Model name: model_name=MEAM_LAMMPS_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.611098513007164
cohesive_energy=4.242432836277799
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
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: 0.018592703358956516
Energy: 0.3262817306176873
Energy: 0.3262817306176873
Energy: 0.018592703358956516
Energy: 0.3262817306176873
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Energy: 0.3262817306176873
Energy: 0.01859270336040515
Energy: 0.3229015469041498
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Energy: 0.32277060829860826
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Energy: 0.022650505527773472
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Energy: 0.3227707310652331
Energy: 0.3229015469041498
Energy: 0.3586150155924439
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Energy: 0.2711175707731884
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Energy: 0.3262817306176873
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Energy: 0.01859270336040515
Energy: 0.3262817306176873
Energy: 0.3262817306176873
Energy: 0.018592703358956516
Energy: 0.3262817306176873
Energy: 0.3262817306176873
Energy: 0.01859270336040515
Energy: 0.3229015469041498
Energy: 0.022650505527773472
Energy: 0.3227707181853125
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Energy: 0.022650505527773472
Energy: 0.3227705379391857
Energy: 0.3229015469041498
Energy: 0.022650505527773472
Energy: 0.3227707908760183
Energy: 0.3229015469041498
Energy: 0.8065582755968327
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Energy: 0.1933652476802081
Energy: 0.8065465480864132
Energy: 0.019056904327232994
Energy: 0.1933652476802081
Energy: 0.8065652950674751
Energy: 0.019056904327232994
Energy: 0.5186043273529788
Energy: 0.806563477536838

minimum gb energy = 0.018592703358956516 eV
minimum distance =  2.30659126037202 Angstroms
sigma value = 3


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

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Energy: -0.7004167491427157

minimum gb energy = -1.0183704571029424 eV
minimum distance =  2.37694928896118 Angstroms
sigma value = 75


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

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minimum gb energy = 0.6407947972544428 eV
minimum distance =  2.23392798428977 Angstroms
sigma value = 105


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

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Energy: 0.2119934832841178
Energy: 0.06584637168746871
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Energy: 0.6202675883083105
Energy: -0.14104115197251835
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Energy: 0.620267588310264
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Energy: 0.6202675883063572
Energy: -0.14104345798568602
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Energy: 0.6202675883063572
Energy: 0.8745223091000558
Energy: 0.7251416141307316
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Energy: 0.8745223091020091
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Energy: 0.8745223091039624
Energy: 0.7251416141287782
Energy: 0.8381447865410757
Energy: 0.8745223091020091
Energy: 0.7024184236508104
Energy: 0.7035548093971606
Energy: 0.24861704086971378
Energy: 0.7024184236488571
Energy: 0.7035548093971606
Energy: 0.2486170408658071
Energy: 0.7024184236371726
Energy: 0.7035548093971606
Energy: 0.24861704086385372
Energy: 0.7024184236352192
Energy: 0.1401462374421313
Energy: 0.854597666281039
Energy: 0.7576079124770991
Energy: 0.1401463150021696
Energy: 0.8542919568658259
Energy: 0.7576079124770991
Energy: 0.1401464275153848
Energy: 0.8545976662771322
Energy: 0.7576079124810059
Energy: 0.14014629530170322
Energy: 0.2364900979942409
Energy: 0.12084229708028278
Energy: 0.8212880804313114
Energy: 0.23649009661969306
Energy: 0.06605801067425794
Energy: 0.821288080429358
Energy: 0.23649009932972184
Energy: 0.12084229704316932
Energy: 0.821288080429358
Energy: 0.23649009374760818
Energy: 0.014155151023722898
Energy: -0.24977365287626307
Energy: 0.00651321145183299
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Energy: -0.24986245857315215
Energy: 0.006513211445972969
Energy: 0.014155151025676235
Energy: -0.24977365323745346
Energy: 0.006513211447926309
Energy: 0.014155151025676235

minimum gb energy = -0.2517017704505232 eV
minimum distance =  2.38144794088485 Angstroms
sigma value = 165


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

Energy: 0.9897132228069541
Energy: 0.8978233648313314
Energy: 0.894234777149066
Energy: 0.9321174487783628
Energy: 0.8978231759716492
Energy: 0.8942347771497365
Energy: 0.9897132228076246
Energy: 0.8978234357500483
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Energy: 0.9321174487790336
Energy: 0.9200784781899893
Energy: 0.9080342692999203
Energy: 0.906465854768381
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Energy: 0.9080342693012613
Energy: 0.9064658547690514
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Energy: 0.9080342693012613
Energy: 0.9064658547710632
Energy: 0.9200784781893189
Energy: 0.8778334866649179
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Energy: 0.8977970585156672
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Energy: 0.8925453433550726
Energy: 0.8971198048166862
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Energy: 0.9025190740168454
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Energy: 0.8958570922706599
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Energy: 0.9079730397371787
Energy: 0.9514115227342882
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Energy: 0.9341726822878439
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Energy: 0.8886212429710997
Energy: 0.8995330294641031
Energy: 0.9514115227309963
Energy: 0.8886212429684173
Energy: 0.934172682285893
Energy: 0.8871453313948114
Energy: 0.9200216399058623
Energy: 0.9079407661254887
Energy: 0.8758336922093589
Energy: 0.9200216399072034
Energy: 0.907940766124818
Energy: 0.8758336922093589
Energy: 0.9200216399072034
Energy: 0.907940766124818
Energy: 0.8758336922100294
Energy: 0.9200216399072034
Energy: 0.9030558945468015
Energy: 0.8962963664288902
Energy: 0.8923968869105658
Energy: 0.9030558945468015
Energy: 0.8962963664295608
Energy: 0.8923968867959563
Energy: 0.903055894547472
Energy: 0.8962963664282197
Energy: 0.8923968868917893
Energy: 0.903055894547472
Energy: 0.8972058963748466
Energy: 0.9276156988883915
Energy: 0.9081617901300961
Energy: 0.8972058963755172
Energy: 0.92761569899026
Energy: 0.9081617901294256
Energy: 0.8972058963755172
Energy: 0.9276156990720716
Energy: 0.9081617901287551
Energy: 0.8972058963748466
Energy: 0.932117448779704
Energy: 0.8978229759207659
Energy: 0.8942347771477248
Energy: 0.9321174487783628
Energy: 0.8978231534270863
Energy: 0.8942347771483954
Energy: 0.932117448779704
Energy: 0.8978232046037501
Energy: 0.8942347771483954
Energy: 0.9321174487783628

minimum gb energy = 0.8528281193793745 eV
minimum distance =  2.36120634225071 Angstroms
sigma value = 41


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

Energy: 0.7432797538798616
Energy: 0.7441070918778835
Energy: 0.7226173156445985
Energy: 0.718981562673267
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Energy: 0.8200508878305869
Energy: 0.681487630500508
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Energy: 0.681487630500508
Energy: 0.6615675001642818
Energy: 0.8200508878305869
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Energy: 0.6615675001564763
Energy: 0.698238911789241
Energy: 0.6878570260566953
Energy: 0.6631141681027645
Energy: 0.6982389117918427
Energy: 0.6878570260566953
Energy: 0.6631141681001627
Energy: 0.6982389117918427
Energy: 0.6878570260592972
Energy: 0.6631141681053663
Energy: 0.6982389117918427
Energy: 0.7136918341875125
Energy: 0.8848495732852201
Energy: 0.6704927205910989
Energy: 0.7136918341875125
Energy: 0.8848495732826183
Energy: 0.6704927205910989
Energy: 0.7136918341875125
Energy: 0.8848495732826183
Energy: 0.6704927205910989
Energy: 0.7136918341901143
Energy: 0.769740985661465
Energy: 0.7603779696591195
Energy: 0.7579275082134854
Energy: 0.6676045811604958
Energy: 0.7603779696617213
Energy: 0.7579275082108835
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Energy: 0.7603779696617213
Energy: 0.7579275082082817
Energy: 0.667604581157894
Energy: 0.7432975027362961
Energy: 0.6610566871546718
Energy: 0.7162056590885807
Energy: 0.7432975027362961
Energy: 0.6610566871572736
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Energy: 0.7432975027336943
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Energy: 0.7006330106898796
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Energy: 0.7668809140253422
Energy: 0.7381157351149367
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Energy: 0.7381157351175384
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Energy: 0.6804871510329848
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Energy: 0.7323150849134946
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Energy: 0.7323150849160964
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Energy: 0.742849416030527
Energy: 0.6714295015951276
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Energy: 0.6714295015951276
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Energy: 0.7428494160331289
Energy: 0.6714295015977295
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Energy: 0.7042659812088823
Energy: 0.6650720592046989
Energy: 0.7058820739520156
Energy: 0.704265981203726
Energy: 0.6650720592073007
Energy: 0.7058820739494138
Energy: 0.704265981203726
Energy: 0.6650720592046989
Energy: 0.7058820739494138
Energy: 0.7549283071479663
Energy: 0.6648562750764092
Energy: 0.7180195180891923
Energy: 0.7549283071479663
Energy: 0.6648562750764092
Energy: 0.7180195180865905
Energy: 0.7549283071505681
Energy: 0.664856275079011
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Energy: 0.7549283071505681
Energy: 0.7281629497488836
Energy: 0.7232340334090138
Energy: 0.7270127306917662
Energy: 0.7281629497540401
Energy: 0.7232340334116156
Energy: 0.7284116131051276
Energy: 0.7281629497540401
Energy: 0.7232340334116156
Energy: 0.7270127306891645
Energy: 0.7281629497514382
Energy: 0.6622174899424403
Energy: 0.7946803122426066
Energy: 0.7562823804776656
Energy: 0.6622174899450421
Energy: 0.8076943572815466
Energy: 0.759302051565632
Energy: 0.6622174899450421
Energy: 0.7946803122426066
Energy: 0.7562823804750638
Energy: 0.6622174899424403
Energy: 0.6666498648983896
Energy: 0.69670250007049
Energy: 0.6987822428154628
Energy: 0.6666498648957878
Energy: 0.6964161299575857
Energy: 0.6985399752969815
Energy: 0.6666498648983896
Energy: 0.69670250007049
Energy: 0.6987822428128609
Energy: 0.6666498649009914
Energy: 0.6879514880699642
Energy: 0.7042895195897104
Energy: 0.7356684604422177
Energy: 0.6879514880699642
Energy: 0.704307577106876
Energy: 0.7356684604422177
Energy: 0.6879514880699642
Energy: 0.7042895195897104
Energy: 0.7356684604396159
Energy: 0.6879514880673624
Energy: 0.4966257384925954
Energy: 0.6990656865233902
Energy: 0.7366292967157957
Energy: 0.4966257384925954
Energy: 0.6996868298118822
Energy: 0.7366292967131939
Energy: 0.4966257384925954
Energy: 0.6990656865207884
Energy: 0.7366292967157957
Energy: 0.4966257384925954
Energy: 0.6926241572950912
Energy: 0.772575731664018
Energy: 0.7009530371802494
Energy: 0.6926241572924893
Energy: 0.7725757316666199
Energy: 0.7009530371802494
Energy: 0.6926241572924893
Energy: 0.7725757316666199
Energy: 0.7009530371776477
Energy: 0.692624157297693

minimum gb energy = 0.24252388519273063 eV
minimum distance =  2.36563224398984 Angstroms
sigma value = 185


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

Energy: 1.0151480049520367
Energy: 0.33371519235176184
Energy: 0.33290792921847895
Energy: 0.3892286741879726
Energy: 0.33371519235271646
Energy: 0.33290792922005125
Energy: 1.0151480049548445
Energy: 0.33371519235148106
Energy: 0.3329079292188159
Energy: 0.3892286741879726
Energy: 0.7539440560417617
Energy: 0.33244224712002796
Energy: 0.4818898862038602
Energy: 0.6077813942388341
Energy: 0.33244224712277953
Energy: 0.5496374860097638
Energy: 0.7539440560432779
Energy: 0.33244224712064563
Energy: 0.4818898862022879
Energy: 0.6077813942400694
Energy: 0.5177181298028295
Energy: 0.3327808797089581
Energy: 0.5197233157772991
Energy: 0.5342136171803681
Energy: 0.332780879707105
Energy: 0.4815887453878212
Energy: 0.5177181298013134
Energy: 0.33278087970929504
Energy: 0.5197233157810052
Energy: 0.5342136171803681
Energy: 0.7885841248783974
Energy: 0.3325962770030406
Energy: 0.6883410524546228
Energy: 0.7885841248771618
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Energy: 0.6769648665891578
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Energy: 0.7885841248774427
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Energy: 0.33085836601902585
Energy: 0.49481665278260045
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Energy: 0.3308583660177904
Energy: 0.4987424682434491
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Energy: 0.3308583660196435
Energy: 0.49481665278046655
Energy: 0.3512831968144094
Energy: 0.6503097499597837
Energy: 0.5454164893979798
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Energy: 0.5454164893979798
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Energy: 0.3504509885813941
Energy: 0.5980765305452712
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Energy: 0.5958393869215126
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Energy: 0.3504509885820118
Energy: 0.6546982352403007
Energy: 0.4814891059368976
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Energy: 0.48238956708448616
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Energy: 0.49957504309772577
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Energy: 0.6458895686425472
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Energy: 0.49957504309868034
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Energy: 0.34148979492746045
Energy: 0.4455902561937496
Energy: 0.43642136009716587
Energy: 0.4351450740106799
Energy: 0.3340108061668032
Energy: 0.5789131939520615
Energy: 0.5079691835314281
Energy: 0.3340108061646132
Energy: 0.43642136009441435
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Energy: 0.33401080616646633
Energy: 0.578913193948636
Energy: 0.6595790508763006
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Energy: 0.33201000187218677
Energy: 0.6710636616826361
Energy: 0.7469696384982278
Energy: 0.3320100018724675
Energy: 0.6595790508754021
Energy: 0.7469696384948024
Energy: 0.3320100018706144
Energy: 0.671063661688813
Energy: 0.6487595633399963
Energy: 0.3337151923499088
Energy: 0.3329079292194335
Energy: 0.6532453995631339
Energy: 0.33371519235148106
Energy: 0.3329079292194335
Energy: 0.6487595633421862
Energy: 0.33371519235237956
Energy: 0.3329079292188159
Energy: 0.6532453995621794
Energy: 0.6953057200037586
Energy: 0.332442247119691
Energy: 0.4002123713759103
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Energy: 0.5618865247987365
Energy: 0.6953057200043763
Energy: 0.332442247119691
Energy: 0.40021237137838117
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Energy: 0.33278087970929504
Energy: 0.51282614244944
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Energy: 0.4364501892635233
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Energy: 0.3327808797095758
Energy: 0.5128261424528654
Energy: 0.5791694230275112
Energy: 0.7885841248799135
Energy: 0.3325962770030406
Energy: 0.6668533250815047
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Energy: 0.3325962770027037
Energy: 0.650303973859298
Energy: 0.7885841248777795
Energy: 0.332596277002086
Energy: 0.6668533250806064
Energy: 0.788584124878678
Energy: 0.35128319681530784
Energy: 0.33085836601930657
Energy: 0.482869922414298
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Energy: 0.3308583660184081
Energy: 0.47511631248457653
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Energy: 0.3308583660199243
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Energy: 0.35128319681379166
Energy: 0.6503097499604015
Energy: 0.4301740503580289
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Energy: 0.43017405035836587
Energy: 0.6465976439622426
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Energy: 0.3504509885801587
Energy: 0.6611439698127967
Energy: 0.5893243683258821
Energy: 0.3504509885813941
Energy: 0.6172005575448971
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Energy: 0.3504509885842019
Energy: 0.6611439698136952
Energy: 0.589324368322513
Energy: 0.3504509885820118
Energy: 0.6546982352418168
Energy: 0.500103117505084
Energy: 0.3325463767306228
Energy: 0.6546982352418168
Energy: 0.49458130472960765
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Energy: 0.6546982352387282
Energy: 0.5001031175032309
Energy: 0.33254637673000514
Energy: 0.6546982352399637
Energy: 0.4301757066351798
Energy: 0.6922448863653708
Energy: 0.3414897949317844
Energy: 0.4456986240994759
Energy: 0.7027451737387042
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Energy: 0.4301757066364152
Energy: 0.6922448863653708
Energy: 0.3414897949284151
Energy: 0.4456986240976229
Energy: 0.4737064557555131
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Energy: 0.3340108061668032
Energy: 0.5342645463206104
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Energy: 0.3320100018718498
Energy: 0.6094385249934549
Energy: 1.0151480049529913
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Energy: 0.33290792922005125
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Energy: 0.33290792922005125
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Energy: 0.3892286741879726
Energy: 0.7539440560420425
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Energy: 0.4818898862047587
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Energy: 0.4818898862032425
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Energy: 0.4815887453878212
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Energy: 0.33278087970929504
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Energy: 0.788584124878678
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Energy: 0.35128319681592557
Energy: 0.33085836601902585
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Energy: 0.4987424682443476
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Energy: 0.35128319681407244
Energy: 0.6503097499600646
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Energy: 0.6123668297255306
Energy: 0.6503097499613
Energy: 0.41486852154967435
Energy: 0.6396349223261676
Energy: 0.650309749963153
Energy: 0.5454164893983168
Energy: 0.6123668297240143
Energy: 0.6503097499622545
Energy: 0.35045098857954105
Energy: 0.5980765305446534
Energy: 0.5893243682783754
Energy: 0.3504509885820118
Energy: 0.5958393869215126
Energy: 0.5893243682808461
Energy: 0.3504509885832472
Energy: 0.5980765305458888
Energy: 0.5893243682826993
Energy: 0.3504509885820118
Energy: 0.6546982352409183
Energy: 0.48148910593656064
Energy: 0.3325463767312406
Energy: 0.6546982352411991
Energy: 0.4823895670847669
Energy: 0.33254637673185833
Energy: 0.6546982352424345
Energy: 0.481489105935943
Energy: 0.33254637672966825
Energy: 0.6546982352393459
Energy: 0.49957504309806267
Energy: 0.5711268393405442
Energy: 0.34148979493116666
Energy: 0.4455902561959396
Energy: 0.6458895686428279
Energy: 0.3414897949284151
Energy: 0.4995750430955919
Energy: 0.5711268393423974
Energy: 0.3414897949280781
Energy: 0.4455902561934688
Energy: 0.43642136009963667
Energy: 0.43514507401157837
Energy: 0.33401080616708395
Energy: 0.5789131939517246
Energy: 0.5079691835308103
Energy: 0.33401080616646633
Energy: 0.4364213600993559
Energy: 0.4351450740121961
Energy: 0.3340108061661855
Energy: 0.5789131939514438
Energy: 0.659579050875683
Energy: 0.7469696384985087
Energy: 0.3320100018718498
Energy: 0.6710636616854437
Energy: 0.7469696384963748
Energy: 0.3320100018706144
Energy: 0.6595790508750653
Energy: 0.7469696384969925
Energy: 0.3320100018724675
Energy: 0.6710636616774137

minimum gb energy = 0.3308583660177904 eV
minimum distance =  2.34762933950962 Angstroms
sigma value = 33


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

Energy: 0.6177504216372389
Energy: 0.6401811298713053
Energy: 0.6400913870828202
Energy: 0.5159472798476562
Energy: 0.6401811298696097
Energy: 0.6400913870828202
Energy: 0.6177504216372389
Energy: 0.6401811298713053
Energy: 0.6400913870845156
Energy: 0.5159472798493518
Energy: 0.6366548521813439
Energy: 0.6395116148148834
Energy: 0.6297824128933142
Energy: 0.6366548521830393
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Energy: 0.6297824128933142
Energy: 0.6366548521796483
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Energy: 0.6297824128933142
Energy: 0.6366548521830393
Energy: 0.49934012489009033
Energy: 0.6272353519067483
Energy: 0.5115767325586554
Energy: 0.5017792091300538
Energy: 0.6272353519101392
Energy: 0.5266826488075356
Energy: 0.4929453594994742
Energy: 0.6272353519084437
Energy: 0.5266826488092311
Energy: 0.4929453594994742
Energy: 0.730370806406683
Energy: 0.6379731276746411
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Energy: 0.7303708064049873
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Energy: 0.502866714285749
Energy: 0.7303708064083784
Energy: 0.6233415077981473
Energy: 0.6254483689691699
Energy: 0.5304418492318155
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Energy: 0.625448368972561
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Energy: 0.6440904754150741
Energy: 0.6515010499297138
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Energy: 0.6299301242183475
Energy: 0.6368112803956778
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Energy: 0.6299301242217386
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Energy: 0.6298550889656468
Energy: 0.6305468372669785
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Energy: 0.6131478031235288
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Energy: 0.6230587053009452
Energy: 0.6131478031252243
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Energy: 0.6305468372652829
Energy: 0.6435056025553301
Energy: 0.5122853508899615
Energy: 0.28620334170167255
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Energy: 0.2862033415423572
Energy: 0.6435056025553301
Energy: 0.512285350888266
Energy: 0.2862033416406654
Energy: 0.643505602551939
Energy: 0.6381854331084263
Energy: 0.6392079100437225
Energy: 0.6570841458536267
Energy: 0.6381854331067307
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Energy: 0.6381854331101218
Energy: 0.6392079100403314
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Energy: 0.6381854331084263
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Energy: 0.6347127301638255
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Energy: 0.6276532033933105
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Energy: 0.6259932835178423
Energy: 0.6276532033967015
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Energy: 0.6260534039908248
Energy: 0.6276532033950061
Energy: 0.6390550909514023
Energy: 0.6181135211550359
Energy: 0.7087746854953464
Energy: 0.6390550909497067
Energy: 0.6344338637878992
Energy: 0.7025651161324309
Energy: 0.6390550909514023
Energy: 0.6181135211567313
Energy: 0.708774685493651
Energy: 0.6390550909530976
Energy: 0.6272524174885497
Energy: 0.5963422518459399
Energy: 0.4946286454251007
Energy: 0.627252417486854
Energy: 0.5963202940319657
Energy: 0.49527154334230605
Energy: 0.6272524174885497
Energy: 0.5963422518476355
Energy: 0.4946286454234052
Energy: 0.6272524174902451
Energy: 0.6393727078286982
Energy: 0.6988715998821708
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Energy: 0.6786522369973232
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minimum gb energy = 0.17963762834386093 eV
minimum distance =  2.35782773654218 Angstroms
sigma value = 219


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

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Energy: 1.0424786575814176
Energy: 0.9201709012531898
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Energy: 1.0424786575825395
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Energy: 1.0102014263077408
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Energy: 0.9306918609520806
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Energy: 0.9306918609520806
Energy: 0.9295554005754542
Energy: 0.9401080798939941
Energy: 0.9306918609532027

minimum gb energy = 0.9110438550727032 eV
minimum distance =  2.29627700249428 Angstroms
sigma value = 15


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

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Energy: 1.1067869751788135
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Energy: 1.0585934340015775
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Energy: 1.099486011853531
Energy: 1.134386057304948
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minimum gb energy = 1.0151614741833759 eV
minimum distance =  2.32350880250343 Angstroms
sigma value = 293


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

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Energy: 1.1508590786181048
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Energy: 0.9743404503925681
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Energy: 0.9705678462143502
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Energy: 1.1000797865592749
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Energy: 1.0893897106429395
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Energy: 1.089389710643216
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Energy: 1.2124050041414605
Energy: 1.0893398498122788
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Energy: 1.0893398498125089
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Energy: 1.0952751713577338
Energy: 1.1248374486666197
Energy: 0.9546988415552854
Energy: 1.0952751713602684
Energy: 1.1248374486686474
Energy: 0.9546988415540412
Energy: 1.0952751713577338
Energy: 1.1248374486663895
Energy: 0.9546988415557923
Energy: 1.095275171360038
Energy: 1.077132884123525
Energy: 1.1127563643892504
Energy: 1.1594851657740821
Energy: 1.0771328841217278
Energy: 1.1127563643892504
Energy: 1.1594851657735754
Energy: 1.0771328841237555
Energy: 1.112756364389481
Energy: 1.159485165773806
Energy: 1.0771328841220043
Energy: 1.1888045205811117
Energy: 1.0214742186713521
Energy: 1.036606198383656
Energy: 1.188804520582356
Energy: 1.0214742186708452
Energy: 1.03660619838467
Energy: 1.1888045205811117
Energy: 1.0214742186713521
Energy: 1.036606198383656
Energy: 1.1888045205826325
Energy: 1.0881820499815782
Energy: 1.1438982546694658
Energy: 1.0777528928544595
Energy: 1.0881820499805643
Energy: 1.1438982546694658
Energy: 1.0777528928306803
Energy: 1.0881820499815782
Energy: 1.1438982546694658
Energy: 1.0777528926107705
Energy: 1.0881820499805643
Energy: 1.0951909102274913
Energy: 0.9549905227490685
Energy: 1.111475596428292
Energy: 1.095190910227998
Energy: 0.9549905227488381
Energy: 1.111475596427555
Energy: 1.095190910227261
Energy: 0.9549905227495755
Energy: 1.111475596428799
Energy: 1.095190910227998
Energy: 1.2454937212313113
Energy: 1.1508590786175978
Energy: 1.0946697260349383
Energy: 1.245493721233339
Energy: 1.1508590786188884
Energy: 1.0946697260344314
Energy: 1.2454937212310349
Energy: 1.1508590786173674
Energy: 1.0946697260349383
Energy: 1.2454937212330623
Energy: 0.9743404503925681
Energy: 1.1220188014807264
Energy: 1.0810089748725784
Energy: 0.9743404503910476
Energy: 1.1220188014817403
Energy: 1.0810089748728546
Energy: 0.9743404503925681
Energy: 1.1220188014802195
Energy: 1.0810089748725784
Energy: 0.9743404503910476

minimum gb energy = 0.9546988415540412 eV
minimum distance =  2.21399203952711 Angstroms
sigma value = 293


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

Energy: 1.1922895264473732
Energy: 1.2146391395298413
Energy: 1.21533549367585
Energy: 1.1922895264469153
Energy: 1.2146391395312155
Energy: 1.2153354936753917
Energy: 1.1922895264478313
Energy: 1.2146391395307576
Energy: 1.21533549367585
Energy: 1.1922895264473732
Energy: 1.212792726272981
Energy: 1.1902206466006506
Energy: 1.2146663679104412
Energy: 1.2127927262725229
Energy: 1.190220646608438
Energy: 1.2146663679118157
Energy: 1.2127927262720648
Energy: 1.1902206466139351
Energy: 1.2146663679113576
Energy: 1.2127927262725229
Energy: 1.2131247599082522
Energy: 1.2131076043332454
Energy: 1.0833495224347909
Energy: 1.213124759907336
Energy: 1.2131076043323294
Energy: 1.0822652978314935
Energy: 1.2131247599082522
Energy: 1.2131076043327873
Energy: 1.081902622371752
Energy: 1.213124759907336
Energy: 1.0828706370906278
Energy: 1.2130863255424387
Energy: 1.2127108237086996
Energy: 1.0828468808923373
Energy: 1.2130863255428967
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Energy: 1.1902206466358822
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Energy: 1.1902206466404635
Energy: 1.2146663679113576
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Energy: 1.1902206466331755
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Energy: 1.0830664870895064
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Energy: 1.2127108237086996
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Energy: 1.128087598014467
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Energy: 1.2127108237091577
Energy: 1.0853722228700076
Energy: 1.2130863255433546
Energy: 1.190224579663889
Energy: 1.2127497299239542
Energy: 1.2145470164131615
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Energy: 1.2146391395302993
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Energy: 1.1922895264473732
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Energy: 1.2153354936753917
Energy: 1.2146663679095253
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Energy: 1.1902206466766532
Energy: 1.2146663679118157
Energy: 1.212792726272981
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Energy: 1.2146663679104412
Energy: 1.2127927262716067
Energy: 1.1902206466766532
Energy: 1.2146663679113576
Energy: 1.1276239616664054
Energy: 1.2131247599077943
Energy: 1.2131076043327873
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Energy: 1.2131076043323294
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Energy: 1.083906048493591
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Energy: 1.0842113086175598
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Energy: 1.212749729923038
Energy: 1.2145470164154522
Energy: 1.1902245798196012
Energy: 1.2127497299244123
Energy: 1.2145470164149939
Energy: 1.1902245798090647
Energy: 1.2127497299244123
Energy: 1.1922895264478313
Energy: 1.2146391395307576
Energy: 1.21533549367585
Energy: 1.1922895264478313
Energy: 1.2146391395307576
Energy: 1.2153354936763079
Energy: 1.1922895264473732
Energy: 1.2146391395298413
Energy: 1.2153354936749337
Energy: 1.1922895264478313
Energy: 1.2127927262720648
Energy: 1.1902206467018486
Energy: 1.2146663679099834
Energy: 1.2127927262720648
Energy: 1.1902206467050551
Energy: 1.2146663679113576
Energy: 1.2127927262720648
Energy: 1.1902206467068877
Energy: 1.2146663679104412
Energy: 1.2127927262725229
Energy: 1.2131247599077943
Energy: 1.2131076043327873
Energy: 1.1281519291989104
Energy: 1.213124759907336
Energy: 1.2131076043323294
Energy: 1.128155631120606
Energy: 1.2131247599077943
Energy: 1.2131076043341618
Energy: 1.1281322088856547
Energy: 1.213124759907336
Energy: 1.0842596095143642
Energy: 1.2130863255428967
Energy: 1.2127108237077837
Energy: 1.1281078629838621
Energy: 1.2130863255424387
Energy: 1.2127108237073254
Energy: 1.127189604622479
Energy: 1.2130863255424387
Energy: 1.2127108237073254
Energy: 1.1277939800908057
Energy: 1.2145470164131615
Energy: 1.190224579914386
Energy: 1.2127497299253287
Energy: 1.2145470164149939
Energy: 1.190224579879112
Energy: 1.2127497299234962
Energy: 1.2145470164136196
Energy: 1.1902245799024753
Energy: 1.2127497299239542
Energy: 1.2145470164131615
Energy: 1.2146391395307576
Energy: 1.2153354936753917
Energy: 1.1922895264469153
Energy: 1.2146391395307576
Energy: 1.2153354936753917
Energy: 1.1922895264473732
Energy: 1.2146391395307576
Energy: 1.2153354936749337
Energy: 1.1922895264473732
Energy: 1.2146391395298413
Energy: 1.1902206467485332
Energy: 1.2146663679113576
Energy: 1.2127927262725229
Energy: 1.1902206467521979
Energy: 1.2146663679104412
Energy: 1.2127927262720648
Energy: 1.1902206467531142
Energy: 1.2146663679127319
Energy: 1.2127927262711484
Energy: 1.1902206467499075

minimum gb energy = 1.081902622371752 eV
minimum distance =  2.36681976311897 Angstroms
sigma value = 15


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

Energy: 1.169428567214425
Energy: 1.0739895172884084
Energy: 1.1252861631625528
Energy: 1.1144133243235088
Energy: 1.0739895175955874
Energy: 1.1252861631646291
Energy: 1.1694285672165015
Energy: 1.0739895184175634
Energy: 1.1252861631646291
Energy: 1.1144133243235088
Energy: 1.116188045119218
Energy: 1.0647195488714822
Energy: 1.057174010968921
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Energy: 1.0647195488673291
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Energy: 1.1191425215269137
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Energy: 1.1239979348050695
Energy: 1.0757132092231592
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Energy: 1.1207665404988794
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Energy: 1.1270166465973641
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Energy: 1.065247867286792
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Energy: 1.0652410344541874
Energy: 1.197246832862162
Energy: 1.0633108016078754
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Energy: 1.1972468328559323
Energy: 1.0633108016120285
Energy: 1.0652410344521106
Energy: 1.0849183519191719
Energy: 1.0916079073389398
Energy: 1.0600390957888004
Energy: 1.0809105028711967
Energy: 1.0912625462058843
Energy: 1.060039095790877
Energy: 1.0849183519233252
Energy: 1.0916079073347864
Energy: 1.0600390957888004
Energy: 1.0809105028711967
Energy: 1.0619205348613157
Energy: 1.071745481151233
Energy: 1.057268437138792
Energy: 1.0619205348633922
Energy: 1.0717454811533096
Energy: 1.057268437138792
Energy: 1.0619205348633922
Energy: 1.071745481151233
Energy: 1.0572684371408683
Energy: 1.061920534865469
Energy: 1.1207598719806
Energy: 1.1084246587673126
Energy: 1.061805051859446
Energy: 1.1207598719806
Energy: 1.1084246587693891
Energy: 1.0618050518635989
Energy: 1.1207598719806
Energy: 1.108424658765236
Energy: 1.0618050518615225
Energy: 1.1207598719806
Energy: 1.0324239167017581
Energy: 1.0772410384672935
Energy: 1.0736713443609163
Energy: 1.032265973544222
Energy: 1.0772410384693698
Energy: 1.0894713665222129
Energy: 1.0324239167017581
Energy: 1.0772410384672935
Energy: 1.0736713443629928
Energy: 1.032265973544222
Energy: 1.1167237274439277
Energy: 1.0587628349417428
Energy: 1.1160569710543509
Energy: 1.1167237274439277
Energy: 1.0587628349438194
Energy: 1.1160569710543509
Energy: 1.1167237274460042
Energy: 1.0587628349417428
Energy: 1.1160569710522743
Energy: 1.1167237274460042
Energy: 1.1658375335812858
Energy: 1.1537899821316837
Energy: 1.1127370250083362
Energy: 1.1658375335792093
Energy: 1.1537899821296072
Energy: 1.1127370250083362
Energy: 1.1658375335792093
Energy: 1.1537899821296072
Energy: 1.112737025010413
Energy: 1.1658375335812858
Energy: 1.1032162150390332
Energy: 1.0616301873925922
Energy: 1.100013550610988
Energy: 1.1130829015054233
Energy: 1.0615005018956032
Energy: 1.1000135506151414
Energy: 1.1032162150411096
Energy: 1.0616301873925922
Energy: 1.1000135506151414
Energy: 1.1130829015095765
Energy: 1.0800836824419733
Energy: 1.0509178434042101
Energy: 1.0871990748736873
Energy: 1.0800836824419733
Energy: 1.0509178434062865
Energy: 1.0871990754320162
Energy: 1.0800836824398967
Energy: 1.0509178434062865
Energy: 1.087199074707638
Energy: 1.0800836824419733
Energy: 1.0954548023764485
Energy: 1.115683782448646
Energy: 1.0827518862860033
Energy: 1.0954548023722954
Energy: 1.115683782448646
Energy: 1.0825960842934608
Energy: 1.0954548023722954
Energy: 1.1156837824465695
Energy: 1.082751886283927
Energy: 1.0954548023764485
Energy: 1.0649613583076014
Energy: 1.129380272427673
Energy: 1.0752243483114297
Energy: 1.0649613583055249
Energy: 1.129380272427673
Energy: 1.0752243483135062
Energy: 1.0649613583076014
Energy: 1.1293802724297493
Energy: 1.0752243483114297
Energy: 1.0649613583055249
Energy: 1.1106061363265922
Energy: 1.1015910039080694
Energy: 1.0709214515930825
Energy: 1.1132734981072478
Energy: 1.1015910039122228
Energy: 1.0709214515889292
Energy: 1.1106061363307451
Energy: 1.1015910039080694
Energy: 1.0709214515889292
Energy: 1.1132734981051713
Energy: 1.108810491713031
Energy: 1.0820598460401987
Energy: 1.0936173620139131
Energy: 1.0772531455416985
Energy: 1.0820598460381219
Energy: 1.102103278486173
Energy: 1.1088104917109542
Energy: 1.0820598460401987
Energy: 1.0936173620180663
Energy: 1.0772531455458514
Energy: 1.0619177284794719
Energy: 1.2224933268211167
Energy: 1.1215427851870807
Energy: 1.0619177284773953
Energy: 1.222493326848074
Energy: 1.1215427851829278
Energy: 1.0619177284794719
Energy: 1.222493326814887
Energy: 1.1215427851850044
Energy: 1.0619177284794719
Energy: 1.0756155640115963
Energy: 1.0843352608398247
Energy: 1.0646199860858359
Energy: 1.0756155640136729
Energy: 1.0843352608356716
Energy: 1.0646199860879126
Energy: 1.0756155640115963
Energy: 1.0843352608377481
Energy: 1.0646199860837595
Energy: 1.0756155640136729
Energy: 1.0918752593915253
Energy: 1.1995630677059705
Energy: 1.063976014177297
Energy: 1.0918752593915253
Energy: 1.199563067703894
Energy: 1.066819522460126
Energy: 1.0918752593915253
Energy: 1.199563067703894
Energy: 1.063976014177297
Energy: 1.0918752593894487
Energy: 1.1539469462767775
Energy: 1.127390976330576
Energy: 1.0619417979056114
Energy: 1.153946946278854
Energy: 1.1273909763347292
Energy: 1.061941797907688
Energy: 1.1539469462747007
Energy: 1.1273909763347292
Energy: 1.0619417979056114
Energy: 1.1539469462747007
Energy: 1.0900936304099
Energy: 1.1463671467738692
Energy: 1.1276219677642243
Energy: 1.0900936304099
Energy: 1.1463671467759458
Energy: 1.1276219677621475
Energy: 1.0900936304119766
Energy: 1.1463671467780225
Energy: 1.1276219677600707
Energy: 1.0900936304119766
Energy: 1.1359261104564091
Energy: 1.0814511287672357
Energy: 1.06385052743813
Energy: 1.1359261104543326
Energy: 1.0814511287651591
Energy: 1.06385052743813
Energy: 1.135926110452256
Energy: 1.0814511287651591
Energy: 1.0638505274360532
Energy: 1.135926110452256
Energy: 1.0217743496257794
Energy: 1.1203346859324081
Energy: 1.0670995591003638
Energy: 1.0217743496216263
Energy: 1.1203346859344847
Energy: 1.0670995591003638
Energy: 1.0217743496257794
Energy: 1.1203346859344847
Energy: 1.067099559096211
Energy: 1.0217743496237028
Energy: 1.1014780774152715
Energy: 1.1243572644879887
Energy: 1.1106133809746797
Energy: 1.101478077413195
Energy: 1.1012341701098027
Energy: 1.0964380994581044
Energy: 1.1014780774152715
Energy: 1.1243572644859121
Energy: 1.1106133809767564
Energy: 1.101478077417348
Energy: 1.1530282578564566
Energy: 1.0537645754764153
Energy: 1.0435917447883933
Energy: 1.1530282578543798
Energy: 1.0537645754764153
Energy: 1.04359174479047
Energy: 1.1530282578564566
Energy: 1.0537645754743388
Energy: 1.0435917447883933
Energy: 1.1530282578585331
Energy: 1.0939592411684436
Energy: 1.2677044611968908
Energy: 1.095005183312057
Energy: 1.0939592411705201
Energy: 1.2677044611927377
Energy: 1.0950051833162102
Energy: 1.0939592411705201
Energy: 1.2677044611948143
Energy: 1.0950051833141337
Energy: 1.0939592411705201
Energy: 1.0975830321645754
Energy: 1.0680448104484221
Energy: 1.1432790551874357
Energy: 1.0975830321645754
Energy: 1.0680364777945028
Energy: 1.1432790551936278
Energy: 1.0975830321645754
Energy: 1.068044810450499
Energy: 1.1432790551915513
Energy: 1.0975830321624989
Energy: 1.0600663537310087
Energy: 1.0688579101810092
Energy: 1.1022062831801562
Energy: 1.0600663537289323
Energy: 1.068857910183086
Energy: 1.102206283176041
Energy: 1.0600663537310087
Energy: 1.0688579101810092
Energy: 1.1022062831801562
Energy: 1.0600663537289323
Energy: 1.101922231233047
Energy: 1.0392322973475019
Energy: 1.0807281106334576
Energy: 1.101922231233047
Energy: 1.039232297343349
Energy: 1.080574854423561
Energy: 1.101922231233047
Energy: 1.0392322973454253
Energy: 1.0807281106334576
Energy: 1.101922231233047
Energy: 1.0613461430711213
Energy: 1.0558046302445332
Energy: 1.0919042904349752
Energy: 1.0613461430731979
Energy: 1.0558046302466095
Energy: 1.0919042904349752
Energy: 1.0613461430711213
Energy: 1.0558046302445332
Energy: 1.0919042904349752
Energy: 1.0613461430731979
Energy: 1.0773034040992475
Energy: 1.1522100254748802
Energy: 1.1430385904520457
Energy: 1.0773034040992475
Energy: 1.1522100254748802
Energy: 1.1430385904499691
Energy: 1.0773034040992475
Energy: 1.1522100254748802
Energy: 1.1430385904499691
Energy: 1.0773034040992475

minimum gb energy = 1.0187614432500933 eV
minimum distance =  2.29786441606291 Angstroms
sigma value = 437


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

Energy: 0.9872845538751256
Energy: 1.0433237779482094
Energy: 1.0430448917586224
Energy: 0.9872845538751256
Energy: 1.043323777950479
Energy: 1.0430448917593786
Energy: 0.9872845538751256
Energy: 1.0433237779482094
Energy: 1.0430448917586224
Energy: 0.9872845538751256
Energy: 1.0961242257461032
Energy: 0.9702345774646018
Energy: 0.970405782508795
Energy: 1.09612422574686
Energy: 0.9702345774630887
Energy: 0.970405782508795
Energy: 1.0961242257461032
Energy: 0.9702345774646018
Energy: 0.970405782508795
Energy: 1.09612422574686
Energy: 1.0199347759995132
Energy: 0.9624853120876513
Energy: 0.9863660348140402
Energy: 1.0199347760010262
Energy: 0.9624853120884078
Energy: 0.9863660348140402
Energy: 1.0264975356351862
Energy: 0.9624853120876513
Energy: 1.0052074398515813
Energy: 1.0264975356351862
Energy: 1.0865762190244581
Energy: 1.0010690171813035
Energy: 0.9838360806007588
Energy: 1.0865762190259711
Energy: 1.0010690171813035
Energy: 0.9838360806015154
Energy: 1.0865762190244581
Energy: 1.0010690171813035
Energy: 0.9838360806007588
Energy: 1.0865762190259711
Energy: 1.0495787243729322
Energy: 0.9884379462840887
Energy: 1.1248082314843488
Energy: 1.0495787243721757
Energy: 0.9884379462848452
Energy: 1.1248082314828358
Energy: 1.0495787243721757
Energy: 0.9884379462840887
Energy: 1.1248082314843488
Energy: 1.049578724371419
Energy: 0.9713742453507083
Energy: 0.9988418860889857
Energy: 0.9706576822689983
Energy: 0.9713742453500206
Energy: 0.9988418860807329
Energy: 0.9706576822689983
Energy: 0.9713742453507083
Energy: 0.9988418861026033
Energy: 0.9706576822689983
Energy: 0.9713742453507083
Energy: 1.0114510535881531
Energy: 0.9710216626342476
Energy: 0.9615180544435599
Energy: 1.0114510535873964
Energy: 0.9710216626342476
Energy: 0.9615180544435599
Energy: 1.0114510535881531
Energy: 0.9710216626350041
Energy: 0.9615180544428034
Energy: 1.0114510535881531
Energy: 0.9857676630807861
Energy: 1.159501482477775
Energy: 0.9827130844660709
Energy: 0.9857676630815427
Energy: 1.1595014824785315
Energy: 0.9827130844524533
Energy: 0.9857676630807861
Energy: 1.159501482477775
Energy: 0.9827130844638012
Energy: 0.9857676630815427
Energy: 1.121212108825545
Energy: 0.9820777484833378
Energy: 0.9885145596008611
Energy: 1.1212121088240317
Energy: 0.9820777484825812
Energy: 0.9885145596008611
Energy: 1.121212108825545
Energy: 0.9820777484833378
Energy: 0.9885145596008611
Energy: 1.1212121088240317
Energy: 1.0874136368400047
Energy: 1.0832346996588733
Energy: 1.0976075520145079
Energy: 1.0874136368354657
Energy: 1.0832346996596298
Energy: 1.0976075520137514
Energy: 1.0874136368392482
Energy: 1.0832346996573603
Energy: 1.0976075520145079
Energy: 1.0874136368377352
Energy: 1.010696713946729
Energy: 0.9642532335906269
Energy: 0.9894970556950603
Energy: 1.010696713946729
Energy: 0.96425323359214
Energy: 0.9894970556943038
Energy: 1.010696713946729
Energy: 0.9642532335913834
Energy: 0.9894970556950603
Energy: 1.010696713946729
Energy: 0.9993434846508663
Energy: 0.9588700512592889
Energy: 1.0244991091988636
Energy: 0.9993434846523794
Energy: 0.9588700512577759
Energy: 1.0244991091973505
Energy: 0.9993434846508663
Energy: 0.9588700512592889
Energy: 1.0244991091988636
Energy: 0.9993434846523794
Energy: 0.9885967404425701
Energy: 1.2015835329122067
Energy: 0.9881713759011291
Energy: 0.9885967404440832
Energy: 1.2015835329137197
Energy: 0.9881713759003727
Energy: 0.9885967404433266
Energy: 1.2015835329129632
Energy: 0.9881713759011291
Energy: 0.9885967404440832
Energy: 1.0587067806241803
Energy: 0.9628017785047118
Energy: 0.9870028526604138
Energy: 1.0587067806241803
Energy: 0.9628017785039553
Energy: 0.9870028526596571
Energy: 1.0587067806234238
Energy: 0.9628017785039553
Energy: 0.9870028526596571
Energy: 1.0587067806241803

minimum gb energy = 0.9588700512577759 eV
minimum distance =  2.20649714702587 Angstroms
sigma value = 33