2419186447037045
Energy: 1.2899683249703457
Energy: 1.2963151238667863
Energy: 1.2984894787130232
Energy: 1.2646468266841433
Energy: 1.324369536448168
Energy: 1.320564135690487
Energy: 1.2212237198061082
Energy: 1.2646468266841433
Energy: 1.324369536448168
Energy: 1.3205641356879336
Energy: 1.3026716505704425
Energy: 1.2659706761398406
Energy: 1.2885679594530755
Energy: 1.2214038912472325
Energy: 1.302671650572996
Energy: 1.265970676119035
Energy: 1.2885679594530755
Energy: 1.1906086780268554
Energy: 1.2085171619717356
Energy: 1.2979938347808282
Energy: 1.2247504199157848
Energy: 1.190608678029409
Energy: 1.208517161974289
Energy: 1.297993834783476
Energy: 1.3334229218613118
Energy: 1.183254904247695
Energy: 1.2236938130888086
Energy: 1.1973127829854875
Energy: 1.3334229218613118
Energy: 1.1832549042424936
Energy: 1.2236938130888086
Energy: 1.2133595139793674
Energy: 1.3476524602763436
Energy: 1.2104885346464138
Energy: 1.1512719902043174
Energy: 1.2133595139741657
Energy: 1.3476524602763436
Energy: 1.2104885346464138
Energy: 1.1719748744145695
Energy: 1.3187211569562387
Energy: 1.2029872305832667
Energy: 1.3394628652724994
Energy: 1.1719748744172174
Energy: 1.3187211569536854
Energy: 1.2029872305832667
Energy: 1.2253608362416133
Energy: 1.1325367013234362
Energy: 1.1157532611590357
Energy: 1.3103752309796755
Energy: 1.2253608362390598
Energy: 1.132536701326084
Energy: 1.1157532611563876

minimum gb energy = 1.115318479116748 eV
minimum distance =  2.63996749020146 Angstroms
sigma value = 311


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

Energy: 1.2513962238435348
Energy: 1.3597083227458493
Energy: 1.2185417659113513
Energy: 1.3595255325240072
Energy: 1.251396223842334
Energy: 1.3597083227449207
Energy: 1.204810617868806
Energy: 1.357419732494268
Energy: 1.3064609636394253
Energy: 1.1805337753801137
Energy: 1.268195667478074
Energy: 1.3574197324939952
Energy: 1.306460963642756
Energy: 1.1805337753825162
Energy: 1.1921731836072087
Energy: 1.1224388025543586
Energy: 1.1935677828271039
Energy: 1.2102708600128556
Energy: 1.19217318361114
Energy: 1.122438802556488
Energy: 1.1964935294537267
Energy: 1.1911501850640973
Energy: 1.1857396985610638
Energy: 1.3072880324950658
Energy: 1.2522495118793013
Energy: 1.191150185064698
Energy: 1.1857396985616646
Energy: 1.3072880324926632
Energy: 1.1980603359822803
Energy: 1.2549194316665817
Energy: 1.2330236304707776
Energy: 1.121353898205324
Energy: 1.1980603361365814
Energy: 1.2549194316683834
Energy: 1.1952468394798483
Energy: 1.2597286236599285
Energy: 1.2338676016833474
Energy: 1.2552424887901892
Energy: 1.2843796314308096
Energy: 1.2597286236626037
Energy: 1.2338676016842753
Energy: 1.2552424887911173
Energy: 1.2410979104574806
Energy: 1.3113029542810741
Energy: 1.2104705867266528
Energy: 1.2127373670635608
Energy: 1.2410979104589548
Energy: 1.3113029542798729
Energy: 1.2104705867299288
Energy: 1.150827383109494
Energy: 1.1688609792276254
Energy: 1.2777491758937671
Energy: 1.2541193201960008
Energy: 1.1508273831070917
Energy: 1.1688609792291542
Energy: 1.2777491758895632
Energy: 1.2648941740341275
Energy: 1.2529443122032344
Energy: 1.2705413764134936
Energy: 1.1670103225392785
Energy: 1.2648941740341275
Energy: 1.252944312202907
Energy: 1.2705413764143676
Energy: 1.195578905512155
Energy: 1.1663257339432476
Energy: 1.2915129456115484
Energy: 1.3110014756246335
Energy: 1.195578905512155
Energy: 1.1663257339414457
Energy: 1.2915129456220862
Energy: 1.4990305546076792
Energy: 1.337293802532705
Energy: 1.2818558890975955
Energy: 1.2037210844209185
Energy: 1.4990305546082796
Energy: 1.3372938025303025
Energy: 1.2818558890961214
Energy: 1.2302146460282852
Energy: 1.2803795861198866
Energy: 1.2463334430489457
Energy: 1.3053547560391778
Energy: 1.2302146460270842
Energy: 1.2803795861204872
Energy: 1.2463334430435402
Energy: 1.2681652982467082
Energy: 1.2492882206301368
Energy: 1.2991638560250058
Energy: 1.185119980429312
Energy: 1.2681652982409752
Energy: 1.2492882206283347
Energy: 1.2991638560220027
Energy: 1.3526912450582504
Energy: 1.1222457806955604
Energy: 1.2297152617434433
Energy: 1.144711623302561
Energy: 1.3526912450585782
Energy: 1.1222457806949597
Energy: 1.2297152617425695
Energy: 1.2578808706771598
Energy: 1.1851154656202418
Energy: 1.3000589700581857
Energy: 1.2492743917577018
Energy: 1.25788087067301
Energy: 1.1851154656205147
Energy: 1.3000589700591136
Energy: 1.2366891505461357
Energy: 1.3053976306577033
Energy: 1.24634290933272
Energy: 1.2806482609807905
Energy: 1.236689150545863
Energy: 1.3053976306567752
Energy: 1.2463429093317917
Energy: 1.4990240444916254
Energy: 1.236437134624445
Energy: 1.2817140057608818
Energy: 1.3485061442186337
Energy: 1.499024044493427
Energy: 1.2364371346265746
Energy: 1.2817140057620828
Energy: 1.2744768885957891
Energy: 1.310943285256418
Energy: 1.1836879459645893
Energy: 1.11830224785696
Energy: 1.2744768885945879
Energy: 1.3109432852555443
Energy: 1.1836879459639886
Energy: 1.2745989309970456
Energy: 1.1675820660040974
Energy: 1.3291687609538707
Energy: 1.2527188845247965
Energy: 1.2745989309967725
Energy: 1.167582066005899
Energy: 1.329168760955072
Energy: 1.1537026434779305
Energy: 1.2540458552537337
Energy: 1.2837373414206872
Energy: 1.168358292401024
Energy: 1.1537026434761288
Energy: 1.2540458552525324
Energy: 1.2837373414191582
Energy: 1.240765661195557
Energy: 1.2128261459659353
Energy: 1.3979223860347456
Energy: 1.3102941357575488
Energy: 1.2407656611976867
Energy: 1.2128261459674095
Energy: 1.397922386035947
Energy: 1.2691181525468944
Energy: 1.2841267448084444
Energy: 1.258019266332412
Energy: 1.2041151052922212
Energy: 1.269118152545693
Energy: 1.284126744809045
Energy: 1.25801926633061
Energy: 1.198172845229229
Energy: 1.1214702604057367
Energy: 1.2065603354708065
Energy: 1.311072183102278
Energy: 1.1981728452415685
Energy: 1.1214702604042626
Energy: 1.2065603354708065
Energy: 1.2336329584412733
Energy: 1.252126316570545
Energy: 1.3073038485353656
Energy: 1.1862204569836743
Energy: 1.2336329584440033
Energy: 1.2521263165723469
Energy: 1.307303848537768
Energy: 1.196920937316319
Energy: 1.215575768106273
Energy: 1.225846958173421
Energy: 1.1460813469414655
Energy: 1.1969209373115142
Energy: 1.2155757681035975
Energy: 1.225846958173421
Energy: 1.3801105905127544
Energy: 1.268169060731454
Energy: 1.1806488040424434
Energy: 1.3063343207391165
Energy: 1.3801105905118263
Energy: 1.2681690607296523
Energy: 1.1806488040451737
Energy: 1.2513962238420062
Energy: 1.3597083227443205
Energy: 1.2238604170218363
Energy: 1.3595255325219324
Energy: 1.2513962238429344
Energy: 1.359708322744648
Energy: 1.2238604170215088
Energy: 1.315210796181428
Energy: 1.3249801749835592
Energy: 1.1805337753789127
Energy: 1.2681956674753987
Energy: 1.3152107961808277
Energy: 1.3249801749826313
Energy: 1.1805337753816425
Energy: 1.230460723831897
Energy: 1.1224388025567609
Energy: 1.1964935294527983
Energy: 1.2158067026552632
Energy: 1.2304607238243623
Energy: 1.1224388025555596
Energy: 1.1964935294521977
Energy: 1.1911501850638242
Energy: 1.185739698560736
Energy: 1.3072880324950658
Energy: 1.2522495118793013
Energy: 1.1911501850608213
Energy: 1.1857396985613369
Energy: 1.3072880324926632
Energy: 1.1980603360069053
Energy: 1.2549194316542969
Energy: 1.195246839529098
Energy: 1.1213538982043956
Energy: 1.1980603359204731
Energy: 1.2549194316515666
Energy: 1.1952468395248939
Energy: 1.259728623672814
Energy: 1.2041639205389154
Energy: 1.2552424887907898
Energy: 1.2760589153319541
Energy: 1.2597286236734146
Energy: 1.204163920538315
Energy: 1.2552424887913902
Energy: 1.2410979104553512
Energy: 1.3092114197023157
Energy: 1.2104705867263252
Energy: 1.212737367074372
Energy: 1.2410979104550781
Energy: 1.3092114197029163
Energy: 1.2104705867251238
Energy: 1.1508273831080196
Energy: 1.1688609792399647
Energy: 1.2777491758847581
Energy: 1.2541193201990037
Energy: 1.1508273831086204
Energy: 1.1688609792396374
Energy: 1.2777491758862871
Energy: 1.337783224190062
Energy: 1.252944312204108
Energy: 1.3290717090186956
Energy: 1.167010322541681
Energy: 1.337783224190062
Energy: 1.2529443122032344
Energy: 1.3290717090171669
Energy: 1.195578905512155
Energy: 1.1663257339432476
Energy: 1.1841629962648021
Energy: 1.3110014756246335
Energy: 1.195578905512155
Energy: 1.1663257339420463
Energy: 1.1841629962672044

minimum gb energy = 1.11830224785696 eV
minimum distance =  2.65737633222679 Angstroms
sigma value = 39


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

Energy: 1.2018646810385807
Energy: 1.3903032602355958
Energy: 1.16657377075777
Energy: 1.3876788725235176
Energy: 1.2018646810385807
Energy: 1.390303260234887
Energy: 1.1751929049240215
Energy: 1.3818308900029193
Energy: 1.1446997146124263
Energy: 0.9743250962239615
Energy: 1.144868414409551
Energy: 1.381830890009621
Energy: 1.144699714610622
Energy: 0.9743250962257658
Energy: 1.2019048118528852
Energy: 1.335588340022165
Energy: 0.9750638875251092
Energy: 1.4107281429503569
Energy: 1.20190481185005
Energy: 1.3355883400204254
Energy: 0.9750638875240782
Energy: 1.4493289203031692
Energy: 1.1447618048526123
Energy: 0.9748941675378798
Energy: 1.0540432970924165
Energy: 1.4493289203056179
Energy: 1.1447618048497767
Energy: 0.974894167538202
Energy: 1.3671322646732096
Energy: 1.1632219363856915
Energy: 1.1700817203311678
Energy: 1.4105565940030633
Energy: 1.3671322646735964
Energy: 1.1632219363856915
Energy: 1.1700817203371607
Energy: 1.4495060687549728
Energy: 0.9715773372666561
Energy: 1.4517722840930838
Energy: 1.0506733202258056
Energy: 1.4495060687585168
Energy: 0.9715773372605987
Energy: 1.4517722840934701
Energy: 1.4666923740728226
Energy: 1.410921235220149
Energy: 1.4251301503897011
Energy: 1.4095025676730126
Energy: 1.4666923740682474
Energy: 1.4109212352197624
Energy: 1.2354657857780487
Energy: 1.4498274289047117
Energy: 1.1295340507606044
Energy: 1.5967290625489416
Energy: 1.1290358943419339
Energy: 1.4498274289058073
Energy: 1.1295340507634397
Energy: 1.5967290625471375
Energy: 1.4666470259506565
Energy: 1.4095794402433188
Energy: 1.1874566905790744
Energy: 1.4109538748075967
Energy: 1.4666470259460165
Energy: 1.4095794402444146
Energy: 1.1874566905819097
Energy: 1.4494976070101449
Energy: 1.0503828082693552
Energy: 1.36397712023461
Energy: 0.971388218236215
Energy: 1.449497607010467
Energy: 1.050382808265102
Energy: 1.3639771202313882
Energy: 1.3667777592293024
Energy: 1.4107881943996574
Energy: 1.0815146322550246
Energy: 1.1632273504453732
Energy: 1.3667777592285935
Energy: 1.4107881943989486
Energy: 1.0379603705977365
Energy: 1.449342555434008
Energy: 1.053820751204014
Energy: 0.9747415732092599
Energy: 1.1445905098357136
Energy: 1.4493425554410966
Energy: 1.0538207512050448
Energy: 0.9747415732035892
Energy: 1.2020354138507887
Energy: 1.4109393249270483
Energy: 1.1242031241437491
Energy: 1.3355708688916248
Energy: 1.2020354138514977
Energy: 1.4109393249305924
Energy: 1.049528965219311
Energy: 1.3815538448855746
Energy: 1.1448968104701722
Energy: 0.9743223405351619
Energy: 1.1452418063612138
Energy: 1.3815538448837703
Energy: 1.1448968104722987
Energy: 0.9743223405365794
Energy: 1.2018646810385807
Energy: 1.3903032602355958
Energy: 1.175192904921895
Energy: 1.3876788725238396
Energy: 1.2018646810392895
Energy: 1.3903032602345646
Energy: 1.1751929049236352
Energy: 1.3818308900032414
Energy: 1.1446997146127484
Energy: 0.97432509622931
Energy: 1.1448684143872547
Energy: 1.3818308900082035
Energy: 1.1446997146113307
Energy: 0.974325096224348
Energy: 1.2019048118511453
Energy: 1.3355883400232607
Energy: 0.9750638875269136
Energy: 1.4107281429503569
Energy: 1.2019048118472146
Energy: 1.3355883400207478
Energy: 0.9750638875276224
Energy: 1.4493289203034914
Energy: 1.1447618048487458
Energy: 0.9748941675392976
Energy: 1.0540432970924165
Energy: 1.4493289203049091
Energy: 1.1447618048504855
Energy: 0.9748941675367845
Energy: 1.367132264675336
Energy: 1.1632219363874958
Energy: 1.1700817203385785
Energy: 1.4105565940048677
Energy: 1.3671322646757227
Energy: 1.163221936386078
Energy: 1.170081720336452
Energy: 1.4495060687549728
Energy: 0.9715773372655605
Energy: 1.4517722840930838
Energy: 1.0506733202229703
Energy: 1.4495060687592258
Energy: 0.9715773372609854
Energy: 1.4517722840959189
Energy: 1.4666923740728226
Energy: 1.41092123522118
Energy: 1.2354657857702518
Energy: 1.4095025676723039
Energy: 1.466692374069987
Energy: 1.410921235218345
Energy: 1.2354657857748912
Energy: 1.4498274289047117
Energy: 1.1295340507617
Energy: 1.5967290625496506
Energy: 1.129035894340516
Energy: 1.4498274289058073
Energy: 1.1295340507606044
Energy: 1.5967290625468151
Energy: 1.4666470259502695
Energy: 1.4095794402440278
Energy: 1.187456690581523
Energy: 1.41095387480721
Energy: 1.4666470259464035
Energy: 1.4095794402465411
Energy: 1.187456690581201
Energy: 1.449497607010467
Energy: 1.0503828082669064
Energy: 1.363977120235641
Energy: 0.9713882182340885
Energy: 1.4494976070108538
Energy: 1.0503828082643931
Energy: 1.3639771202317745
Energy: 1.3667777592278847
Energy: 1.410788194397531
Energy: 1.0153767160860543
Energy: 1.1632273504449866
Energy: 1.366777759231751
Energy: 1.410788194397531
Energy: 1.0153767160888898
Energy: 1.4493425554336214
Energy: 1.0538207512036273
Energy: 0.9747415732092599
Energy: 1.1445905098367446
Energy: 1.4493425554400008
Energy: 1.0538207512050448
Energy: 0.974741573204298
Energy: 1.2020354138532376
Energy: 1.4109393249266617
Energy: 1.0495289652186022
Energy: 1.3355708688916248
Energy: 1.2020354138564597
Energy: 1.4109393249309146
Energy: 1.0495289652182156
Energy: 1.3815538448866058
Energy: 1.14489681047159
Energy: 0.9743223405323265
Energy: 1.1452418063633403
Energy: 1.3815538448823526
Energy: 1.1448968104733297
Energy: 0.9743223405283957
Energy: 1.2018646810385807
Energy: 1.3903032602352734
Energy: 1.1751929049186733
Energy: 1.3876788725245484
Energy: 1.2018646810382585
Energy: 1.390303260232438
Energy: 1.1751929049233127
Energy: 1.3818308900029193
Energy: 1.1446997146102997
Energy: 0.9743250962278922
Energy: 1.1448684143776535
Energy: 1.3818308900100076
Energy: 1.144699714613135
Energy: 0.9743250962225438

minimum gb energy = 0.9713882182340885 eV
minimum distance =  2.60563660587068 Angstroms
sigma value = 21


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

Energy: 1.1986961251382215
Energy: 1.4087901573625417
Energy: 1.122259967611781
Energy: 1.4059940624888243
Energy: 1.1986961251369308
Energy: 1.4087901573621113
Energy: 1.120060643546038
Energy: 1.2696014079372715
Energy: 1.1773832082572113
Energy: 1.421144466176836
Energy: 1.1772975896833597
Energy: 1.2696014079364113
Energy: 1.1773832082572113
Energy: 1.4211444661776966
Energy: 1.1987036465466847
Energy: 1.2378670943518495
Energy: 1.0445096082909218
Energy: 1.369311076637453
Energy: 1.1987036465466847
Energy: 1.2378670943540004
Energy: 1.044509608291352
Energy: 1.4260501169057669
Energy: 1.1763773704854519
Energy: 1.1571243328491212
Energy: 1.1269350148530826
Energy: 1.426050116906197
Energy: 1.1763773704867426
Energy: 1.1571243328517027
Energy: 1.1354806492655602
Energy: 1.2521795310964143
Energy: 1.1613989126031838
Energy: 1.1496272189453849
Energy: 1.13548064926427
Energy: 1.252179531097705
Energy: 1.1613989126027535
Energy: 1.4268938625943266
Energy: 1.1633340103809329
Energy: 1.2347574089898508
Energy: 1.1459865791490895
Energy: 1.426893862593896
Energy: 1.1633340103809329
Energy: 1.2347574089876994
Energy: 1.1787159727418726
Energy: 1.2474302464195974
Energy: 1.1701706999830517
Energy: 1.2993485371384683
Energy: 1.178715972741442
Energy: 1.2474302464200278
Energy: 1.1623458084759466
Energy: 1.2311911461170542
Energy: 1.2791961374355714
Energy: 1.292819887406251
Energy: 1.145318224310554
Energy: 1.2311911461174845
Energy: 1.279196137436432
Energy: 1.2928198874105536
Energy: 1.1703612285083855
Energy: 1.146921141169652
Energy: 1.3048859722350172
Energy: 1.2000604752900887
Energy: 1.170361228510967
Energy: 1.1469211411705125
Energy: 1.3048859722311452
Energy: 1.1953722796511115
Energy: 1.1636225643500708
Energy: 1.1562693894559561
Energy: 1.1449755154486512
Energy: 1.195372279653693
Energy: 1.1636225643492102
Energy: 1.1562693894555258
Energy: 1.2027044173949157
Energy: 1.0420748472512416
Energy: 1.266607400973781
Energy: 1.0432789591692173
Energy: 1.2027044173931951
Energy: 1.0420748472512416
Energy: 1.2666074009746415
Energy: 1.1116942331232131
Energy: 1.210209248795864
Energy: 1.0646175732458656
Energy: 1.1288584498359955
Energy: 1.111694233124934
Energy: 1.2102092487941434
Energy: 1.0646175732351095
Energy: 1.331593577262769
Energy: 1.0429400811379852
Energy: 1.2026795213018038
Energy: 1.0323040072618241
Energy: 1.3315935772631993
Energy: 1.0429400811362641
Energy: 1.2026795213018038
Energy: 1.1325423994431842
Energy: 1.2105720146250214
Energy: 1.2153892079962079
Energy: 1.181241984649985
Energy: 1.1325423994427541
Energy: 1.210572014608242
Energy: 1.215389207998359
Energy: 1.2742168219719932
Energy: 1.092194796471917
Energy: 1.2026652155629476
Energy: 1.0366494475335168
Energy: 1.2742168219681598
Energy: 1.092194796471917
Energy: 1.2026652155607962
Energy: 1.132363709011535
Energy: 1.2390791712800597
Energy: 1.1541842216418823
Energy: 1.2401678967188148
Energy: 1.1323637090102443
Energy: 1.239079171282211
Energy: 1.154184221644034
Energy: 1.2744509419509527
Energy: 1.2480480396447893
Energy: 1.2680838096646998
Energy: 1.1232904774755228
Energy: 1.2744509419483714
Energy: 1.2480480396447893
Energy: 1.2680838096646998
Energy: 1.1319171670571326
Energy: 1.267393736297581
Energy: 1.1005827854565198
Energy: 1.1475047805799168
Energy: 1.1319171670562722
Energy: 1.267393736297581
Energy: 1.1005827854560897
Energy: 1.3196183289832133
Energy: 1.3153580343322508
Energy: 1.1921436037126703
Energy: 1.1234700352674287
Energy: 1.3196183289836436
Energy: 1.3153580343305298
Energy: 1.1921436037174027
Energy: 1.140772414641801
Energy: 1.1128499166310701
Energy: 1.3378982752568134
Energy: 1.1124996143196437
Energy: 1.140772414641801
Energy: 1.1128499166358026
Energy: 1.3378982752572435
Energy: 1.3198224470586202
Energy: 1.124266600936843
Energy: 1.191492271200766
Energy: 1.3154524151876645
Energy: 1.3198224470577598
Energy: 1.1242666009364126
Energy: 1.191492271200766
Energy: 1.1322387388072652
Energy: 1.1476639419738341
Energy: 1.1005737769782835
Energy: 1.267284463445401
Energy: 1.132238738806835
Energy: 1.147663941971683
Energy: 1.1005737769787138
Energy: 1.2741450064420614
Energy: 1.0415355718849097
Energy: 1.2679672755478084
Energy: 1.2480479131475306
Energy: 1.2741450064442128
Energy: 1.0415355718689907
Energy: 1.267967275546948
Energy: 1.1325044380292348
Energy: 1.282682384795204
Energy: 1.1541756003908041
Energy: 1.2391589637353433
Energy: 1.1325044380288047
Energy: 1.2826823847973552
Energy: 1.1541756003882226
Energy: 1.2743668234808974
Energy: 1.0341855007910221
Energy: 1.202820936364234
Energy: 1.2276788312494817
Energy: 1.2743668234774554
Energy: 1.034185500790592
Energy: 1.2028209363633737

minimum gb energy = 1.0323040072618241 eV
minimum distance =  2.61362354551651 Angstroms
sigma value = 113


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

Energy: 1.1334739516361798
Energy: -1.4215369516487297
Energy: 0.92118363142818
Energy: -1.3728595065405487
Energy: 1.1334739516386245
Energy: -1.3513908823378562
Energy: 0.9803435710078547
Energy: 1.2704610730758616
Energy: 1.2613808263510538
Energy: 1.4258289611638049
Energy: 1.1714000429910867
Energy: 1.270461073080664
Energy: 1.2613808263606587
Energy: 1.4258289611638049
Energy: 1.1323067302191587
Energy: -1.3239436557196267
Energy: 1.1174643619382971
Energy: 1.1150569178539314
Energy: 1.132306730223961
Energy: -1.30373222181775
Energy: 1.1174643619382971
Energy: 1.066758685280995
Energy: 1.2626428339555549
Energy: 1.1150783226000238
Energy: 1.1772393462112658
Energy: 1.066758685280995
Energy: 1.2626428339603573
Energy: 1.1150783177446497
Energy: 1.1310620284888029
Energy: 1.1562399724491568
Energy: 1.1735574695230515
Energy: 1.1124765190869015
Energy: 1.1310620285007649
Energy: 1.1562399724491568
Energy: 1.1735574695206066
Energy: 1.0651524577321547
Energy: 1.1968802559111342
Energy: 1.3699436197876027
Energy: 1.1118729589946474
Energy: 1.0651524577321547
Energy: 1.1968802559087768
Energy: 1.3699436197059622
Energy: 1.1100921331845612
Energy: 0.8236847051892879
Energy: 1.1484031554773133
Energy: 1.0476208607392659
Energy: 1.1100921331821163
Energy: 0.8236847556998651
Energy: 1.1484031554821157
Energy: 1.0641587672270696
Energy: 1.1006125855737448
Energy: 1.4011066362728664
Energy: 1.0966904325006241
Energy: 1.0641587672343167
Energy: 1.1006125855833495
Energy: 1.4011066362728664
Energy: 1.1120180211698947
Energy: 1.160418500736478
Energy: 1.1086835143885432
Energy: 1.088924763665114
Energy: 1.1120180205866246
Energy: 1.1604185007293182
Energy: 1.1086835143860982
Energy: 1.062509242896728
Energy: 1.1004256379394421
Energy: 1.0961559616180176
Energy: 1.1222128457441933
Energy: 1.062509242896728
Energy: 1.1004256379370847
Energy: 1.0961559616851637
Energy: 1.1126197948823757
Energy: 1.1331724080157834
Energy: 1.034798767673439
Energy: 1.0609688621831153
Energy: 1.1126197948848204
Energy: 1.1331724080157834
Energy: 1.034798767670994
Energy: 1.0621836817036592
Energy: 1.0452204803119498
Energy: 1.338178666346622
Energy: 1.057849833543239
Energy: 1.062183681706104
Energy: 1.0452204803215543
Energy: 1.3381786663514241
Energy: 1.1044393626225457
Energy: 1.1980883193142533
Energy: 1.034019074229155
Energy: 1.153193690650469
Energy: 1.1044393626345081
Energy: 1.1980883193142533
Energy: 1.034019074229155
Energy: 1.0511130589758642
Energy: 1.0537804296019444
Energy: 1.4859974893886447
Energy: 1.068155940897959
Energy: 1.0511130589758642
Energy: 1.0537804295947846
Energy: 1.4859974893838424
Energy: 1.1172582248271625
Energy: 1.1747917099433944
Energy: 1.068728704219298
Energy: 1.0547616417671095
Energy: 1.1172582248319651
Energy: 1.1747917099481966
Energy: 1.068728704327308
Energy: 1.0574353395167846
Energy: 1.1059851756168462
Energy: 1.308488389170963
Energy: 1.0489695161434645
Energy: 1.0574353395119822
Energy: 1.1059851756264507
Energy: 1.308488389173408
Energy: 1.0769908985033376
Energy: 1.1984710429632475
Energy: 1.0584340353774153
Energy: 1.1239846445157708
Energy: 1.0769908984961776
Energy: 1.1984710429680496
Energy: 1.0584340370503
Energy: 1.0622166921849843
Energy: 1.0307071355622954
Energy: 0.9644894493596902
Energy: 1.0902465317527772
Energy: 1.0622166921802692
Energy: 1.030707135567098
Energy: 0.9644894493644927
Energy: 1.0766292420379446
Energy: 1.1277444614899514
Energy: 1.2808162267989387
Energy: 1.1897865860756618
Energy: 1.0766292420331425
Energy: 1.1277444614923087
Energy: 1.3318805645620029
Energy: 1.1108784081507472
Energy: 1.0716555718101677
Energy: 0.9063153861079022
Energy: 1.062121820148881
Energy: 1.1108784081579943
Energy: 1.0716555718245746
Energy: 0.9063153860982974
Energy: 1.13222368069358
Energy: 1.0591108297477383
Energy: 1.3008500637594902
Energy: 1.0944664547594634
Energy: 1.13222368069358
Energy: 1.059110829742936
Energy: 1.3008500637642926
Energy: 1.1111712175762984
Energy: 1.0740245419201497
Energy: 1.1555026387829948
Energy: 1.0666986273039873
Energy: 1.111171217571496
Energy: 1.0740245419201497
Energy: 1.1555026387805496
Energy: 1.053654038650168
Energy: 1.1039799618233717
Energy: 1.223962627009142
Energy: 1.254777771649066
Energy: 1.0536540386430082
Energy: 1.1039799618185693
Energy: 1.2239626270115866
Energy: 1.081606805063462
Energy: 1.153970013965414
Energy: 0.9446917611793229
Energy: 1.1448098303534182
Energy: 1.0816068050562149
Energy: 1.1539700139606115
Energy: 0.9446917611265842
Energy: 1.0532091041820049
Energy: 1.1720468172371268
Energy: 1.3846656439915852
Energy: 1.3572157810183767
Energy: 1.0532091041892522
Energy: 1.172046817234682
Energy: 1.384665643984338
Energy: 1.1473082373505221
Energy: 1.0254901670347782
Energy: 1.1126607261410144
Energy: 1.0107491215207676
Energy: 1.1473082373480774
Energy: 1.0254901670467405
Energy: 1.1126607261337673
Energy: 1.1063133692765428
Energy: 1.156734081500576
Energy: 1.0905647358825565
Energy: 1.191567758208729
Energy: 1.1063133692933076
Energy: 1.1567340815077356
Energy: 1.0905647358681494
Energy: 1.1800577437804403
Energy: 1.2084073180636463
Energy: 1.081154409779527
Energy: 1.1013557477143894
Energy: 1.1800577437827977
Energy: 1.2084073180684491
Energy: 1.0811544097747245
Energy: 1.1920731288491848
Energy: 1.148293715546551
Energy: 1.157410023043258
Energy: 1.356946803122514
Energy: 1.1920731288443824
Energy: 1.1482937154985273
Energy: 1.1574100230384556
Energy: 1.140668139332
Energy: 1.184038034125793
Energy: 1.058907514319275
Energy: 1.0116506475957086
Energy: 1.1406681393271974
Energy: 1.1840380341305954
Energy: 1.0589075143216324
Energy: 1.2341435769985185
Energy: 1.2054009069702574
Energy: 1.313009068455393
Energy: 1.3387154373608796
Energy: 1.2341435769889137
Energy: 1.2054009069606526
Energy: 1.3130090684433435
Energy: 1.1807230109653324
Energy: 1.1558675472953988
Energy: 1.0048571864936342
Energy: 1.0555316363684375
Energy: 1.1807230109677773
Energy: 1.1558675473050033
Energy: 1.004857186503239
Energy: 1.0922192728923248
Energy: 1.031170132008603
Energy: 1.373295265837416
Energy: 1.1286336983016583
Energy: 1.09221927288988
Energy: 1.0311701320061581
Energy: 1.3732952658350583
Energy: 1.2398903268298398
Energy: 1.0470025553211595
Energy: 1.1391886913697074
Energy: 1.134537581500139
Energy: 1.2398903268273949
Energy: 1.0470025553067523
Energy: 1.1391886913697074
Energy: 1.0391430094649845
Energy: 1.0761857592000317
Energy: 1.1821806583046943
Energy: 1.1425629245648583
Energy: 1.0391430094673422
Energy: 1.076185759190427
Energy: 1.1821806583046943
Energy: 1.2397807706912467
Energy: 1.1553252766411422
Energy: 1.2810591158113442
Energy: 1.0717524012814317
Energy: 1.2397807706840867
Energy: 1.1553252766387847
Energy: 1.2810591158113442
Energy: 1.0324623285174104
Energy: 1.165575040239206
Energy: 1.1263601881782472
Energy: 1.1621496052469789
Energy: 1.0324623285126082
Energy: 1.1655750402344038
Energy: 1.1263601881302236
Energy: 1.0985473080512418
Energy: 1.1474100585376308
Energy: 1.0996411954113696
Energy: 1.152666549005415
Energy: 1.0985473080488843
Energy: 1.1474100585303835
Energy: 1.0996411954065675
Energy: 1.1644617152299106
Energy: 1.2151146758851359
Energy: 1.123926673990761
Energy: 1.2197178887305071
Energy: 1.1644617152226635
Energy: 1.2151146758803335
Energy: 1.1239266740387848
Energy: 1.097935052529599
Energy: 1.118253123390836
Energy: 1.0813505445823268
Energy: 1.1844580927549984
Energy: 1.097935052529599
Energy: 1.118253123395638
Energy: 1.0813505445847718
Energy: 1.1427360230493542
Energy: 1.2316407920264416
Energy: 1.2253092106866708
Energy: 1.2202472544233858
Energy: 1.1427360230445518
Energy: 1.231640792021639
Energy: 1.22530921069872
Energy: 1.0978538269443778
Energy: 1.1776256847694508
Energy: 1.4609792758543538
Energy: 1.2018810226259622
Energy: 1.0978538269420204
Energy: 1.1776256847646485
Energy: 1.4609792758591562
Energy: 1.0165995090716757
Energy: 1.231769977817892
Energy: 1.0536098126056657
Energy: 1.2185627877378458
Energy: 1.0165995090668731
Energy: 1.2317699778274969
Energy: 1.053609812267229
Energy: 1.1923123007632204
Energy: 1.1771802451467934
Energy: 1.4083639388796096
Energy: 1.1240956074154285
Energy: 1.1923123007632204
Energy: 1.1771802451515956
Energy: 1.4083639388700049
Energy: 1.0581449027206886
Energy: 1.19731231859123
Energy: 1.1092630198803417
Energy: 1.2112249576039429
Energy: 1.0581449027135286
Energy: 1.19731231859123
Energy: 1.1092630192562953

minimum gb energy = -1.4215369516487297 eV
minimum distance =  2.52601504201883 Angstroms
sigma value = 365


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

Energy: 1.0873613518785699
Energy: 0.713386656916046
Energy: 0.2537770383025306
Energy: 0.7133866569155045
Energy: 1.087361351875863
Energy: 0.7133866569138804
Energy: 0.5749824367889157
Energy: 1.087361351875863
Energy: 0.713386656916046
Energy: 0.9480975358929428
Energy: 0.7133866569155045
Energy: 1.0873613518769456
Energy: 0.7133866569149631
Energy: 0.5749822252286199
Energy: 1.087361351875863
Energy: 0.7133866569149631
Energy: 1.38623850794111
Energy: 0.7133866569144218
Energy: 1.0873613518764043
Energy: 0.7133866569165873
Energy: 0.5749820297812447
Energy: 1.0873613518780283
Energy: 0.7133866569149631
Energy: 1.364421927815153
Energy: 0.7133866569149631
Energy: 1.0873613518769456
Energy: 0.7133866569133389
Energy: 0.5749820804219442
Energy: 1.0873613518753216
Energy: 0.7133866569155045
Energy: 0.9480940109227141
Energy: 0.713386656916046
Energy: 1.0873613518764043
Energy: 0.7133866569155045
Energy: 0.5749827173663314
Energy: 1.087361351875863
Energy: 0.7133866569144218
Energy: 1.5093087072746314
Energy: 0.7133866569149631
Energy: 1.087361351875863
Energy: 0.7133866569155045
Energy: 0.5749812079291675
Energy: 1.087361351879111
Energy: 0.713386656916046
Energy: 0.5749815593425346
Energy: 0.7133866569149631
Energy: 1.0873613518764043
Energy: 0.7133866569127976
Energy: 0.574983009656696
Energy: 1.0873613518764043
Energy: 0.713386656916046
Energy: 0.9480948791497312
Energy: 0.7133866569149631
Energy: 1.0873613518764043
Energy: 0.7133866569149631
Energy: 0.5749822621222676
Energy: 1.087361351875863
Energy: 0.7133866569149631
Energy: 0.5749821613549311
Energy: 0.7133866569149631
Energy: 1.0873613518764043
Energy: 0.7133866569155045
Energy: 0.5749807964895832
Energy: 1.087361351879111
Energy: 0.713386656916046
Energy: 0.5749822986095378
Energy: 0.7133866569149631
Energy: 1.0873613518764043
Energy: 0.7133866569138804
Energy: 0.5749829754140755
Energy: 1.087361351875863
Energy: 0.7133866569171287
Energy: 0.9480997684257202
Energy: 0.7133866569149631
Energy: 1.0873613518769456
Energy: 0.7133866569155045
Energy: 0.5749812327159406
Energy: 1.087361351875863
Energy: 0.7133866569138804
Energy: 0.5749817413946058
Energy: 0.7133866569149631
Energy: 1.087361351875863
Energy: 0.7133866569155045
Energy: 0.5749804930782908
Energy: 1.087361351879111
Energy: 0.7133866569155045
Energy: 0.5749815576320279
Energy: 0.713386656916046
Energy: 1.0873613518769456
Energy: 0.7133866569133389
Energy: 1.0008052261878468
Energy: 1.0873613518764043
Energy: 0.713386656916046
Energy: 0.5749819717377981
Energy: 0.7133866569144218
Energy: 1.0873613518764043
Energy: 0.7133866569149631
Energy: 0.5749831093715454
Energy: 1.087361351875863
Energy: 0.7133866569149631
Energy: 0.574982099756209
Energy: 0.7133866569144218
Energy: 1.087361351875863
Energy: 0.713386656916046
Energy: 0.5749816482746697
Energy: 1.0873613518785699
Energy: 0.7133866569155045
Energy: 0.5749816700781573
Energy: 0.7133866569149631
Energy: 1.0873613518769456
Energy: 0.7133866569122563
Energy: 0.574982857889382
Energy: 1.0873613518769456
Energy: 0.713386656916046
Energy: 0.5749821577271602
Energy: 0.7133866569155045
Energy: 1.0873613518764043
Energy: 0.713386656916046
Energy: 0.5749828478356077
Energy: 1.0873613518764043
Energy: 0.7133866569138804
Energy: 0.5749818593506295
Energy: 0.7133866569144218
Energy: 1.087361351875863
Energy: 0.7133866569155045
Energy: 0.5749822705504821
Energy: 1.087361351879111
Energy: 0.7133866569155045
Energy: 0.5749829498588909
Energy: 0.7133866569165873
Energy: 1.0873613518769456
Energy: 0.7133866569138804
Energy: 0.5749826748838466
Energy: 1.0873613518769456
Energy: 0.7133866569171287
Energy: 0.5749806763961025
Energy: 0.7133866569149631
Energy: 1.0873613518753216
Energy: 0.7133866569144218
Energy: 0.5749817303965707

minimum gb energy = 0.2537770383025306 eV
minimum distance =  2.78098812996169 Angstroms
sigma value = 23