Model name: model_name=MEAM_LAMMPS_ChoiKimSeol_2017_CoFe__MO_179158257180_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.863657310605049
cohesive_energy=4.29033744093271
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: 0.016182212260107184
Energy: 0.1682267922272015
Energy: 0.016182212260107184
Energy: 0.16822679222760956
Energy: 0.016182212260107184
Energy: 0.16822679222760956
Energy: 0.016182212260107184
Energy: 0.016754814564715732
Energy: 0.6301152417199092
Energy: 0.016754814564715732
Energy: 0.6301152417199092
Energy: 0.01675481456430768
Energy: 0.6301152417199092
Energy: 0.016754814563899628
Energy: 0.016500251695249164
Energy: 0.561480925261998
Energy: 0.016500251695249164
Energy: 0.5614809252615899
Energy: 0.016500251695657216
Energy: 0.5614809252615899
Energy: 0.016500251695249164
Energy: 0.016754814564715732
Energy: 0.6301152417195011
Energy: 0.016754814564715732
Energy: 0.6301152417195011
Energy: 0.016754814564715732
Energy: 0.6301152417195011
Energy: 0.016754814564715732
Energy: 0.016182212260107184
Energy: 0.1682267922272015
Energy: 0.016182212260107184
Energy: 0.16822679222760956
Energy: 0.016182212260107184
Energy: 0.16822679222760956
Energy: 0.016182212260107184
Energy: 0.016754814564715732
Energy: 0.6301152417195011
Energy: 0.016754814564715732
Energy: 0.6301152417195011
Energy: 0.01675481456430768
Energy: 0.6301152417195011
Energy: 0.01675481456430768

minimum gb energy = 0.016182212260107184 eV
minimum distance =  2.47643576009471 Angstroms
sigma value = 5


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

Energy: 1.2895991058171137
Energy: 1.2646173903318167
Energy: 1.289599105815164
Energy: 1.2646173903332794
Energy: 1.2895991058156513
Energy: 1.2646173903342541
Energy: 1.289599105816139
Energy: 1.2406241475020372
Energy: 1.1760810646885538
Energy: 1.2406241475020372
Energy: 1.1761193455125367
Energy: 1.2406241475015498
Energy: 1.1761058449132047
Energy: 1.2406241475015498
Energy: 1.13126531557052
Energy: 1.1742849545065919
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Energy: 1.1312653155710075
Energy: 1.1742849545085414
Energy: 1.13126531557052
Energy: 1.1373669277226406
Energy: 1.2098274412533407
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Energy: 1.2098274412543155
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Energy: 1.2098274412528534
Energy: 1.1373669277221534
Energy: 1.1352649836960207
Energy: 1.2089205455991792
Energy: 1.1352649836945583
Energy: 1.2089205455991792
Energy: 1.1352649836960207
Energy: 1.2089205455986916
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Energy: 1.2440950303571456
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Energy: 1.1503027051267907
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Energy: 1.2265638429623806
Energy: 1.24631007793434
Energy: 1.226563842960431
Energy: 1.1729010214942819
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Energy: 1.156805354899348
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Energy: 1.2267670932931931
Energy: 1.1853080191391867
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Energy: 1.2267670932922183
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Energy: 1.189283318302507
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Energy: 1.2274421016419834
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Energy: 1.1769387047780724
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Energy: 1.2533396809946773
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Energy: 1.2349739977306304
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Energy: 1.2349739977316054
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Energy: 1.234973997731118
Energy: 1.1346989363376914
Energy: 1.1709797557257013
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Energy: 1.1709797557257013
Energy: 1.1346989363372038
Energy: 1.170979755725214
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Energy: 1.1873584552860632
Energy: 1.1583071012071176
Energy: 1.187358455365471
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Energy: 1.1873584552958119
Energy: 1.158307101322596
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Energy: 1.1209146927378135
Energy: 1.169299005742203
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Energy: 1.1692990057426906
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Energy: 1.1875800480110486
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Energy: 1.2148788548025007
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Energy: 1.2487603228162236
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Energy: 1.2487603228167112
Energy: 1.2236587841835411
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Energy: 1.2459226098682006
Energy: 1.1888128238050164
Energy: 1.2459226098672256
Energy: 1.1888129073887825
Energy: 1.1800396030097933
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Energy: 1.2437803966863532
Energy: 1.180039603008331
Energy: 1.1748511137740425
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Energy: 1.1748511137740425
Energy: 1.2117650343507127
Energy: 1.1748511137735551
Energy: 1.2117650343526625
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Energy: 1.136761757625251
Energy: 1.1220564452840065
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Energy: 1.1220564452888808
Energy: 1.136761757625251
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Energy: 1.2380815425129124
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Energy: 1.1606578520311925
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Energy: 1.1606578520502027
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Energy: 1.1481104432665032
Energy: 1.1889529513132937
Energy: 1.1481104432665032
Energy: 1.188952951313781
Energy: 1.1481104432660159
Energy: 1.1889529513132937
Energy: 1.1731992194102583
Energy: 1.2063485745165425
Energy: 1.1731992194126954
Energy: 1.20634857451703
Energy: 1.1731992194117207
Energy: 1.2063485745155678
Energy: 1.1731992194141578
Energy: 1.1586781353200988
Energy: 1.204243629186272
Energy: 1.158678135318149
Energy: 1.2042436291867595
Energy: 1.1586781353196114
Energy: 1.2042436291857845
Energy: 1.158678135318149
Energy: 1.1348123061675983
Energy: 1.1830614684919354
Energy: 1.1348123061680857
Energy: 1.1830614684909606
Energy: 1.1348123061680857
Energy: 1.1830614684929104
Energy: 1.1348123061690607
Energy: 1.130609949771759
Energy: 1.1780681555804824
Energy: 1.130609949771759
Energy: 1.1780681555809698
Energy: 1.130609949772734
Energy: 1.1780681555804824
Energy: 1.1306099497698092
Energy: 1.1566756520277917
Energy: 1.195539047098461
Energy: 1.1566756520253545
Energy: 1.1955390470974863
Energy: 1.156675652028279
Energy: 1.1955390470979737
Energy: 1.1566756520258419

minimum gb energy = 1.1209146927378135 eV
minimum distance =  2.31296238369512 Angstroms
sigma value = 401


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

Energy: 1.3189081917818124
Energy: 1.2746574656149796
Energy: 1.2889123392026602
Energy: 1.2746574656149796
Energy: 1.3189081917801524
Energy: 1.274657465613873
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Energy: 1.301863847604886
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Energy: 1.318908191781259
Energy: 1.274657465615533
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Energy: 1.318908191779599
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Energy: 1.3398951871656744
Energy: 1.1687498179953344
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Energy: 1.16919367810281
Energy: 1.2966442481448273
Energy: 1.16919367810281
Energy: 1.2960490918336853
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Energy: 1.2159932526029966
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Energy: 1.2159932526041033
Energy: 1.2157654304589367
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Energy: 1.2157654304605967
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Energy: 1.2157654304589367
Energy: 1.273141931301023
Energy: 1.2157654304578303
Energy: 1.2515096802469758
Energy: 1.2957018337295971
Energy: 1.2513427809480138
Energy: 1.295858620757759
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Energy: 1.2513427809502267
Energy: 1.2509878860456074
Energy: 1.2956047646792865
Energy: 1.250947643778513
Energy: 1.2955138469804932
Energy: 1.250987886046714
Energy: 1.2956047646776268
Energy: 1.250947643778513
Energy: 1.203104513024248
Energy: 1.2729160015516536
Energy: 1.2023996379195168
Energy: 1.2729160015505472
Energy: 1.2031045130248013
Energy: 1.2729160015505472
Energy: 1.2023996379173036
Energy: 1.2025758193129197
Energy: 1.318830377486761
Energy: 1.2024382192469985
Energy: 1.3188303774862076
Energy: 1.2025758193129197
Energy: 1.3188303774851011
Energy: 1.2024382192475518
Energy: 1.1771056399384534
Energy: 1.1953584561585777
Energy: 1.1771056399401134
Energy: 1.195358456160791
Energy: 1.17710563993956
Energy: 1.1953584561602377
Energy: 1.1771056399401134
Energy: 1.2135425316877704
Energy: 1.2159969384440124
Energy: 1.1766948716770065
Energy: 1.2159969384451188
Energy: 1.213542531688877
Energy: 1.215996938442906
Energy: 1.1766948716770065
Energy: 1.3189081917818124
Energy: 1.274657465616086
Energy: 1.2889123392010002
Energy: 1.2746574656149796
Energy: 1.318908191779599
Energy: 1.2746574656133196
Energy: 1.2889123392004471
Energy: 1.177623267153035
Energy: 1.2491775265977594
Energy: 1.132881300515358
Energy: 1.2499026330538143
Energy: 1.1776232671519282
Energy: 1.2491775265983125
Energy: 1.1328813005164646

minimum gb energy = 1.1328813005148046 eV
minimum distance =  2.32206553301588 Angstroms
sigma value = 311


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

Energy: 1.1911730022221068
Energy: 1.2270508686466044
Energy: 1.1911730022214677
Energy: 1.2270508686466044
Energy: 1.1911730022214677
Energy: 1.2270508686466044
Energy: 1.1911730022221068
Energy: 1.1517108771895364
Energy: 1.149214992788949
Energy: 1.1517108771895364
Energy: 1.1492149927883102
Energy: 1.1517108771895364
Energy: 1.1492149927883102
Energy: 1.1517108771901752
Energy: 1.1627242434529999
Energy: 1.1806248969453295
Energy: 1.1625061107949182
Energy: 1.1806221523060485
Energy: 1.1627242434529999
Energy: 1.180624896945968
Energy: 1.1625061107955572
Energy: 1.3250706730327926
Energy: 1.2276479455507099
Energy: 1.3286043719396594
Energy: 1.2276479455532654
Energy: 1.3250706730327926
Energy: 1.2276479455609322
Energy: 1.3286043719390206
Energy: 1.2657134142987054
Energy: 1.2641628309490103
Energy: 1.2656156419981661
Energy: 1.2641628309477326
Energy: 1.2657134142987054
Energy: 1.2641628309477326
Energy: 1.2656156419988047
Energy: 1.1541510589331891
Energy: 1.282086564258229
Energy: 1.1541510589331891
Energy: 1.282086564258229
Energy: 1.1541510589331891
Energy: 1.282086564258868
Energy: 1.154151058933828
Energy: 1.164971645255516
Energy: 1.2562574653328724
Energy: 1.164971645255516
Energy: 1.2562574653335115
Energy: 1.164971645255516
Energy: 1.25625746533415
Energy: 1.164971645255516
Energy: 1.2858619811839422
Energy: 1.2635016838853892
Energy: 1.2514814377841148
Energy: 1.263501683886028
Energy: 1.285861981184581
Energy: 1.263501683886028
Energy: 1.2514814377834758
Energy: 1.2719827626634275
Energy: 1.2688505334795463
Energy: 1.2512205651062502
Energy: 1.2688505334795463
Energy: 1.2719827626634275
Energy: 1.2688505334789073
Energy: 1.2512205651062502
Energy: 1.1539755254879682
Energy: 1.2620135693185126
Energy: 1.1540082607705835
Energy: 1.2620865125561394
Energy: 1.1539755254873294
Energy: 1.2620135693185126
Energy: 1.1540082607705835
Energy: 1.1606717663565864
Energy: 1.2819316347353282
Energy: 1.1605704324436639
Energy: 1.2821591470942741
Energy: 1.1606717663553086
Energy: 1.2819316347347185
Energy: 1.160570432442386
Energy: 1.2656747891377775
Energy: 1.2643806899724828
Energy: 1.2656747891377775
Energy: 1.2643378830755616
Energy: 1.2656747891371387
Energy: 1.2643806899718437
Energy: 1.2656747891371387
Energy: 1.2616522771662857
Energy: 1.2247355307247068
Energy: 1.2616522771669245
Energy: 1.2247355307247068
Energy: 1.2616522771669245
Energy: 1.2247355307253456
Energy: 1.2616522771669245
Energy: 1.145393436102856
Energy: 1.1749972549630152
Energy: 1.145393436102856
Energy: 1.1749972549630152
Energy: 1.1453934361022169
Energy: 1.1749972549630152
Energy: 1.1453934361022169
Energy: 1.2479519328778128
Energy: 1.2858857467928337
Energy: 1.2479519328784516
Energy: 1.2858857467928337
Energy: 1.2479519328778128
Energy: 1.2858857467928337
Energy: 1.2479519328778128
Energy: 1.1909782709994323
Energy: 1.2183614157725005
Energy: 1.1909782710000714
Energy: 1.2183614157718614
Energy: 1.1909782710000714
Energy: 1.2183614157718614
Energy: 1.1909782710007102
Energy: 1.1976560756945167
Energy: 1.1528458001097015
Energy: 1.1976963461643741
Energy: 1.1528458001090915
Energy: 1.1976560756938777
Energy: 1.1528458001103405
Energy: 1.197696346165652
Energy: 1.1675352082499215
Energy: 1.202688102988448
Energy: 1.1673644755179666
Energy: 1.203720594635406
Energy: 1.1675352082492827
Energy: 1.2026881029897256
Energy: 1.1673644755173276
Energy: 1.2774687549529398
Energy: 1.309486437237683
Energy: 1.2774687549529398
Energy: 1.3094864372370443
Energy: 1.2774687549529398
Energy: 1.309486437237683
Energy: 1.3215286060692846
Energy: 1.2797691912875702
Energy: 1.309516957919333
Energy: 1.279809129159314
Energy: 1.309507689625431
Energy: 1.2797691912869313
Energy: 1.309516957918694
Energy: 1.279809129159314
Energy: 1.1609511393368337
Energy: 1.1573145166050893
Energy: 1.1609511393374727
Energy: 1.1573145166050893
Energy: 1.1609511393374727
Energy: 1.1573145166050893
Energy: 1.1609511393368337
Energy: 1.1658658115947502
Energy: 1.2726339903620174
Energy: 1.1658658115941114
Energy: 1.2739496465302071
Energy: 1.1658658115947502
Energy: 1.2726339903626565
Energy: 1.1658658115947502
Energy: 1.2106718267205947
Energy: 1.218276946184326
Energy: 1.2106718267212337
Energy: 1.2182769461836869
Energy: 1.2106718267205947
Energy: 1.2182769461824092
Energy: 1.2106718267225114
Energy: 1.2336272774054275
Energy: 1.2862522187639103
Energy: 1.2336272774054275
Energy: 1.286252218781799
Energy: 1.2336272774054275
Energy: 1.286252218781799
Energy: 1.2336272774054275
Energy: 1.1510281495498562
Energy: 1.1670058489345179
Energy: 1.1509852823815123
Energy: 1.1670070448894345
Energy: 1.1510281495498562
Energy: 1.1670058489345179
Energy: 1.1509852823821511
Energy: 1.2441977180276882
Energy: 1.2540698940963748
Energy: 1.2439683164720796
Energy: 1.2542331653831842
Energy: 1.244197718028327
Energy: 1.2540698940970139
Energy: 1.2439683164720796
Energy: 1.2212299063093692
Energy: 1.2635506690572709
Energy: 1.3087403955388874
Energy: 1.2635506690572709
Energy: 1.2402720192640295
Energy: 1.2635506690572709
Energy: 1.2403522764000268
Energy: 1.2066097652620231
Energy: 1.2818526888387614
Energy: 1.2066097652613843
Energy: 1.2818526888381225
Energy: 1.2066097652613843
Energy: 1.2818526888381225
Energy: 1.2066097652613843
Energy: 1.1570004416452428
Energy: 1.1647720881988237
Energy: 1.1570004416458817
Energy: 1.1647720881988237
Energy: 1.1570004416452428
Energy: 1.1647720881994625
Energy: 1.1570004416452428
Energy: 1.2742766484858699
Energy: 1.2034251288599063
Energy: 1.2336185579541776
Energy: 1.205242708059223
Energy: 1.2742766484852308
Energy: 1.2034251288586284
Energy: 1.2336185579548165
Energy: 1.3119427504467718
Energy: 1.2679026074948112
Energy: 1.3199488987052934
Energy: 1.2679026074948112
Energy: 1.2585276644655095
Energy: 1.2679026074948112
Energy: 1.224114074221213
Energy: 1.1642046057670092
Energy: 1.2730239655818762
Energy: 1.1644153266785986
Energy: 1.2731041648278445
Energy: 1.1642046057676483
Energy: 1.2730239655812374
Energy: 1.1644153266785986
Energy: 1.1602927123084557
Energy: 1.175828289553385
Energy: 1.1604282325324538
Energy: 1.1759047133857103
Energy: 1.1602927123084557
Energy: 1.175828289553385
Energy: 1.1604282325324538
Energy: 1.2683663240411442
Energy: 1.3500592714427062
Energy: 1.268366324042422
Energy: 1.3033818368886567
Energy: 1.2683663240417833
Energy: 1.3500592714427062
Energy: 1.2683663240417833
Energy: 1.348898393650832
Energy: 1.32046124297434
Energy: 1.2983220697132525
Energy: 1.3203586976235355
Energy: 1.3816822787838259
Energy: 1.3204612429737013
Energy: 1.325590709225987
Energy: 1.1556890023273005
Energy: 1.164719050566103
Energy: 1.1556890023273005
Energy: 1.164719050565464
Energy: 1.1556890023279396
Energy: 1.164719050565464
Energy: 1.1556890023273005

minimum gb energy = 1.1453934361022169 eV
minimum distance =  2.24457128408903 Angstroms
sigma value = 39


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

Energy: 1.1888565560570061
Energy: 1.2280937434557286
Energy: 1.188856556056252
Energy: 1.2280937434564827
Energy: 1.1888565560570061
Energy: 1.2280937434572365
Energy: 1.188856556056252
Energy: 1.2344038277960698
Energy: 1.0958428098654942
Energy: 1.2344038277953158
Energy: 1.0958428098654942
Energy: 1.234403827794562
Energy: 1.0958428098654942
Energy: 1.2344038277960698
Energy: 1.1522003834973005
Energy: 1.12873657973192
Energy: 1.1522003834973005
Energy: 1.128736579730412
Energy: 1.1522003834980545
Energy: 1.128736579731166
Energy: 1.1522003834980545
Energy: 1.2478305790057453
Energy: 1.0956408692721833
Energy: 1.2478305790057453
Energy: 1.095640869271429
Energy: 1.2478305790049913
Energy: 1.095640869269921
Energy: 1.2478305790057453
Energy: 1.2306567313051924
Energy: 1.0965657000523528
Energy: 1.2306567313059464
Energy: 1.0965657000523528
Energy: 1.2306567313059464
Energy: 1.0965657000508449
Energy: 1.2306567313059464
Energy: 1.2477324405996304
Energy: 1.1513763014582319
Energy: 1.2477324405988761
Energy: 1.1513763014574778
Energy: 1.2477324406003842
Energy: 1.1513763014582319
Energy: 1.2477324406003842
Energy: 1.1734914419969416
Energy: 1.1930482142999197
Energy: 1.1734914419954336
Energy: 1.1930482142999197
Energy: 1.2247462388984616
Energy: 1.1930482143006735
Energy: 1.2040587285808122
Energy: 1.2167168254130583
Energy: 1.1570620109578957
Energy: 1.2167168254145666
Energy: 1.1570620109578957
Energy: 1.2167168254138125
Energy: 1.1570620109571417
Energy: 1.2167168254145666
Energy: 1.2524133011788112
Energy: 1.157368496058559
Energy: 1.2524133011788112
Energy: 1.157368496058559
Energy: 1.2524133011780574
Energy: 1.157368496058559
Energy: 1.2524133011788112
Energy: 1.154206383309539
Energy: 1.203213059225845
Energy: 1.154206383309539
Energy: 1.203213059225091
Energy: 1.1542063833087852
Energy: 1.203213059225091
Energy: 1.1542063833087852
Energy: 1.1736115420935005
Energy: 1.1970608632101012
Energy: 1.1736115420935005
Energy: 1.1970608632108553
Energy: 1.1736115420935005
Energy: 1.1970608632108553
Energy: 1.229851845914651
Energy: 1.151649541819338
Energy: 1.0958032335043568
Energy: 1.151649541819338
Energy: 1.0958032335028485
Energy: 1.151649541819338
Energy: 1.0958032335043568
Energy: 1.151649541820092
Energy: 1.1877477981837603
Energy: 1.1118582621523359
Energy: 1.1877477981837603
Energy: 1.11185826215309
Energy: 1.1877477981837603
Energy: 1.1118582621523359
Energy: 1.1877477981837603
Energy: 1.1547361414273711
Energy: 1.096091658722955
Energy: 1.154736141428125
Energy: 1.096091658722955
Energy: 1.1547361414273711
Energy: 1.096091658722955
Energy: 1.1547361414266168
Energy: 1.1483531812016743
Energy: 1.1590784964749299
Energy: 1.1483531812009202
Energy: 1.1590784964749299
Energy: 1.2276524486698854
Energy: 1.1590784964749299
Energy: 1.2276524486698854
Energy: 1.1545694410156178
Energy: 1.1506507360109013
Energy: 1.1545694410148637
Energy: 1.1506507360116554
Energy: 1.1545694410156178
Energy: 1.1506507360116554
Energy: 1.1545694410163716
Energy: 1.2660810097984045
Energy: 1.1569834742435479
Energy: 1.2660810098865896
Energy: 1.1569834742435479
Energy: 1.2660810099415982
Energy: 1.1569834742427938
Energy: 1.2660810099031778
Energy: 1.2137256701540076
Energy: 1.1567946607776347
Energy: 1.2137256701540076
Energy: 1.1567946607783886
Energy: 1.2137256701547614
Energy: 1.1567946607776347
Energy: 1.2137256701547614
Energy: 1.2243806729327782
Energy: 1.1866677083594543
Energy: 1.2243806729320241
Energy: 1.1866677083594543
Energy: 1.2243806729320241
Energy: 1.1866677083602084
Energy: 1.2243806729320241
Energy: 1.1540267832229558
Energy: 1.1981338132082893
Energy: 1.1540267832229558
Energy: 1.1981338132082893
Energy: 1.1540267832244642
Energy: 1.1981338132082893
Energy: 1.1540267832229558
Energy: 1.2293422835900045
Energy: 1.0960217449929608
Energy: 1.2293422835892505
Energy: 1.0960217449929608
Energy: 1.2293422835884964
Energy: 1.096021744993715
Energy: 1.2293422835907584
Energy: 1.1526259012657074
Energy: 1.095559271453015
Energy: 1.1526259012649533
Energy: 1.095559271453015
Energy: 1.1526259012641993
Energy: 1.095559271453015
Energy: 1.1526259012657074
Energy: 1.3288978383127479
Energy: 1.1313888995580959
Energy: 1.3288978383119938
Energy: 1.1313888995565877
Energy: 1.3288978383119938
Energy: 1.1313888995565877
Energy: 1.32889783831124
Energy: 1.232484024049237
Energy: 1.0952254552093692
Energy: 1.232484024049237
Energy: 1.0952254552093692
Energy: 1.232484024049237
Energy: 1.0952254552093692
Energy: 1.2324840240499908
Energy: 1.2478150685964067
Energy: 1.1523714443396016
Energy: 1.2478150685971605
Energy: 1.1523714443388475
Energy: 1.2478150685956526
Energy: 1.1523714443388475
Energy: 1.2478150685956526
Energy: 1.2353340233138133
Energy: 1.1549354827238625
Energy: 1.2353340233138133
Energy: 1.1549354827231084
Energy: 1.2353340233130592
Energy: 1.1549354827223544
Energy: 1.2353340233123051
Energy: 1.2131088564050196
Energy: 1.1813635385064163
Energy: 1.2131088564057737
Energy: 1.1813635385064163
Energy: 1.2131088564050196
Energy: 1.1813635385071701
Energy: 1.2131088564050196
Energy: 1.2344199764701171
Energy: 1.1584176580389014
Energy: 1.2344199764693633
Energy: 1.1584176580381473
Energy: 1.234419976471625
Energy: 1.1584176580381473
Energy: 1.2344199764701171
Energy: 1.188856556056252
Energy: 1.2280937434557286
Energy: 1.1888565560554982
Energy: 1.2280937434564827
Energy: 1.188856556056252
Energy: 1.2280937434572365
Energy: 1.188856556056252
Energy: 1.2344038277960698
Energy: 1.0958428098654942
Energy: 1.2344038277953158
Energy: 1.0958428098654942
Energy: 1.234403827794562
Energy: 1.0958428098647404
Energy: 1.2344038277960698

minimum gb energy = 1.0952254552093692 eV
minimum distance =  2.28397771933897 Angstroms
sigma value = 21


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

Energy: 1.138367053119977
Energy: 1.1244484598857845
Energy: 1.138367053119062
Energy: 1.1244484598857845
Energy: 1.138367053119977
Energy: 1.1244484598857845
Energy: 1.138367053119062
Energy: 1.105364044449206
Energy: 1.0657228233075982
Energy: 1.1053640444126134
Energy: 1.0657228233075982
Energy: 1.1053640444043755
Energy: 1.0657228233085136
Energy: 1.105364044721851
Energy: 1.1115018723909127
Energy: 1.495093905222711
Energy: 1.1115018723909127
Energy: 1.4950939052236265
Energy: 1.1115018723909127
Energy: 1.4950939052236265
Energy: 1.1115018723909127
Energy: 1.04113711978819
Energy: 1.052162288039709
Energy: 1.041137119787275
Energy: 1.052162288039709
Energy: 1.04113711978819
Energy: 1.0521622880406243
Energy: 1.041137119787275
Energy: 1.0112547149759334
Energy: 1.0527307506078762
Energy: 1.0112547149759334
Energy: 1.0527307506087917
Energy: 1.0112547149759334
Energy: 1.0527307506069608
Energy: 1.0112547149759334
Energy: 1.0239215375921087
Energy: 1.0935061497609808
Energy: 1.0239215375921087
Energy: 1.0935061497609808
Energy: 1.0239215375921087
Energy: 1.0935061497609808
Energy: 1.0239215375930237
Energy: 0.9693395037582868
Energy: 1.2202371574279665
Energy: 0.9693395037582868
Energy: 1.2202371574279665
Energy: 0.9693395037573714
Energy: 1.2202371574288817
Energy: 0.9693395037582868
Energy: 0.9861178841329858
Energy: 1.0713962953613771
Energy: 0.9861178841329858
Energy: 1.0713962953613771
Energy: 0.9861178841329858
Energy: 1.0713962953613771
Energy: 0.9861178841339013
Energy: 1.0416613882272499
Energy: 1.0243904148530258
Energy: 1.0416613882272499
Energy: 1.0243904148530258
Energy: 1.0416613882272499
Energy: 1.0243904148539411
Energy: 1.0416613882272499
Energy: 1.0413436390373538
Energy: 1.4284189101645404
Energy: 1.0413436390373538
Energy: 1.4284189101645404
Energy: 1.0413436390373538
Energy: 1.4284189101645404
Energy: 1.0413436390373538
Energy: 0.9695100381419982
Energy: 1.0719256842456715
Energy: 0.9695100381419982
Energy: 1.0719256842456715
Energy: 0.9695100381419982
Energy: 1.0719256842456715
Energy: 0.9695100381429137
Energy: 0.9859326915904472
Energy: 1.0767483786623009
Energy: 0.9859326915895318
Energy: 1.0767483786623009
Energy: 0.9859326915904472
Energy: 1.0767483786623009
Energy: 0.9859326915904472
Energy: 1.041604219196307
Energy: 1.0243983780025365
Energy: 1.041604219196307
Energy: 1.0243983780025365
Energy: 1.0416042191953916
Energy: 1.024398378003452
Energy: 1.041604219196307
Energy: 1.063119435365545
Energy: 1.2513827578014654
Energy: 1.063119435365545
Energy: 1.25138275780055
Energy: 1.063119435365545
Energy: 1.25138275780055
Energy: 1.0631194353646298
Energy: 1.0890343736339771
Energy: 1.0710879764250139
Energy: 1.0890343711398787
Energy: 1.0710879764250139
Energy: 1.0890343712451007
Energy: 1.0710879764250139
Energy: 1.0890343738489974
Energy: 1.0908983444000184
Energy: 1.033218443195197
Energy: 1.090898344400934
Energy: 1.0332184431961122
Energy: 1.0908983444000184
Energy: 1.033218443195197
Energy: 1.0908983444000184
Energy: 1.104963405326961
Energy: 1.056407541291574
Energy: 1.104963405327876
Energy: 1.0564075412924894
Energy: 1.104963405327876
Energy: 1.056407541291574
Energy: 1.104963405327876
Energy: 1.0956530226734404
Energy: 1.2513695490784646
Energy: 1.0956530226734404
Energy: 1.2513695490784646
Energy: 1.0956530226734404
Energy: 1.25136954907938
Energy: 1.095653022674356
Energy: 1.0032784705662585
Energy: 1.0717785109625584
Energy: 1.0032784674417863
Energy: 1.0717785109625584
Energy: 1.0032784283945062
Energy: 1.0717785109625584
Energy: 1.0032784336068559
Energy: 0.9859053362547849
Energy: 1.0240617059138837
Energy: 0.9859053362538696
Energy: 1.0240617059138837
Energy: 0.9859053362547849
Energy: 1.0240617059138837
Energy: 0.9859053362538696
Energy: 1.041412245498509
Energy: 1.025238850562805
Energy: 1.041412245498509
Energy: 1.0252388091485958
Energy: 1.041412245498509
Energy: 1.0252387837035555
Energy: 1.041412245498509
Energy: 0.9695570538666536
Energy: 1.0314498808050605
Energy: 0.9695570538666536
Energy: 1.0314498808078068
Energy: 0.9695570538666536
Energy: 1.0314498808197061
Energy: 0.9695570538666536
Energy: 0.9661613688733646
Energy: 1.0715653745717393
Energy: 0.9661613688816028
Energy: 1.0715653745717393
Energy: 0.966161368877026
Energy: 1.0715653745717393
Energy: 0.96616136887428
Energy: 1.040730310932182
Energy: 1.0238950186494287
Energy: 1.0407303109330972
Energy: 1.023895018650344
Energy: 1.040730310932182
Energy: 1.023895018650344
Energy: 1.040730310932182
Energy: 1.0417465477723697
Energy: 1.0090947976671418
Energy: 1.0417465477723697
Energy: 1.0090947976662268
Energy: 1.0417465477723697
Energy: 1.0090947976653113
Energy: 1.0417465477723697

minimum gb energy = 0.9661613688733646 eV
minimum distance =  2.32936149584131 Angstroms
sigma value = 113


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

Energy: 0.9918626111484349
Energy: 1.2075687665403403
Energy: 0.9918626111494565
Energy: 1.2075687665413624
Energy: 0.9918626111474131
Energy: 1.2075687665413624
Energy: 0.9918626111484349
Energy: 0.98834260251129
Energy: 0.9769995593368779
Energy: 0.9883426025026056
Energy: 0.9769995593394319
Energy: 0.9883426025225286
Energy: 0.9769995593384101
Energy: 0.9883426025092465
Energy: 1.004037980366248
Energy: 1.020628205801466
Energy: 1.004037980365737
Energy: 1.0206282057999334
Energy: 1.004037980366759
Energy: 1.0206282058009553
Energy: 1.0040379803688022
Energy: 1.0151552088198033
Energy: 0.9966512984761303
Energy: 1.015155208818271
Energy: 0.9966512984756194
Energy: 1.01515520881776
Energy: 0.9966512984730651
Energy: 1.015155208821336
Energy: 0.9657474648353577
Energy: 1.1909300991816048
Energy: 0.9657474648363792
Energy: 1.1909300991810938
Energy: 0.9657474648363792
Energy: 1.1909300991810938
Energy: 0.96574746483689
Energy: 0.9945060875904589
Energy: 0.9585009262291779
Energy: 0.9945060875914806
Energy: 0.9585009262291779
Energy: 0.9945060875925023
Energy: 0.9585009262291779
Energy: 0.9945060875909698
Energy: 0.9739544014365284
Energy: 1.0020298489824553
Energy: 0.9739544014360175
Energy: 1.0020298489804118
Energy: 0.9739544014355067
Energy: 1.0020298489799009
Energy: 0.9739544014380608
Energy: 0.9894009038043171
Energy: 0.9579584963939535
Energy: 0.9894009038048279
Energy: 0.9579584963898666
Energy: 0.9894009038053387
Energy: 0.9579584963883343
Energy: 0.9894009038048279
Energy: 0.9446892241402347
Energy: 1.055031121794883
Energy: 0.9446892241402347
Energy: 1.0550311217933506
Energy: 0.9446892241417673
Energy: 1.0550311217938615
Energy: 0.9446892241422781
Energy: 0.9555261604610163
Energy: 0.9440595118374477
Energy: 0.955526160458973
Energy: 0.9440595118364261
Energy: 0.9555261604610163
Energy: 0.9440595118359154
Energy: 0.9555261604584622
Energy: 0.9217343947760678
Energy: 0.9375209288822813
Energy: 0.921734394778622
Energy: 0.9375209288843246
Energy: 0.921734394778111
Energy: 0.9375209288807488
Energy: 0.9217343947776001
Energy: 0.9576272156664992
Energy: 0.923142459670991
Energy: 0.9576272156664992
Energy: 0.9231424596699694
Energy: 0.957627215667521
Energy: 0.923142459670991
Energy: 0.9576272156649667
Energy: 0.9035366723810616
Energy: 1.1151460077782713
Energy: 0.9035366723805508
Energy: 1.115146007776228
Energy: 0.9035366723836157
Energy: 1.115146007776228
Energy: 0.9035366723841267
Energy: 0.9173030742817859
Energy: 0.9208852721724173
Energy: 0.9173030742792317
Energy: 0.9208852721759931
Energy: 0.9173030742807642
Energy: 0.9208852721744606
Energy: 0.9173030742802534
Energy: 0.92891786655125
Energy: 0.9173601520752183
Energy: 0.9289178665507392
Energy: 0.9173601528544472
Energy: 0.9289178665497178
Energy: 0.9173601437638638
Energy: 0.9289178665507392
Energy: 0.9163286497836531
Energy: 1.0187071514271695
Energy: 0.9163286497856964
Energy: 1.0187071514276802
Energy: 0.9163286497846749
Energy: 1.0187071514281913
Energy: 0.916328649784164
Energy: 0.8607795830708006
Energy: 0.9294492527464027
Energy: 0.8607795830697788
Energy: 0.9294492527443592
Energy: 0.8607795830753516
Energy: 0.9294492527448701
Energy: 0.8607795830713112
Energy: 0.9197415451209325
Energy: 0.9233387693842592
Energy: 0.9197415451204216
Energy: 0.9233387693822157
Energy: 0.9197415451209325
Energy: 0.9233387693882994
Energy: 0.9197415451188891
Energy: 0.9469986370137766
Energy: 0.8873971968390103
Energy: 0.9469986370117333
Energy: 0.8873971968849865
Energy: 0.9469986370142873
Energy: 0.8873971967736681
Energy: 0.9469986370122441
Energy: 0.9233364440355878
Energy: 1.00844281959252
Energy: 0.9233364440360986
Energy: 1.0084428195904764
Energy: 0.9233364440360986
Energy: 1.008442819592009
Energy: 0.9233364440376312
Energy: 0.9245738157661068
Energy: 0.9007714790736137
Energy: 0.9245738157691719
Energy: 0.9007714790746355
Energy: 0.9245738157666177
Energy: 0.9007714790725923
Energy: 0.9245738157671285
Energy: 0.9359771849474886
Energy: 0.8833789698852352
Energy: 0.9359771849454454
Energy: 0.883377055658986
Energy: 0.9359771849474886
Energy: 0.883378370725075
Energy: 0.9359771849454454
Energy: 0.9249156224947984
Energy: 0.900658982353135
Energy: 0.9249156224963309
Energy: 0.9006589823516025
Energy: 0.9249156224947984
Energy: 0.9006589823541568
Energy: 0.9249156224953092
Energy: 0.9136722768686264
Energy: 1.0567185688039111
Energy: 0.9136722768676045
Energy: 1.0567185688039111
Energy: 0.9136722768691372
Energy: 1.0567185688034004
Energy: 0.9136722768676045
Energy: 1.0195337138818934
Energy: 0.9390525802653621
Energy: 1.019533713882915
Energy: 0.9390525802653621
Energy: 1.0195337138818934
Energy: 0.939052580265873
Energy: 1.019533713883426
Energy: 0.9544353068252719
Energy: 0.9424458862780987
Energy: 0.9544353068140333
Energy: 0.9424458862750336
Energy: 0.954435306815055
Energy: 0.9424458862791205
Energy: 0.9544353068273154
Energy: 0.9930389564161834
Energy: 1.047929630954857
Energy: 0.9930389564156725
Energy: 1.0479296308149777
Energy: 0.9930389564156725
Energy: 1.0479296309834645
Energy: 0.9930389564156725
Energy: 0.976174111939715
Energy: 1.1320551881023595
Energy: 0.976174112025491
Energy: 1.1320551818865956
Energy: 0.9761741119841588
Energy: 1.1320551855247607
Energy: 0.9761741119606598
Energy: 1.0802071920971643
Energy: 0.9865245655149434
Energy: 1.0802071920971643
Energy: 0.9865245655134107
Energy: 1.0802071920976752
Energy: 0.9865245655139215
Energy: 1.0802071920976752
Energy: 1.0129501815703466
Energy: 0.9975708170424912
Energy: 1.0129501815708575
Energy: 0.9975708164195355
Energy: 1.0129501815708575
Energy: 0.9975708140022501
Energy: 1.0129501815739226
Energy: 0.9800963139007429
Energy: 0.988306547816424
Energy: 0.9800963138992103
Energy: 0.9883065478179562
Energy: 0.9800963139017647
Energy: 0.9883065478148914
Energy: 0.9800963139022755
Energy: 0.9611039654621578
Energy: 1.1576987294342571
Energy: 0.9611039654611362
Energy: 1.1576987294342571
Energy: 0.9611039654596035
Energy: 1.1576987294311925
Energy: 0.961103965461647
Energy: 1.050988151152354
Energy: 0.9800545401514721
Energy: 1.050988151151843
Energy: 0.9800545401489178
Energy: 1.0509881511503107
Energy: 0.9800545401473854
Energy: 1.0509881511503107
Energy: 0.9764431268904921
Energy: 0.9262899720619803
Energy: 0.9764431268930462
Energy: 0.9262899720619803
Energy: 0.976443126891003
Energy: 0.9262899720609585
Energy: 0.9764431268899812
Energy: 0.9881597435115478
Energy: 1.0575161235247936
Energy: 0.988159743510526
Energy: 1.0575161235268369
Energy: 0.9881597435115478
Energy: 1.0575161235278587
Energy: 0.988159743511037
Energy: 0.9295594240824041
Energy: 1.1208041229277352
Energy: 0.9295594240829151
Energy: 1.1208041229277352
Energy: 0.9295594240818935
Energy: 1.120804122929268
Energy: 0.9295594240829151
Energy: 1.0222489596349253
Energy: 0.9675776814924882
Energy: 1.0222489596344144
Energy: 0.9675776814909556
Energy: 1.022248959635436
Energy: 0.967577681489423
Energy: 1.0222489596339035
Energy: 0.9348111365623909
Energy: 0.9168932181469486
Energy: 0.9348111365623909
Energy: 0.916893218148992
Energy: 0.9348111365603474
Energy: 0.9168932181495029
Energy: 0.9348111365583042
Energy: 0.9718689032778791
Energy: 0.8992238108380848
Energy: 0.9718689032773683
Energy: 0.8992238108391064
Energy: 0.9718689032773683
Energy: 0.8992238108391064
Energy: 0.9718689032768574
Energy: 0.9174805481766497
Energy: 1.1376876257298834
Energy: 0.9174805481781823
Energy: 1.1376876257303945
Energy: 0.9174805481797148
Energy: 1.1376876257303945
Energy: 0.9174805481781823
Energy: 0.9175110291727719
Energy: 0.9194751242044799
Energy: 0.917511029172261
Energy: 0.919475124203969
Energy: 0.9175110291727719
Energy: 0.919475124203969
Energy: 0.9175110291727719
Energy: 0.942717234559637
Energy: 0.9181098056484579
Energy: 0.9427172345611696
Energy: 0.9181098056469252
Energy: 0.9427172345606586
Energy: 0.9181098056474362
Energy: 0.942717234559637
Energy: 0.9179847646020158
Energy: 1.0942985591937973
Energy: 0.9179847646025268
Energy: 1.0942985591927754
Energy: 0.9179847646020158
Energy: 1.0942985591912429
Energy: 0.9179847646025268
Energy: 0.8751469952868781
Energy: 0.9495136671461116
Energy: 0.8751469952858564
Energy: 0.9495136671445791
Energy: 0.8751469952878996
Energy: 0.9495136671445791
Energy: 0.8751469952858564
Energy: 0.9173180066199851
Energy: 0.9280783601435633
Energy: 0.9173180066199851
Energy: 0.9280783601420307
Energy: 0.9173180066194743
Energy: 0.9280783601420307
Energy: 0.917318006620496

minimum gb energy = 0.8607795830697788 eV
minimum distance =  2.3060320904707 Angstroms
sigma value = 365


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

Energy: 0.3248713083855596
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.3248713083855596
Energy: 0.3376633678679527
Energy: 0.3248713083855596
Energy: 1.9337457565885174
Energy: 1.0752480009835632
Energy: 1.7649421804364398
Energy: 1.0752480009835632
Energy: 1.7650226076966877
Energy: 1.0752480009835632
Energy: 1.7649515632084976
Energy: 0.32487130838440786
Energy: 0.3376633678668009
Energy: 0.32487130838440786
Energy: 0.3376633678668009
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 1.9337457565839107
Energy: 1.0752480009824112
Energy: 1.9337457565827587
Energy: 1.0752480009824112
Energy: 1.933745756578152
Energy: 1.0752480009824112
Energy: 1.9337457566057943
Energy: 0.32487130838440786
Energy: 0.3376633678668009
Energy: 0.3248713083855596
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 1.933745756572419
Energy: 1.0752480009824112
Energy: 1.933745756575848
Energy: 1.0752480009835632
Energy: 1.9337457565701155
Energy: 1.0752480009824112
Energy: 1.9337457565735707
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 1.9337457566196152
Energy: 1.0752480009835632
Energy: 1.7650240164667659
Energy: 1.0752480009824112
Energy: 1.7653916381091244
Energy: 1.0752480009824112
Energy: 1.7650533087255569
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.3248713083855596
Energy: 1.933745756568964
Energy: 1.0752480009824112
Energy: 1.9337457565701155
Energy: 1.0752480009824112
Energy: 1.933745756568964
Energy: 1.0752480009824112
Energy: 1.9337457565850622
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 1.9337457565678118
Energy: 1.0752480009824112
Energy: 1.933745756578152
Energy: 1.0752480009835632
Energy: 1.9337457566046423
Energy: 1.0752480009824112
Energy: 1.9337457565735707
Energy: 0.3248713083855596
Energy: 0.3376633678679527
Energy: 0.3248713083855596
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 1.9337457565977316
Energy: 1.0752480009824112
Energy: 1.933745756572419
Energy: 1.0752480009824112
Energy: 1.933745756568964
Energy: 1.0752480009824112
Energy: 1.9337457566276777
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 1.9337457565804552
Energy: 1.0752480009824112
Energy: 1.933745756578152
Energy: 1.0752480009824112
Energy: 1.933745756575848
Energy: 1.0752480009824112
Energy: 1.9337457565678118
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.3248713083855596
Energy: 1.9337457565942764
Energy: 1.0752480009824112
Energy: 1.9337457566023388
Energy: 1.0752480009835632
Energy: 1.933745756568964
Energy: 1.0752480009824112
Energy: 1.9337457565816067
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 0.3376633678679527
Energy: 0.32487130838440786
Energy: 1.9337457565839107
Energy: 1.0752480009824112
Energy: 1.9337457565678118
Energy: 1.0752480009824112
Energy: 1.933745756578152
Energy: 1.0752480009824112
Energy: 1.933745756568964

minimum gb energy = 0.32487130838440786 eV
minimum distance =  2.31509773641011 Angstroms
sigma value = 23