Model name: model_name=MEAM_LAMMPS_KimSeolJi_2017_PtCu__MO_070797404269_002
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315671682358
cohesive_energy=3.5402784386807093
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.313733570227712e-19, 1.89196232179158e-19, 2.35777915636074e-19, 2.75624048523654e-19, 3.10668458039136e-19, 3.4196217205442396e-19, 3.70144459046484e-19, 3.95647906706496e-19, 4.1877853077155396e-19, 4.397606359704179e-19, 4.58772063909462e-19, 4.759506017792099e-19, 4.91410004120676e-19, 5.052415950019979e-19, 5.1752708543151e-19, 5.28330562474572e-19, 5.37711306666642e-19, 5.45718985483374e-19, 5.52400062047154e-19, 5.57794590773832e-19, 5.61937819549356e-19, 5.648617919064059e-19, 5.66596949201028e-19, 5.67170528436e-19, 5.665424751954719e-19, 5.644836782207819e-19, 5.606913261281039e-19, 5.547953161149839e-19, 5.46342232194e-19, 5.347777212497879e-19, 5.1941444950636195e-19, 4.99396854641166e-19, 4.73657887015956e-19, 4.40853320434806e-19, 3.9927363242923796e-19, 3.4674146495364597e-19, 2.80435384955556e-19, 1.96689612296376e-19, 9.0666374629743e-20, -4.4075078113022995e-20, -2.1623776940780999e-19, -4.3775471082465e-19, -7.25246081676342e-19, -1.1023359764312159e-18, -1.60325009234478e-18, -2.2788559353698996e-18, -3.20694879414708e-18, -4.51025539884072e-18, -6.390345591774359e-18, -9.19388233124658e-18, -1.3552283428716778e-17, -2.0701243634923797e-17, -3.3295793937134397e-17, -5.780813513135399e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.016739188472016515
Energy: 0.018696340339935155
Energy: 0.5354969928769222
Energy: 0.9048409475581323
Energy: 0.8896909270955666
Energy: 0.3468190683297528
Energy: 0.01780466670039911
Energy: 0.0173852189938503
Energy: 0.8216922387137563
Energy: 0.27751624204757835
Energy: 0.5352688741513554
Energy: 0.5355464355099544
Energy: 0.01770479437938837
Energy: 0.09909393527519593
Energy: 0.017277452113079877
Energy: 0.822834369688455
Energy: 0.7630085761185615
Energy: 0.7651158037874304
Energy: 0.7126712203640455
Energy: 0.09744532905881778
Energy: 0.0988665948593697
Energy: 0.019114757505064237
Energy: 0.5357151311211187
Energy: 0.9828852608762781
Energy: 0.9046546120546898
Energy: 0.891111467233056
Energy: 0.09759138203450714
Energy: 0.017685695029991396
Energy: 0.3430813102481871
Energy: 0.8259100499863677
Energy: 0.2775254954217847
Energy: 0.5354816959486621
Energy: 0.5355494977970569
Energy: 0.017335264105435035
Energy: 0.0984710273486064
Energy: 0.017219691482349135
Energy: 0.7596999926844314
Energy: 0.763300232784467
Energy: 0.764741674482182
Energy: 0.6977720687949893
Energy: 0.09744892516318017
Energy: 0.09853311736948692

minimum gb energy = 0.016739188472016515 eV
minimum distance =  2.53269322791727 Angstroms
sigma value = 5


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

Energy: 1.162048590536758
Energy: 1.3584442607537104
Energy: 1.277004862212468
Energy: 1.3470241470054567
Energy: 1.2044040227947423
Energy: 1.304874531592217
Energy: 1.35452758156198
Energy: 1.0727694725137336
Energy: 1.189457847365089
Energy: 1.1066710487746674
Energy: 1.2138841187178648
Energy: 1.1710450345423804
Energy: 1.1191830284167081
Energy: 1.155063738441125
Energy: 1.222039567933579
Energy: 1.2120588855701846
Energy: 1.22859240329511
Energy: 1.1769065152729434
Energy: 1.271831357623494
Energy: 1.2370126932776104
Energy: 1.2455903655670286
Energy: 1.1699589855377226
Energy: 1.1933420850379524
Energy: 1.1069381422803366
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Energy: 1.1875846680613855
Energy: 1.166223404286521
Energy: 1.2868024015876345
Energy: 1.2570850160150122
Energy: 1.268958589258138
Energy: 1.12024853367616
Energy: 1.1563383619059928
Energy: 1.1389014387643908
Energy: 1.2030449117508122
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Energy: 1.178674556172255
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Energy: 1.1613177543782547
Energy: 1.272937985300941
Energy: 1.2815735245044637
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Energy: 1.1990172607175231
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Energy: 1.1298613428956452
Energy: 1.2132934187540438
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Energy: 1.0848784670558922
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Energy: 1.160594495787913
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Energy: 1.1415475231134953
Energy: 1.1828062868374756
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Energy: 1.1706947546669046
Energy: 1.1476431276028638
Energy: 1.2006942818250543
Energy: 1.169594762046706
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Energy: 1.269399134930657
Energy: 1.144819892520237
Energy: 1.1957479785135994
Energy: 1.1189437973108247
Energy: 1.1781636937701876
Energy: 1.1897905056787699
Energy: 1.119141262931314
Energy: 1.187371210037041
Energy: 1.2509407480489743
Energy: 1.3191813130666292
Energy: 1.187361078739981
Energy: 1.2192466750740205
Energy: 1.1797322503808336
Energy: 1.2267138640220692
Energy: 1.2709676724055405
Energy: 1.1001671203967167
Energy: 1.1936083303423148
Energy: 1.1708689031397028
Energy: 1.2056226701577768
Energy: 1.1720373394113937
Energy: 1.2023712834058837
Energy: 1.2283146675965266
Energy: 1.1744796780608622
Energy: 1.2457335843839767
Energy: 1.1904550735145112
Energy: 1.2550481498348998
Energy: 1.2472035141170117
Energy: 1.2370886955646252
Energy: 1.2121147120120217
Energy: 1.0760048277102294
Energy: 1.2301850276201876
Energy: 1.204247310556364
Energy: 1.216615136261817
Energy: 1.1872964286146082
Energy: 1.2041059364165099
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Energy: 1.1784966104616692
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Energy: 1.22757819208398
Energy: 1.2441319994508142
Energy: 1.1954737974526846
Energy: 1.1403629000871858
Energy: 1.2082949144990747

minimum gb energy = 1.0659198303512525 eV
minimum distance =  2.29681876304888 Angstroms
sigma value = 401


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

Energy: 1.1071114893534517
Energy: 1.1858863258334336
Energy: 1.1307257471299825
Energy: 1.3101596752434264
Energy: 1.3140174946847534
Energy: 1.2421923015151386
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Energy: 1.0979258338572766
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Energy: 1.061060009980062
Energy: 1.2643857112228594
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Energy: 1.1181400033504412
Energy: 1.1050439212263194
Energy: 1.0904831471247487
Energy: 1.2129747729012517
Energy: 1.2136203501638112
Energy: 1.1687674893838451
Energy: 1.1597771389004978
Energy: 1.1271656114845594
Energy: 1.13056493381029
Energy: 1.1251617470122388
Energy: 1.1295062822782806
Energy: 1.2864472906507227
Energy: 1.2751051556896182
Energy: 1.1432402189352462
Energy: 1.1807638196067227
Energy: 1.1105965431262428
Energy: 1.1403463938119633
Energy: 1.2374913279949527
Energy: 1.2282380502628485
Energy: 1.0815290643548547
Energy: 1.135531658177662
Energy: 1.185485504651567
Energy: 1.1953230498852006
Energy: 1.1703381619495894
Energy: 1.170407909635994
Energy: 1.188246438204461
Energy: 1.0974998912539997
Energy: 1.1476966832563158
Energy: 1.155299616868656
Energy: 1.3757886079092365
Energy: 1.2242453927307615
Energy: 1.137831731073816
Energy: 1.1773749893805119
Energy: 1.0536969074934264
Energy: 1.1371370132669494
Energy: 1.2070949546550849
Energy: 1.115451308359419
Energy: 1.1617152999408147
Energy: 1.0953134361220314
Energy: 1.1431636804455403
Energy: 1.058756298131321
Energy: 1.1203198995072001
Energy: 1.2441429983831749
Energy: 1.2179965890288957
Energy: 1.2989526862717582
Energy: 1.1533404032637053
Energy: 1.1022410001973415
Energy: 1.0888584640455579
Energy: 1.215743883703254
Energy: 1.082697873396295
Energy: 1.1822602389228456
Energy: 1.1862726995935187
Energy: 1.1007855749299718
Energy: 1.1412529522373769
Energy: 1.1794000631484833
Energy: 1.2987149570914454
Energy: 1.1504231932620332
Energy: 1.1502741574424136
Energy: 1.2370955896335376
Energy: 1.216690994364587
Energy: 1.2928111551656816
Energy: 1.0969722580031116
Energy: 1.1110987368237824
Energy: 1.0807650589083173
Energy: 1.1198976411717716
Energy: 1.1268689921118336
Energy: 1.1073002789137378
Energy: 1.2336710183652313
Energy: 1.2504049901092935
Energy: 1.1583539916309868
Energy: 1.1266349617974074
Energy: 1.1246895356586892
Energy: 1.0920411451447578
Energy: 1.2600273328954317
Energy: 1.2446594709098455
Energy: 1.1120270725172454
Energy: 1.122426132728436
Energy: 1.0676209478957768
Energy: 1.1487876898276255
Energy: 1.1284118477216718
Energy: 1.0635265732196324
Energy: 1.2100165708755029
Energy: 1.1796972767036944
Energy: 1.15805997940288
Energy: 1.1731671212901573
Energy: 1.1500391640610033
Energy: 1.1611085506124088
Energy: 1.2362478423803562
Energy: 1.2483806510308142
Energy: 1.0872518794508161
Energy: 1.1997177520505466
Energy: 1.1122035973604607
Energy: 1.2259644402141734
Energy: 1.1403204818448214
Energy: 1.1712585439496324
Energy: 1.1796350783080984
Energy: 1.1277712771091442
Energy: 1.1300193352267047
Energy: 1.152213405176334
Energy: 1.1655960159492107
Energy: 1.1686686016466739
Energy: 1.2499127242457577
Energy: 1.1928677889108343
Energy: 1.0839119816244693
Energy: 1.1861131010905697
Energy: 1.1323924881789005
Energy: 1.1141433186875453
Energy: 1.2346912069001539
Energy: 1.0570536180528596
Energy: 1.1772782884883275

minimum gb energy = 1.0419273840063648 eV
minimum distance =  2.28533042287565 Angstroms
sigma value = 311


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

Energy: 1.2211925281544485
Energy: 1.1193418990440562
Energy: 1.1700334052206849
Energy: 1.1262128781676244
Energy: 1.1647944758897173
Energy: 1.1631759065882443
Energy: 1.2079878539223565
Energy: 1.1282147212465563
Energy: 1.1621960390375061
Energy: 1.0951212506393777
Energy: 1.1823217139867848
Energy: 1.1779522246587715
Energy: 1.1276941847477424
Energy: 1.156720666287418
Energy: 1.127515847859383
Energy: 1.159604555325729
Energy: 1.1442699278501616
Energy: 1.1189000112965366
Energy: 1.2164489899085482
Energy: 1.1690294884623087
Energy: 1.1513931784320521
Energy: 1.1334065714649193
Energy: 1.203233874191808
Energy: 1.1695301699051552
Energy: 1.1361766731573442
Energy: 1.0904322861358047
Energy: 1.1653504090378508
Energy: 1.1238441443004017
Energy: 1.2211924167210118
Energy: 1.1475224506043349
Energy: 1.2208227887309282
Energy: 1.226946488688413
Energy: 1.1896434929171105
Energy: 1.2776947517914938
Energy: 1.1428953794590484
Energy: 1.1084646249096195
Energy: 1.1064851284911084
Energy: 1.0988749770207464
Energy: 1.1457613488075309
Energy: 1.1634241300251587
Energy: 1.1659169521613033
Energy: 1.135409959551139
Energy: 1.2143231992194534
Energy: 1.150181719545958
Energy: 1.1683520968121002
Energy: 1.1605944248179043
Energy: 1.2439994754278823
Energy: 1.1474248177433275
Energy: 1.2692655456842203
Energy: 1.1885499539867452
Energy: 1.1574366126534557
Energy: 1.0979154174657317
Energy: 1.178449760275256
Energy: 1.1850788101695513
Energy: 1.183369976913694
Energy: 1.1658701798191935
Energy: 1.1505235741006423
Energy: 1.1862107433037066
Energy: 1.102647613806171
Energy: 1.1314186577877723
Energy: 1.1141060373543425
Energy: 1.20962645321188
Energy: 1.1986953497149864
Energy: 1.1193244164028604
Energy: 1.1529575535871104
Energy: 1.0782223716871875
Energy: 1.1695755656500257
Energy: 1.1099248482273132
Energy: 1.1101786809748635
Energy: 1.142116685792908
Energy: 1.2348572777992914
Energy: 1.1436936075977273
Energy: 1.2129154917814102
Energy: 1.2351648859748756
Energy: 1.1540640891737717
Energy: 1.2273485890727198
Energy: 1.1164071604710415
Energy: 1.067276683204306
Energy: 1.0961027394540386
Energy: 1.1019769765683218
Energy: 1.109481922417676
Energy: 1.1282980910265505
Energy: 1.0712160144437055
Energy: 1.1059404890903115
Energy: 1.1670130484153782
Energy: 1.1308633977378035
Energy: 1.181605464354796
Energy: 1.1351976041070964
Energy: 1.1395473772440787
Energy: 1.1839943121110272
Energy: 1.2274417384360727
Energy: 1.137523456889374
Energy: 1.1764529763703504
Energy: 1.1583910531172783
Energy: 1.1945082468594954
Energy: 1.2391406967920118
Energy: 1.1619419039560834
Energy: 1.187730251017277
Energy: 1.1151652927380606
Energy: 1.1584683098217345
Energy: 1.1874330354779312
Energy: 1.2194442185948953
Energy: 1.1334996715906511
Energy: 1.2005614583073934
Energy: 1.15193137907189
Energy: 1.1065438080940022
Energy: 1.0827169101009815
Energy: 1.1400615660342537
Energy: 1.106828963715925
Energy: 1.1327736525085508
Energy: 1.1313833632755061
Energy: 1.1279519321825848
Energy: 1.214215246934903
Energy: 1.1833621838392938
Energy: 1.226350826656204
Energy: 1.2089729721808595
Energy: 1.1271268423675938
Energy: 1.206444635930369
Energy: 1.1231256251463178
Energy: 1.136757272348558
Energy: 1.1291953933828913
Energy: 1.1608967800793413
Energy: 1.1850540282070177
Energy: 1.0801151538919094
Energy: 1.0925500733626474
Energy: 1.0990886080287678
Energy: 1.1721363727892227
Energy: 1.1605959111966668
Energy: 1.1585665302193886
Energy: 1.1365114159552694
Energy: 1.180630988422226
Energy: 1.1828922060864302
Energy: 1.1612854898091618
Energy: 1.134177299037436
Energy: 1.1930009424262307
Energy: 1.1606922412945038
Energy: 1.1738686204689401
Energy: 1.2249896798029019
Energy: 1.2012620829006408
Energy: 1.1986370335160628
Energy: 1.1463159915101262
Energy: 1.1855067686115945
Energy: 1.1656477781208974
Energy: 1.1411541989920453
Energy: 1.130324422747693
Energy: 1.0988157123709326
Energy: 1.122314303766488
Energy: 1.0965784647507038
Energy: 1.1162030034942991
Energy: 1.1535593038617968
Energy: 1.1777574079335822
Energy: 1.1210555732121925
Energy: 1.115037834847144
Energy: 1.0963251631771205
Energy: 1.1671731065486477
Energy: 1.1532756624669267
Energy: 1.223781369368057
Energy: 1.1786266775677001
Energy: 1.1579021845507234
Energy: 1.2143045926526719
Energy: 1.1467573151688557
Energy: 1.1221683896443153
Energy: 1.0957944334399985
Energy: 1.132679522153994
Energy: 1.0696890089901512
Energy: 1.07562903634479
Energy: 1.10536600178453
Energy: 1.0728911574550626
Energy: 1.1729234680948384
Energy: 1.1712820787029583
Energy: 1.185553662142085
Energy: 1.1126373465790917
Energy: 1.0983801539657212
Energy: 1.1316444691024166
Energy: 1.1218577458360128
Energy: 1.1544555417916134
Energy: 1.156284223020909
Energy: 1.1423057626388295
Energy: 1.1541503333194059
Energy: 1.2150402543349723
Energy: 1.199429924876408
Energy: 1.1954749859779807
Energy: 1.1895151228935457
Energy: 1.1406102082418064
Energy: 1.1308011366954989
Energy: 1.138871176113735
Energy: 1.084752175700106
Energy: 1.1635698374813381
Energy: 1.1184125021046654
Energy: 1.0897199638189707
Energy: 1.0566685472204604
Energy: 1.1146554085627198
Energy: 1.1287798184607236
Energy: 1.0842081302507376
Energy: 1.0993662413342138
Energy: 1.1135506283416123
Energy: 1.2391293898666487
Energy: 1.1200974510220179
Energy: 1.233008522632148
Energy: 1.2030146353393785
Energy: 1.1017632746187764
Energy: 1.1815105636903735
Energy: 1.1493848199760097
Energy: 1.1404348868918586
Energy: 1.1374228129222725
Energy: 1.1719918750669378
Energy: 1.1543229238044928
Energy: 1.0820222553451166
Energy: 1.0821149047229555
Energy: 1.1383262936473142
Energy: 1.1807901610848623
Energy: 1.1573483634941972
Energy: 1.1316953831149787
Energy: 1.1084471730696712
Energy: 1.0702576874609977
Energy: 1.0993144349943114
Energy: 1.1568548681366004
Energy: 1.1785450445563714
Energy: 1.2057771928333987
Energy: 1.2033947759374173
Energy: 1.0849635967885523
Energy: 1.1882016340955823
Energy: 1.1702379330950563
Energy: 1.2124577899549311
Energy: 1.1164193847953527
Energy: 1.129997526298949
Energy: 1.1442419125974312
Energy: 1.1373888296372188
Energy: 1.1523093549477506
Energy: 1.1545721859342741
Energy: 1.16674649210808
Energy: 1.1092669794135415
Energy: 1.0826103246139651
Energy: 1.144485567282303
Energy: 1.1309407748797602
Energy: 1.1189693648503793
Energy: 1.077150091625272
Energy: 1.1586638124219382
Energy: 1.2164990241390037
Energy: 1.1125330869313594
Energy: 1.167292204777783
Energy: 1.2157556360043802
Energy: 1.1549636145830249
Energy: 1.2046430358757882
Energy: 1.1705790576493116
Energy: 1.195067684503767
Energy: 1.1194427267283844
Energy: 1.1951235020555515
Energy: 1.1187288592726043
Energy: 1.1082050211905117
Energy: 1.1782036443387949
Energy: 1.1491185067429446

minimum gb energy = 1.0566685472204604 eV
minimum distance =  2.29956268524952 Angstroms
sigma value = 39


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

Energy: 1.0264851961999937
Energy: 1.0753470885357101
Energy: 1.2673583540536209
Energy: 1.045458730459271
Energy: 1.1617589467918799
Energy: 1.1238140526177594
Energy: 1.0616906122157541
Energy: 1.0047699434286756
Energy: 1.1565553675711853
Energy: 1.1046497469404566
Energy: 1.0524765213017964
Energy: 0.9921225561465784
Energy: 1.0620611394091235
Energy: 1.0946214535551777
Energy: 1.3031944697412936
Energy: 0.9783454640255806
Energy: 1.1076588430022902
Energy: 1.0085473436500456
Energy: 1.0259969592037839
Energy: 1.0588964489882737
Energy: 1.1136322803702787
Energy: 1.0534845309747922
Energy: 1.0156594021522858
Energy: 1.0920694368752315
Energy: 1.0281221700971568
Energy: 1.0809384260316588
Energy: 1.1020715921558901
Energy: 1.2266529119992282
Energy: 1.072448436982828
Energy: 1.0526383805361692
Energy: 1.0533727852802202
Energy: 1.062370713630146
Energy: 1.2359506628209433
Energy: 1.1236767526588218
Energy: 1.0692063629918414
Energy: 1.0037849510304515
Energy: 1.0239068187288511
Energy: 1.065326435179302
Energy: 1.1527264271862099
Energy: 1.077958094258679
Energy: 1.0676682319660051
Energy: 1.1642316430771922
Energy: 1.2692520141576495
Energy: 1.0768890989995155
Energy: 1.0406537980258268
Energy: 1.2337236265536142
Energy: 1.0094284352665976
Energy: 1.008319336782103
Energy: 1.2157127637170808
Energy: 1.0224408261155224
Energy: 1.0750525042892287
Energy: 1.2077974959041418
Energy: 0.9794841930533205
Energy: 1.1366387153889566
Energy: 1.124350551133552
Energy: 1.1733866706290843
Energy: 1.0044283489565213
Energy: 1.0754717041831467
Energy: 1.2466832899339546
Energy: 0.9789983250517307
Energy: 1.1156744502446825
Energy: 1.1846342834916657
Energy: 1.1726320402366168
Energy: 1.2699921070430629
Energy: 1.1330345334493752
Energy: 1.101053961200915
Energy: 1.0171246212370784
Energy: 1.0309214483586284
Energy: 1.0700641749785436
Energy: 1.230890612910563
Energy: 1.0490789788616792
Energy: 1.0304945218464494
Energy: 1.091436892105175
Energy: 0.9795198344915226
Energy: 1.0397481045933243
Energy: 1.0653109064497375
Energy: 1.193599379879565
Energy: 1.0650282754117382
Energy: 0.992431820960621
Energy: 1.053303032050392
Energy: 1.0689899415787598
Energy: 1.0607001880651463
Energy: 1.1063033534702875
Energy: 1.1108736170197255
Energy: 1.0064367474037639
Energy: 1.0401969267883733
Energy: 1.2115525736857167
Energy: 1.1423036008536476
Energy: 1.1287900579696424
Energy: 1.128329211243809
Energy: 1.0759607953721706
Energy: 1.261847341100275
Energy: 1.07060149934499
Energy: 1.2921243533376905
Energy: 1.1846047177325618
Energy: 1.0077385547458528
Energy: 1.0196797378591087
Energy: 1.229804289593225
Energy: 1.0049390109473861
Energy: 1.0840812555574355
Energy: 1.047984162579149
Energy: 1.151540071035393
Energy: 1.007738304648765
Energy: 0.9909791344686332
Energy: 1.1544410117595947
Energy: 1.026581344648151
Energy: 1.0283819607019102
Energy: 1.2585547562220356
Energy: 1.0442456565723808
Energy: 1.1380206650493203
Energy: 1.1205369732499808
Energy: 1.075435187076031
Energy: 1.0550892412451347
Energy: 1.1557258982377896
Energy: 1.1034565637258746
Energy: 1.053015159742597
Energy: 0.9917604436155149
Energy: 1.0614446313293455
Energy: 1.1552819953066638
Energy: 1.2451998208804944
Energy: 0.9783028576390769
Energy: 1.1073467266040358
Energy: 1.0088697790054955
Energy: 1.026097484483413
Energy: 1.0593011236272296
Energy: 1.1209542411994609
Energy: 1.0531010206121993
Energy: 1.0166032004014385
Energy: 1.0922428508582016
Energy: 1.0281671262608452
Energy: 1.0813416666617315
Energy: 1.102208833232291
Energy: 1.2267512438177777
Energy: 1.0723792444220699
Energy: 1.0524012395501698
Energy: 1.1094324092749084
Energy: 1.0630990421025013
Energy: 1.075834969968479
Energy: 1.1214639096669152
Energy: 1.0692395141681534
Energy: 1.0044230923808883
Energy: 1.046075473681019
Energy: 1.0650965807241257
Energy: 1.1529932203596376
Energy: 1.077260362403159
Energy: 1.00190921667886
Energy: 1.1640759484470382
Energy: 1.2695759620301512
Energy: 1.0600986929026053
Energy: 1.0406677364049588
Energy: 1.2338282473597397
Energy: 1.0092338963824388
Energy: 1.0085135871089437
Energy: 1.2158329410529227
Energy: 1.0227483945799838
Energy: 1.0752455212719945
Energy: 1.2098691088877385
Energy: 1.073226153502223
Energy: 1.1369895605858258
Energy: 1.1243457211316914
Energy: 1.1735127620724288
Energy: 1.0007431100706097
Energy: 1.0773290963340036
Energy: 1.2467742298555575
Energy: 0.9782293418170179
Energy: 1.114568202783447
Energy: 1.1842977094742957
Energy: 1.2098288923605856
Energy: 1.2700901808130685
Energy: 1.1325186425654914
Energy: 1.1017088469447607
Energy: 1.0168646655273612
Energy: 1.0305614688226623
Energy: 1.0703139533911494
Energy: 1.2239195672256606
Energy: 1.0479418822480628
Energy: 1.0293442336049663
Energy: 1.0926808496082612
Energy: 0.9805837855116265
Energy: 1.039950790599742
Energy: 1.108145081386259
Energy: 1.2226810013986045
Energy: 1.0653111663970123
Energy: 0.9925353931044447
Energy: 1.05397019591561
Energy: 1.0702475685013926
Energy: 1.0378237148711684
Energy: 1.1050390796329213
Energy: 1.1098867487750297
Energy: 1.0048058443980343
Energy: 1.0406260826191525
Energy: 1.2122073625109648
Energy: 1.1428021649830364
Energy: 1.0686964732964852
Energy: 1.1283998418699261
Energy: 1.0765834973832344
Energy: 1.2614925310005787
Energy: 1.070687038527621
Energy: 1.2924352081737487
Energy: 1.1848281289968106
Energy: 1.0075936265333982
Energy: 1.0194238646975153
Energy: 1.230340217465205
Energy: 1.0087585513941852
Energy: 1.0839671087832994
Energy: 1.0480894659790947
Energy: 1.1531803487451315
Energy: 0.9935352134694323
Energy: 0.9911134652596298
Energy: 1.153623701992971

minimum gb energy = 0.9782293418170179 eV
minimum distance =  2.27920694081681 Angstroms
sigma value = 21


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

Energy: 1.2724750186029747
Energy: 1.265311308879097
Energy: 1.2986847448920469
Energy: 1.3442726379536096
Energy: 1.1330068071519612
Energy: 1.1704492180273613
Energy: 1.2666551606159933
Energy: 1.1837655345837825
Energy: 1.1105525655937183
Energy: 1.2937065228032738
Energy: 1.2351496645526265
Energy: 1.2696147833261338
Energy: 1.2244982719950315
Energy: 1.3460515679424259
Energy: 1.3587139750824084
Energy: 1.1711972271606865
Energy: 1.268518875843832
Energy: 1.2298080902648203
Energy: 1.2620832714909092
Energy: 1.2523102056919404
Energy: 1.172046417951156
Energy: 1.2363174098039122
Energy: 1.2194777488491024
Energy: 1.165634114933721
Energy: 1.2714186069799198
Energy: 1.1510562866977498
Energy: 1.1396856622206843
Energy: 1.1558001927567945
Energy: 1.132034626003029
Energy: 1.1340592488911228
Energy: 1.2865372622352342
Energy: 1.0836470444666482
Energy: 1.0596809920895203
Energy: 1.1881988433180228
Energy: 1.159413052727936
Energy: 1.0238254591507359
Energy: 1.067141121730785
Energy: 1.2218504731101036
Energy: 1.193809059374516
Energy: 1.1161499919028366
Energy: 1.2090050862650463
Energy: 1.103103652904438
Energy: 1.2666860650603673
Energy: 1.2157246455451594
Energy: 1.1430590365312259
Energy: 1.1821293009619822
Energy: 1.051254847457716
Energy: 1.055515633142011
Energy: 1.1216324463688678
Energy: 1.1616316078939941
Energy: 1.078515751466724
Energy: 1.2676505321460643
Energy: 1.2221244631059893
Energy: 1.1933717519834404
Energy: 1.1884788255325924
Energy: 1.109965445803826
Energy: 1.1053687628339472
Energy: 1.0851526659457869
Energy: 1.2686235385611153
Energy: 1.213321716490695
Energy: 1.2622288366328942
Energy: 1.230686458973198
Energy: 1.234000300015235
Energy: 1.2368920005182362
Energy: 1.2768827173787936
Energy: 1.1511716476875729
Energy: 1.1756260282448132
Energy: 1.0559968461380995
Energy: 1.2376913094209165
Energy: 1.2245363898724957
Energy: 1.1987955949369131
Energy: 1.1717576837446337
Energy: 1.2230689811610809
Energy: 1.1362275754230167
Energy: 1.1242474589650657
Energy: 1.129732307432236
Energy: 1.3360664315345454
Energy: 1.2607385834532339
Energy: 1.1193925004505272
Energy: 1.2112338502222815
Energy: 1.377397195788995
Energy: 1.2509111390774328
Energy: 1.2505436919253448
Energy: 1.1835988737877043
Energy: 1.2445466448774234
Energy: 1.2032949346967117
Energy: 1.1386601019425286
Energy: 1.2069277737926114
Energy: 1.18794819129174
Energy: 1.204628471753417
Energy: 1.1984755205613447
Energy: 1.1310581063610095
Energy: 1.15509431257338
Energy: 1.1814402094496053
Energy: 1.2121285247018476
Energy: 1.2455450991753567
Energy: 1.2601097182425387
Energy: 1.2265810631586453
Energy: 1.241951973077316
Energy: 1.1754635316377424
Energy: 1.1667830358055207
Energy: 1.2443495318597741
Energy: 1.258975939659728
Energy: 1.2547838503454551
Energy: 1.1574211277013915
Energy: 1.3432907658940105
Energy: 1.2349838091330114
Energy: 1.1445150634924892
Energy: 1.2114325191940656
Energy: 1.160271467358221
Energy: 1.111372871198712
Energy: 1.2532928927843623
Energy: 1.1797532225374496
Energy: 1.1151571940685703
Energy: 1.1958494477152846
Energy: 1.0809116058548602
Energy: 1.052652002680676
Energy: 1.2381618980490046
Energy: 1.1683746505181443
Energy: 1.0264453602156267
Energy: 1.064853296220101
Energy: 1.1645523885512812
Energy: 1.2237510057381495
Energy: 1.3297720581366441
Energy: 1.2428270340985728
Energy: 1.0726615983788403
Energy: 1.1314984657625424
Energy: 1.0560534758296174
Energy: 1.2529307282880557
Energy: 1.098869812713392
Energy: 1.0378624193056072
Energy: 1.1057277086424928
Energy: 1.0674031229080212
Energy: 1.2519131677929407
Energy: 1.0742317643833295
Energy: 1.221119531274688
Energy: 1.1664085481391708
Energy: 1.1137166637315545
Energy: 1.1647071718973963
Energy: 1.0630735514232827
Energy: 1.1044207519117253
Energy: 1.092636027770578
Energy: 1.2712813038742652
Energy: 1.2197126848279893
Energy: 1.2560639188893714
Energy: 1.2559231456160496
Energy: 1.182250555042626
Energy: 1.1903237572026448
Energy: 1.2420751061899742
Energy: 1.1192565235499485
Energy: 1.1724588089024843
Energy: 1.1864204853613538
Energy: 1.2616637254126275
Energy: 1.3171228115593157
Energy: 1.2190163290835774
Energy: 1.1590176550685563
Energy: 1.1618124969105983
Energy: 1.2819862820127594
Energy: 1.1625254418847
Energy: 1.2211596395886022
Energy: 1.2489185483594705
Energy: 1.2379591328914774
Energy: 1.3790667488692858
Energy: 1.1654324680440185
Energy: 1.3918126747155786
Energy: 1.3021851034745966
Energy: 1.2534420984623267
Energy: 1.2815997887916897
Energy: 1.131476339480631
Energy: 1.1739045796125185
Energy: 1.2311273146787085
Energy: 1.225407008055948
Energy: 1.1647744937555327
Energy: 1.1147563368755806
Energy: 1.303123871052154

minimum gb energy = 1.0238254591507359 eV
minimum distance =  2.27794399790526 Angstroms
sigma value = 113


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

Energy: 1.3205316620829595
Energy: 1.4259069722171434
Energy: 1.2978022291640767
Energy: 1.3307730693624675
Energy: 1.2862644668795147
Energy: 1.2720012973173473
Energy: 1.4194751632942277
Energy: 1.3520958769223497
Energy: 1.285214461997578
Energy: 1.3026525101669586
Energy: 1.3341634286934507
Energy: 1.272018317877923
Energy: 1.3238227098218254
Energy: 1.3224553912533386
Energy: 1.3810943605974764
Energy: 1.309407443401597
Energy: 1.2431397702652354
Energy: 1.2789884427460696
Energy: 1.2917893373542764
Energy: 1.2674136383921488
Energy: 1.295867382361942
Energy: 1.2091258624217265
Energy: 1.389711257614332
Energy: 1.2408655395721517
Energy: 1.2829702673592975
Energy: 1.2531693051319903
Energy: 1.2302865154589837
Energy: 1.2775595410976914
Energy: 1.2060969572218525
Energy: 1.3029421022335728
Energy: 1.3513014809546184
Energy: 1.2694095949937436
Energy: 1.279198466152013
Energy: 1.3226374852215819
Energy: 1.2493232036912585
Energy: 1.1350685198986203
Energy: 1.234470898995912
Energy: 1.234333953846374
Energy: 1.2559109176359324
Energy: 1.2124667547692551
Energy: 1.1893427054829127
Energy: 1.2378972749621442
Energy: 1.301329429073072
Energy: 1.213721127820684
Energy: 1.2920959090077557
Energy: 1.1730502547840547
Energy: 1.2076834586234193
Energy: 1.322235741043561
Energy: 1.3175020468165908
Energy: 1.3282796610699559
Energy: 1.0947576050143089
Energy: 1.2119082229914664
Energy: 1.2453282641911483
Energy: 1.2876485691328468
Energy: 1.2651988854857412
Energy: 1.1184255178328995
Energy: 1.1919891072289615
Energy: 1.2097628529557267
Energy: 1.2646938278021291
Energy: 1.2697346134603178
Energy: 1.2173868113729767
Energy: 1.236894749047337
Energy: 1.2684624329118759
Energy: 1.2014599233573542
Energy: 1.2426945640809428
Energy: 1.2826653528092222
Energy: 1.2217245436542563
Energy: 1.2341377136059175
Energy: 1.26451041661962
Energy: 1.1921356043950353
Energy: 1.2702496513937815
Energy: 1.1897674166212402
Energy: 1.2662001099029312
Energy: 1.1603529510181965
Energy: 1.133173537055032
Energy: 1.1762967084032243
Energy: 1.1839469263316786
Energy: 1.2306316331236555
Energy: 1.3728489863117677
Energy: 1.2293848082996077
Energy: 1.2067605419816994
Energy: 1.2043878277631113
Energy: 1.2244219952725806
Energy: 1.3292893058574948
Energy: 1.338727037966527
Energy: 1.1044811969911876
Energy: 1.2116548326199896
Energy: 1.2053174286009358
Energy: 1.229808936520284
Energy: 1.2339835225643156
Energy: 1.1065514458607368
Energy: 1.2351413627634096
Energy: 1.2152923634185313
Energy: 1.251216418881217
Energy: 1.1939726226750522
Energy: 1.1403511801517963
Energy: 1.2722199714510352
Energy: 1.2773835936719216
Energy: 1.1401075690682916
Energy: 1.2269881918765697
Energy: 1.2366603535409912
Energy: 1.1870183477865324
Energy: 1.2305408995976248
Energy: 1.2639813161762907
Energy: 1.1961037747378815
Energy: 1.2060788170839165
Energy: 1.196820273752178
Energy: 1.33640975035909
Energy: 1.2319612670156808
Energy: 1.2879023804321355
Energy: 1.265628633617309
Energy: 1.1940916701550548
Energy: 1.2193996001882634
Energy: 1.3596293916938575
Energy: 1.254141584351205
Energy: 1.2513719994117798
Energy: 1.199289486352966
Energy: 1.2580729221691753
Energy: 1.338196431970099
Energy: 1.27423190704264
Energy: 1.2849856755201465
Energy: 1.2417599252939355
Energy: 1.2258218446460882
Energy: 1.204757951383443
Energy: 1.2499263315931555
Energy: 1.223229167121188
Energy: 1.2892093536259723
Energy: 1.3321649988623188
Energy: 1.3228697019160545
Energy: 1.3188626602606663
Energy: 1.335630060048546
Energy: 1.3960761250637224
Energy: 1.3333109697625403
Energy: 1.2691275219795752
Energy: 1.2883618800277579
Energy: 1.2676279837753552
Energy: 1.2755108532680115
Energy: 1.2652955081452217
Energy: 1.2737333321423503
Energy: 1.3216932254712346
Energy: 1.337786907054592
Energy: 1.2888869430295002
Energy: 1.285713163924958
Energy: 1.3532982740732336
Energy: 1.3271887089742187
Energy: 1.253436440028688
Energy: 1.329171867950522
Energy: 1.317231106992028
Energy: 1.345670887479408
Energy: 1.2611935290351968
Energy: 1.3541719157319216
Energy: 1.2705415998739213
Energy: 1.2294474046164945
Energy: 1.3066208467671436
Energy: 1.2861869821746212
Energy: 1.3370465337052702
Energy: 1.2823794252503777
Energy: 1.278225836500866
Energy: 1.286507149760338
Energy: 1.271566680127592
Energy: 1.257031757022789
Energy: 1.3102006875572672
Energy: 1.364529552555996
Energy: 1.275427729482433
Energy: 1.3098740770202442
Energy: 1.3600598664523258
Energy: 1.343588517892272
Energy: 1.3002126598711021
Energy: 1.3017885082923613
Energy: 1.252783053344575
Energy: 1.237394722084589
Energy: 1.2724372405790407
Energy: 1.2370663560221515
Energy: 1.272081650899951
Energy: 1.2214329672008784
Energy: 1.1880040266020973
Energy: 1.366304619538839
Energy: 1.25358488827082
Energy: 1.2440217944233232
Energy: 1.2582690150680202
Energy: 1.2317902677675354
Energy: 1.3354183428082511
Energy: 1.2104029387168829
Energy: 1.3120385522782967
Energy: 1.355905911873581
Energy: 1.2744876080889755
Energy: 1.3033336782011793
Energy: 1.313807190839633
Energy: 1.2495321674773607
Energy: 1.1323598179097099
Energy: 1.292006697969008
Energy: 1.2395226865341822
Energy: 1.2580437143074064
Energy: 1.2117713583168725
Energy: 1.2515232838029648
Energy: 1.2231740730405831
Energy: 1.293704437326285
Energy: 1.236799125520752
Energy: 1.2215438783870212
Energy: 1.1702273993678076
Energy: 1.1682050125706713
Energy: 1.2768963667340052
Energy: 1.308507694432489
Energy: 1.3176035014510026
Energy: 1.097290670212894
Energy: 1.2162162160255816
Energy: 1.24554349949048
Energy: 1.2534519514472062
Energy: 1.226097250262873
Energy: 1.115368626398147
Energy: 1.17969766112914
Energy: 1.2186978008491296
Energy: 1.242798582698471
Energy: 1.2326315707659563
Energy: 1.2103406053812709
Energy: 1.2179839348982908
Energy: 1.2607862893363926
Energy: 1.2720033478410742
Energy: 1.20225037806424
Energy: 1.2764124499161906
Energy: 1.2193211854186228
Energy: 1.2161238928197184
Energy: 1.203125363102245
Energy: 1.201806741458779
Energy: 1.2666402069635616
Energy: 1.1793217501352942
Energy: 1.2544533844973904
Energy: 1.286174443635775
Energy: 1.0966761180268343
Energy: 1.1733138171009845
Energy: 1.1804205151573632
Energy: 1.2463296962091985
Energy: 1.256301038516084
Energy: 1.2307361344319907
Energy: 1.2034751317378054
Energy: 1.190629394294443
Energy: 1.2233667838249502
Energy: 1.2813257178063038
Energy: 1.3333706904582514
Energy: 1.1045081702854913
Energy: 1.226182762833191
Energy: 1.210095782476848
Energy: 1.2317624173367359
Energy: 1.2047797077221651
Energy: 1.1005131743023588
Energy: 1.2586338211253807
Energy: 1.2154569561799997
Energy: 1.2493334407895542
Energy: 1.1759819623644725
Energy: 1.125260412313816
Energy: 1.2595993657169757
Energy: 1.2740545701126824
Energy: 1.1522808375410967
Energy: 1.2485282309034118
Energy: 1.2373451944660656
Energy: 1.1985672986674258
Energy: 1.2014981775479021
Energy: 1.1925298990345277
Energy: 1.2408516788081259
Energy: 1.2042315271573532
Energy: 1.237498362931995
Energy: 1.3338559332376847
Energy: 1.2177215462307671
Energy: 1.2868419403698705
Energy: 1.2936290152002927
Energy: 1.2101587913842005
Energy: 1.2466799404417164
Energy: 1.3342470835339337
Energy: 1.2560110358256702
Energy: 1.2482187653290318
Energy: 1.2085797012603914
Energy: 1.1934043392290838
Energy: 1.3818361898856528
Energy: 1.2836961811818894
Energy: 1.2712570061468649
Energy: 1.230130179172381
Energy: 1.223995255067034
Energy: 1.2747990944970133
Energy: 1.2284303304151718
Energy: 1.1972240263064924
Energy: 1.2900325549216036
Energy: 1.316135785307854
Energy: 1.3054405023604314
Energy: 1.315374436658464
Energy: 1.361669155191566
Energy: 1.3712476444175958
Energy: 1.262055735212189
Energy: 1.2556810158484648
Energy: 1.2936754026391117
Energy: 1.2311623359005501
Energy: 1.275949177204037
Energy: 1.2708340153166104
Energy: 1.272232791766705
Energy: 1.3385228524350952
Energy: 1.3299792325628643
Energy: 1.386860277303375
Energy: 1.2934864306513636
Energy: 1.3238458157708213
Energy: 1.3068927903190914
Energy: 1.2271234014603971
Energy: 1.3146811223279131
Energy: 1.3617832563623093
Energy: 1.2832786780265788
Energy: 1.3180439744473427
Energy: 1.379796531490472
Energy: 1.2945468616942994
Energy: 1.1909548376786931
Energy: 1.2857044354780882
Energy: 1.307569875734105
Energy: 1.3071528389933649
Energy: 1.2999911031867302
Energy: 1.3240196861857247
Energy: 1.269224677876306
Energy: 1.289821883317579
Energy: 1.332186766891247

minimum gb energy = 1.0947576050143089 eV
minimum distance =  2.22449980727524 Angstroms
sigma value = 365


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

Energy: 1.0984906792606917
Energy: 1.0680363065647394
Energy: 1.0719129406062116
Energy: 1.0723195797298692
Energy: 1.0721663419146323
Energy: 1.0710654578185863
Energy: 1.0685439177792249
Energy: 1.0555997488264663
Energy: 1.224002555231385
Energy: 1.04422585476139
Energy: 1.0460897146268984
Energy: 1.0464501064067757
Energy: 1.0460314071654193
Energy: 1.2264510058576097
Energy: 1.112723309567086
Energy: 1.2549291311572266
Energy: 1.0444816455091035
Energy: 1.0448076073233568
Energy: 1.0449552871095875
Energy: 1.0464891956372402
Energy: 1.0460940727533965
Energy: 1.1118124465436992
Energy: 1.2558912184123934
Energy: 1.0839592042211257
Energy: 1.0452692588160477
Energy: 1.0461604839475598
Energy: 1.0448957099273373
Energy: 1.0713091943817408
Energy: 1.0567222770511593
Energy: 1.225558256424956
Energy: 1.0091186520831836
Energy: 1.2254465050174739
Energy: 1.0456631890378918
Energy: 1.012256076054911
Energy: 1.2253250509723852
Energy: 1.1123290802069847
Energy: 1.2563821212131394
Energy: 1.0838512408865117
Energy: 1.0450184412785837
Energy: 1.0462638919951728
Energy: 1.0830246294975485
Energy: 1.069637369406742
Energy: 1.116373781609635
Energy: 1.2258660800902863
Energy: 1.0443419709870254
Energy: 1.0450567238928115
Energy: 1.0459439243388984
Energy: 1.0462094225285123
Energy: 1.2246927479454641
Energy: 1.1156715309934575
Energy: 1.2260140971298
Energy: 1.0441041347021627
Energy: 1.0449151848443297
Energy: 1.045311547655461
Energy: 1.046477318879577
Energy: 1.2265671641753562
Energy: 1.112051346632738
Energy: 1.255738284660521
Energy: 1.0839725385363408
Energy: 1.0468117129345553
Energy: 1.045963226296401
Energy: 1.083153137908756
Energy: 1.0698826173620994
Energy: 1.0564320321520666
Energy: 1.2298489324126125
Energy: 1.0094220060977561
Energy: 1.2261893212607542
Energy: 1.2303683260661495
Energy: 1.0121322940897097
Energy: 1.224256129757461
Energy: 1.1116836581399558
Energy: 1.255562280898921
Energy: 1.0837256065243177
Energy: 1.0464784411672594
Energy: 1.0470177115827881
Energy: 1.083316628217378
Energy: 1.0710605403520195
Energy: 1.1148071573721863
Energy: 1.2292888201930936
Energy: 1.0446044414570648
Energy: 1.0452752813053934
Energy: 1.0451738254516516
Energy: 1.0470976881555598
Energy: 1.2260540375214977
Energy: 1.1163455051996127
Energy: 1.2242526514163876
Energy: 1.0447269904028733
Energy: 1.0460539675219798
Energy: 1.0456787239396608
Energy: 1.0446956909582694
Energy: 1.2301588285073142
Energy: 1.1133154798996345
Energy: 1.2327837780600552
Energy: 1.0712077952464043
Energy: 1.0463403889650784
Energy: 1.0720590919789994
Energy: 1.0729885764247244
Energy: 1.0738940297806168
Energy: 1.0560805451156505
Energy: 1.2246224105488757
Energy: 1.0091255469374103
Energy: 1.0451459757694406
Energy: 1.0472825216301482
Energy: 1.0462088395667006
Energy: 1.225662232628052
Energy: 1.1120645108439704
Energy: 1.2558981609339046
Energy: 1.0840190689097449
Energy: 1.0454816007077548
Energy: 1.0454660687540918
Energy: 1.0461317725424417
Energy: 1.0685034735684233
Energy: 1.112494749209348
Energy: 1.2549972125157127
Energy: 1.0841591118756293
Energy: 1.0451137568928215
Energy: 1.0459404379517778
Energy: 1.0467661370450934
Energy: 1.0473361933733267
Energy: 1.055772742633778
Energy: 1.2251782758219028
Energy: 1.0442715699576262
Energy: 1.0464715250934369
Energy: 1.0472927508105305
Energy: 1.0446450694378235
Energy: 1.2246925030996243
Energy: 1.0992524415693643
Energy: 1.2308182673742005
Energy: 1.0714520745080238
Energy: 1.0451743327561065
Energy: 1.0719829987355682
Energy: 1.0712397427007572
Energy: 1.0694401955529673
Energy: 1.112736308203924
Energy: 1.2309543129975593
Energy: 1.044497099273078
Energy: 1.0459318453965487
Energy: 1.0462450467289044
Energy: 1.046166688089615
Energy: 1.224064600078032

minimum gb energy = 1.0091186520831836 eV
minimum distance =  2.25750091385301 Angstroms
sigma value = 23