Model name: model_name=MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049999177455902
cohesive_energy=3.3532637165796375
mass=26.981538
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: 0.011681528474338532
Energy: 0.17506688379334762
Energy: 0.17506688379334762
Energy: 0.011681528474338532
Energy: 0.17506688379334762
Energy: 0.17506688379334762
Energy: 0.011681528474338532
Energy: 0.17506688379334762
Energy: 0.17506688379334762
Energy: 0.011681528474338532
Energy: 0.17521211063250905
Energy: 0.012165034979172583
Energy: 0.17505484985806366
Energy: 0.17521211063250905
Energy: 0.012165034979172583
Energy: 0.17505484985691203
Energy: 0.17521211063250905
Energy: 0.012165034979172583
Energy: 0.17505484985806366
Energy: 0.17521211063250905
Energy: 0.9232465808567618
Energy: 0.32969014326758145
Energy: 0.01245454508841765
Energy: 0.7285170213807751
Energy: 0.39865290289767663
Energy: 0.01245454508841765
Energy: 0.869976369988377
Energy: 0.32969014326758145
Energy: 0.01245454508726598
Energy: 0.5096171929737598
Energy: 0.17521211063250905
Energy: 0.17505484985691203
Energy: 0.012165034980324256
Energy: 0.17521211063250905
Energy: 0.17505484985691203
Energy: 0.012165034980324256
Energy: 0.17521211063250905
Energy: 0.17505484985806366
Energy: 0.012165034979172583
Energy: 0.17521211063250905
Energy: 0.011681528474338532
Energy: 0.17506688379334762
Energy: 0.17506688379334762
Energy: 0.011681528474338532
Energy: 0.17506688379334762
Energy: 0.17506688379334762
Energy: 0.011681528474338532
Energy: 0.17506688379334762
Energy: 0.17506688379334762
Energy: 0.011681528474338532
Energy: 0.17521211063250905
Energy: 0.012165034980324256
Energy: 0.17505484985806366
Energy: 0.17521211063250905
Energy: 0.012165034979172583
Energy: 0.17505484985691203
Energy: 0.17521211063250905
Energy: 0.012165034980324256
Energy: 0.17505484985691203
Energy: 0.17521211063250905
Energy: 0.5096202183096862
Energy: 0.475208900846696
Energy: 0.01245454508841765
Energy: 0.832197335829334
Energy: 0.475208900846696
Energy: 0.01245454508726598
Energy: 0.7727580684116702
Energy: 0.475208900846696
Energy: 0.01245454508841765
Energy: 0.5733291947437934

minimum gb energy = 0.011681528474338532 eV
minimum distance =  2.56012084653431 Angstroms
sigma value = 3


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

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Energy: 0.6913986858882317
Energy: 0.6526344128783496
Energy: 0.5547191393944034
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Energy: 0.6263316861359083
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Energy: 0.6526344128806063
Energy: 0.5548059779869331
Energy: 0.6913986858902064
Energy: 0.6526344128800421
Energy: 0.5711371690847757
Energy: 0.6263316861356262
Energy: 0.5596390266768656
Energy: 0.7272861052183778
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Energy: 0.5596390266774298
Energy: 0.7272861052203524
Energy: 0.6263316861373188
Energy: 0.5596390266774298
Energy: 0.7272861052211987
Energy: 0.6263316861364726
Energy: 0.6477128394625774
Energy: 0.6921993705680739
Energy: 0.6890823873792199
Energy: 0.6143700285186898
Energy: 0.6921993705672275
Energy: 0.6890823873200044
Energy: 0.6477128394594743
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Energy: 0.6890823872994367
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Energy: 0.5354108801504901
Energy: 0.6881183684813881
Energy: 0.6088211792641743
Energy: 0.5354108801493616
Energy: 0.6881183684819523

minimum gb energy = 0.5140965356647502 eV
minimum distance =  2.41195706970669 Angstroms
sigma value = 75


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

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Energy: 0.4869841658766109
Energy: 0.4867796522512897
Energy: 0.5594191778583405
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minimum gb energy = 0.48149465022477933 eV
minimum distance =  2.3942673785586 Angstroms
sigma value = 105


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

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Energy: 0.6873815372411044
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Energy: 0.6378833329932585
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Energy: 0.657397313746592
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Energy: 0.6558344289145445
Energy: 0.6298856022341693
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Energy: 0.6930348774337657
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Energy: 0.6836421042692806
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Energy: 0.6836421042677278
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Energy: 0.6190704532672581
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Energy: 0.7278330605671162
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Energy: 0.5741379020432416
Energy: 0.6938038785428139
Energy: 0.580188966136624
Energy: 0.7038024415941053
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Energy: 0.5801889661360028
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Energy: 0.6938038785403292
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Energy: 0.6938038785417409
Energy: 0.6833056220693399
Energy: 0.6175830836531764
Energy: 0.6346993031241006
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Energy: 0.6425275241670523
Energy: 0.6858888194887814
Energy: 0.6175830836530068
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Energy: 0.6766518358288293
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Energy: 0.6671576139336592
Energy: 0.5575628699740753
Energy: 0.6459057853450484
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Energy: 0.6812333645177425
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Energy: 0.6812333645189849
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Energy: 0.6276625805883522
Energy: 0.7038539109538952
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Energy: 0.6276625805883522
Energy: 0.7038539109535845
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Energy: 0.6276625805872792
Energy: 0.7038539109545162
Energy: 0.6014745427781191
Energy: 0.6892656759603373
Energy: 0.6636701970882801
Energy: 0.656599997559867
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Energy: 0.6584097446411
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Energy: 0.6565999975597258
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Energy: 0.5886461305759636
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Energy: 0.6628205279950729
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Energy: 0.6418436956644101
Energy: 0.6091155489513844
Energy: 0.6427207591947421
Energy: 0.6418436956648902
Energy: 0.6091155489520057
Energy: 0.6427207591950527
Energy: 0.6418436956644101
Energy: 0.6091155489506221
Energy: 0.6427207591945726
Energy: 0.6062632150264914
Energy: 0.6447166781946382
Energy: 0.6563463586466528
Energy: 0.6062632150269713
Energy: 0.6447166781960217
Energy: 0.6563463586466528
Energy: 0.606263215027282
Energy: 0.6447166781968122
Energy: 0.6563463586454106
Energy: 0.6062632150264914
Energy: 0.6266823263245394
Energy: 0.6308788988044878
Energy: 0.6305216505468414
Energy: 0.6266823263232969
Energy: 0.6308587493479056
Energy: 0.6305216505470108
Energy: 0.6266823263226758
Energy: 0.630878898803076
Energy: 0.6305216505470108
Energy: 0.626682326322817
Energy: 0.7262459287744034
Energy: 0.629873167502955
Energy: 0.6627472968623946
Energy: 0.7262459287739516
Energy: 0.6298818857153758
Energy: 0.662747296862084
Energy: 0.7262459287750244
Energy: 0.6298731675030961
Energy: 0.6627472968614629
Energy: 0.7262459287739516
Energy: 0.6575294072836422
Energy: 0.6467865678315672
Energy: 0.5741114274575928
Energy: 0.6575294072848844
Energy: 0.6467865678312565
Energy: 0.5741114274580444
Energy: 0.6575294072848844
Energy: 0.6467865678315672
Energy: 0.5741114274582138
Energy: 0.6575294072831903
Energy: 0.6499226648617584
Energy: 0.6894364643354901
Energy: 0.6165631852642629
Energy: 0.6499226648617584
Energy: 0.6890967723843746
Energy: 0.6165631852627099
Energy: 0.6499226648631419
Energy: 0.6894364643359701
Energy: 0.6165631852636416
Energy: 0.6499226648633113
Energy: 0.5964319417346025
Energy: 0.6432312006074771
Energy: 0.6418647570797249
Energy: 0.5964319417362967
Energy: 0.6434068050664605
Energy: 0.641864757081419
Energy: 0.5964319417361554
Energy: 0.6432312006077875
Energy: 0.641864757081419
Energy: 0.5964319417356754
Energy: 0.6648469375185615
Energy: 0.588494993608158
Energy: 0.68356923385843
Energy: 0.6648469375176298
Energy: 0.588464056169967
Energy: 0.6835692338574983
Energy: 0.6648469375176298
Energy: 0.5884949936078475
Energy: 0.6835692338582606
Energy: 0.6648469375179403

minimum gb energy = 0.5525751624989098 eV
minimum distance =  2.34575065172803 Angstroms
sigma value = 165


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

Energy: 0.5695628603141403
Energy: 0.6870612762515942
Energy: 0.6870878856507634
Energy: 0.569562860313074
Energy: 0.6870612762510612
Energy: 0.6870878856496971
Energy: 0.5695628603141403
Energy: 0.687061276250528
Energy: 0.6870878856496971
Energy: 0.569562860313074
Energy: 0.6796597251614387
Energy: 0.6888098645671432
Energy: 0.6319568499382019
Energy: 0.6796597250282073
Energy: 0.6888098645666102
Energy: 0.6319568499376687
Energy: 0.6796597250117048
Energy: 0.6888098645671432
Energy: 0.6319568499387349
Energy: 0.6796597250426015
Energy: 0.6078426361773409
Energy: 0.6884504817503984
Energy: 0.560084291483578
Energy: 0.6078426361464443
Energy: 0.6884510104480456
Energy: 0.5600751955846547
Energy: 0.6078426361874701
Energy: 0.6884571092727741
Energy: 0.5600810364407531
Energy: 0.6078426361698772
Energy: 0.7063305607510629
Energy: 0.6855554473110906
Energy: 0.5760054737118984
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Energy: 0.5760054737113653
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Energy: 0.6855554473116238
Energy: 0.5760054737118984
Energy: 0.7063305607510629
Energy: 0.61238888956607
Energy: 0.6262923912301568
Energy: 0.6120739110445841
Energy: 0.6123888889415445
Energy: 0.6262923912402619
Energy: 0.6120634093941418
Energy: 0.6123888894653586
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Energy: 0.6120617063919954
Energy: 0.6123888901692947
Energy: 0.5985715836977776
Energy: 0.656806330750877
Energy: 0.7815246335613198
Energy: 0.5985715836983106
Energy: 0.6568063271507204
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Energy: 0.5985715836977776
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Energy: 0.781524633561853
Energy: 0.5985715836983106
Energy: 0.6201240706730123
Energy: 0.6515880615792792
Energy: 0.6026567401169555
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Energy: 0.6515880615782129
Energy: 0.6026443422932265
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Energy: 0.6594349822910669
Energy: 0.6594115680909076
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Energy: 0.6594349822910669
Energy: 0.659411568091974
Energy: 0.6270720287319381
Energy: 0.6200864071357032
Energy: 0.6026748312516422
Energy: 0.6515175500785781
Energy: 0.6200864071357032
Energy: 0.6035387833576588
Energy: 0.6515175500785781
Energy: 0.6200864071357032
Energy: 0.6035405102361484
Energy: 0.651517550077512
Energy: 0.6200864071351699
Energy: 0.5985788607820498
Energy: 0.783339616427577
Energy: 0.6567103174928732
Energy: 0.5985788607809837
Energy: 0.783339616427577
Energy: 0.6567102496067794
Energy: 0.5985788607820498
Energy: 0.78333961642811
Energy: 0.6567098972294279
Energy: 0.5985788607809837
Energy: 0.6123870636219861
Energy: 0.6119577716130894
Energy: 0.6264133325676667
Energy: 0.6123860154972295
Energy: 0.6119577679548469
Energy: 0.6264133325666006
Energy: 0.6123895025423666
Energy: 0.6119577711681283
Energy: 0.6264133325719317
Energy: 0.6123863235984159
Energy: 0.7062869443019475
Energy: 0.5758910198918977
Energy: 0.6854310290814641
Energy: 0.7062869443030138
Energy: 0.5758910198913646
Energy: 0.6854310290819972
Energy: 0.7062869443024806
Energy: 0.5758910198902983
Energy: 0.6854310290809309
Energy: 0.7062869443024806
Energy: 0.6074899937806935
Energy: 0.5600970535961984
Energy: 0.6884740583972637
Energy: 0.6074899937892233
Energy: 0.5600987003242989
Energy: 0.6884758358974956
Energy: 0.6074899937828259
Energy: 0.5600998982296395
Energy: 0.6884765468501748
Energy: 0.6074899937870908
Energy: 0.6798954243526271
Energy: 0.631913216979826
Energy: 0.6888968359600044
Energy: 0.6798954243547596
Energy: 0.6319132169803593
Energy: 0.6888968359605375
Energy: 0.6798954243574252
Energy: 0.6319132169808924
Energy: 0.6888968359594713
Energy: 0.6798954243632895
Energy: 0.5695628603136073
Energy: 0.6870612762521273
Energy: 0.6870878856512964
Energy: 0.569562860313074
Energy: 0.687061276250528
Energy: 0.6870878856502303
Energy: 0.5695628603136073
Energy: 0.6870612762510612
Energy: 0.6870878856560946
Energy: 0.569562860313074

minimum gb energy = 0.5600751955846547 eV
minimum distance =  2.54413865021285 Angstroms
sigma value = 41


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

Energy: 0.6860030166534613
Energy: 0.623263053227053
Energy: 0.6171711441313911
Energy: 0.6694873958990473
Energy: 0.6232630532241571
Energy: 0.6171711441324441
Energy: 0.6860030166528596
Energy: 0.6232630532264513
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Energy: 0.7108354352229753
Energy: 0.5878273721984869
Energy: 0.6605168980330348
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Energy: 0.7108354352223359
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Energy: 0.6605168980338623
Energy: 0.7108354352225615
Energy: 0.6173566874651139
Energy: 0.5680121208684835
Energy: 0.6089073348857067
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Energy: 0.6086749392011754
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Energy: 0.6167712565177248
Energy: 0.589272801401677
Energy: 0.5687784042412166
Energy: 0.5705681282283709
Energy: 0.5625756540734421
Energy: 0.5687784042445261
Energy: 0.5705681282267161
Energy: 0.5625266854375661
Energy: 0.5687784042410284
Energy: 0.570568128225663
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Energy: 0.568778404243285
Energy: 0.598166851505654
Energy: 0.6518215726385223
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Energy: 0.5615000103846011
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Energy: 0.5575243396729295
Energy: 0.6540965455139369
Energy: 0.6278538353364459
Energy: 0.5575243396722903
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Energy: 0.6278538353368596
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Energy: 0.5575243396722903
Energy: 0.6108799907180441
Energy: 0.6165324433743071
Energy: 0.6374231394802642
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Energy: 0.5675989985651493
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Energy: 0.567584348204184
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Energy: 0.6982564414550846
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Energy: 0.6574565544569599
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Energy: 0.6249596286521898
Energy: 0.7018113042359351
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Energy: 0.6683326917083631
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Energy: 0.632032534027804
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Energy: 0.5538846841517129
Energy: 0.6143405888745765
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Energy: 0.6800709081930697
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Energy: 0.6800709081905875
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Energy: 0.5743088041080825
Energy: 0.6194185307624942
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Energy: 0.6194185307604633
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Energy: 0.5743088041074808
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Energy: 0.5609258621527807
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Energy: 0.7155355857373223
Energy: 0.5530833313335556
Energy: 0.5960370848699356
Energy: 0.6876740105227215
Energy: 0.6492522603903494
Energy: 0.6182807831627887
Energy: 0.6732471829147777
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Energy: 0.6876740105235488
Energy: 0.6492522603892964
Energy: 0.618280783162563
Energy: 0.6732471829137247
Energy: 0.6249767625694911
Energy: 0.5839075364702299
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Energy: 0.6249767625705065
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Energy: 0.6252215409403231
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Energy: 0.623227160387964
Energy: 0.6558563717233091
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Energy: 0.6605531259034667
Energy: 0.5599556293392987
Energy: 0.655856371736096
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Energy: 0.5712578498164709
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Energy: 0.6404573172244995
Energy: 0.5810614789803358
Energy: 0.5965927645560729
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Energy: 0.5965927645579533
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Energy: 0.5965927645602098
Energy: 0.6404573172226191
Energy: 0.6644009211836167
Energy: 0.5879086040306999
Energy: 0.650195707889254
Energy: 0.6644009211854595
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Energy: 0.6501957078890283
Energy: 0.6644009211848577
Energy: 0.5879086040321666
Energy: 0.650195707890495
Energy: 0.6644009211850458
Energy: 0.6236108102490614
Energy: 0.6220627027109175
Energy: 0.6698866320226581
Energy: 0.6236108102465792
Energy: 0.6220627027096763
Energy: 0.6698866320230717
Energy: 0.6236108102459775
Energy: 0.622062702708661
Energy: 0.6698866320234853
Energy: 0.6236108102472185
Energy: 0.575862658905006
Energy: 0.676808342108779
Energy: 0.6253593961455498
Energy: 0.5758626589048179
Energy: 0.6848060002599002
Energy: 0.6253593961453618
Energy: 0.5758626589035768
Energy: 0.6768083421091929
Energy: 0.6253593961455498
Energy: 0.5758626589035768
Energy: 0.5688973654347514
Energy: 0.5612506440631545
Energy: 0.5611094806040824
Energy: 0.5688973654358045
Energy: 0.5612586184905791
Energy: 0.5610673642892894
Energy: 0.5688973654351651
Energy: 0.5612506440619133
Energy: 0.5611094806057372
Energy: 0.5688973654329086
Energy: 0.5946381157275433
Energy: 0.5797917021406789
Energy: 0.5688673361212818
Energy: 0.5946381157281451
Energy: 0.5880613172586899
Energy: 0.5688673361272991
Energy: 0.5946381157287843
Energy: 0.5797917021390241
Energy: 0.5688673360995817
Energy: 0.5946381157277314
Energy: 0.6512721823177651
Energy: 0.5602927823479317
Energy: 0.6130396548141301
Energy: 0.6512721823156966
Energy: 0.5603025655690508
Energy: 0.6130396548083384
Energy: 0.6512721823148693
Energy: 0.56029278234733
Energy: 0.6130396548112342
Energy: 0.6512721823165241
Energy: 0.6453161496793809
Energy: 0.6290825644428552
Energy: 0.5555838758421037
Energy: 0.6453161496773125
Energy: 0.6290825644434569
Energy: 0.5555838758445859
Energy: 0.6453161496789672
Energy: 0.6290825644449236
Energy: 0.555583875843984
Energy: 0.6453161496773125

minimum gb energy = 0.5530833313335556 eV
minimum distance =  2.37444384218997 Angstroms
sigma value = 185


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

Energy: 0.4924325354801813
Energy: 0.36862120082272526
Energy: 0.5156324690090667
Energy: 0.35597952690824075
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Energy: 0.41390437359060184
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Energy: 0.5411103084411071
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Energy: 0.43609370201920583
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Energy: 0.38247987737757644
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Energy: 0.37688925226630543
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Energy: 0.3967724790449086
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Energy: 0.38539818952060906
Energy: 0.39375667835606676
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Energy: 0.5156324690088212
Energy: 0.38564044761528476
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Energy: 0.36495650852045214
Energy: 0.5112236145099098
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Energy: 0.3535393425967023
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Energy: 0.3615841779471735
Energy: 0.39685031940329735
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Energy: 0.3730936611714309
Energy: 0.3535393425969478
Energy: 0.43609370201920583
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Energy: 0.371338551175227
Energy: 0.4360937020199425
Energy: 0.3701231028148439
Energy: 0.39855973269781825
Energy: 0.4360937020216612
Energy: 0.3701231028148439
Energy: 0.37133855117547254
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Energy: 0.3704639088935073
Energy: 0.525270987961596
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Energy: 0.37046390889277064
Energy: 0.5252709879623325
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Energy: 0.4373955557138685
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Energy: 0.3709059940382853
Energy: 0.39058555719191224
Energy: 0.44036529390257245
Energy: 0.3709059940382853
Energy: 0.3780326285221578
Energy: 0.44036529390306345
Energy: 0.37090599403853075
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Energy: 0.44036529390232687
Energy: 0.37090599403853075
Energy: 0.5818348472055883
Energy: 0.38217711987821995
Energy: 0.3812635975351054
Energy: 0.5818348472011686
Energy: 0.3554887437168907
Energy: 0.38126359753412326
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Energy: 0.3812635975365787
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Energy: 0.4387234261519976
Energy: 0.38493113003414625
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Energy: 0.39932642513310423
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Energy: 0.3700130771678579
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Energy: 0.3743547681889883
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Energy: 0.37133855117424486
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Energy: 0.5252709879598773
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Energy: 0.3704639088910519
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Energy: 0.3556646199720909
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Energy: 0.4373955557126408
Energy: 0.5348563000142837
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Energy: 0.4373955557143597
Energy: 0.43665122618867847
Energy: 0.40124702435740134
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Energy: 0.5348563000133016
Energy: 0.3796333352339536
Energy: 0.437395555713623
Energy: 0.37090599403853075
Energy: 0.3768892522660599
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Energy: 0.3709059940380397
Energy: 0.3780326285224033
Energy: 0.4403652939028179
Energy: 0.37090599403754865
Energy: 0.3768892522655688
Energy: 0.44036529390306345
Energy: 0.3709059940382853
Energy: 0.5818348471992043
Energy: 0.3784154988036757
Energy: 0.38126359753412326
Energy: 0.5818348472009232
Energy: 0.3807030860773945
Energy: 0.3812635975348599
Energy: 0.5818348472092715
Energy: 0.3784154988022025
Energy: 0.38126359753559647
Energy: 0.5818348471950302
Energy: 0.40026927719398064
Energy: 0.3980020542925336
Energy: 0.370013077168349
Energy: 0.4387234261519976
Energy: 0.3849311300334097
Energy: 0.3700130771668758
Energy: 0.4002692771947173
Energy: 0.39800205429155144
Energy: 0.37001307716663023
Energy: 0.4387234261519976
Energy: 0.3967724790449086
Energy: 0.3711966480577379
Energy: 0.37984425979288466
Energy: 0.35359293142643594
Energy: 0.36061353234088933
Energy: 0.37984425979288466
Energy: 0.3967724790453997
Energy: 0.37119664805675573
Energy: 0.37984425979411235
Energy: 0.3535929314254538
Energy: 0.37435476818677843
Energy: 0.44217875047950816
Energy: 0.3811659431340548
Energy: 0.38539818952134564
Energy: 0.44217875047926264
Energy: 0.3811659431343003
Energy: 0.3743547681889883
Energy: 0.4421787504809813
Energy: 0.3811659431335637
Energy: 0.3853981895203635

minimum gb energy = 0.35217948291944373 eV
minimum distance =  2.56699065958706 Angstroms
sigma value = 33


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

Energy: 0.5859604715190482
Energy: 0.6002654427576022
Energy: 0.5974578200410314
Energy: 0.5748341680705112
Energy: 0.6002654427602979
Energy: 0.5974578200410314
Energy: 0.5859604715203961
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Energy: 0.5748341680691634
Energy: 0.591200778709343
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Energy: 0.5970673226811765
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Energy: 0.591200778707995
Energy: 0.5834197848594641
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Energy: 0.5981881446222302
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Energy: 0.5861989064288493
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Energy: 0.6681824149228913
Energy: 0.6071433582539901
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Energy: 0.577865415911835
Energy: 0.5320657339999721
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Energy: 0.532065734002668
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Energy: 0.5883553757709536
Energy: 0.5965733010566319
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Energy: 0.5954117041723955
Energy: 0.6063782928942516
Energy: 0.553545780410382
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Energy: 0.5535457804090341
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minimum gb energy = 0.5304506816958743 eV
minimum distance =  2.38326246215104 Angstroms
sigma value = 219


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

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Energy: 0.6771440762675855
Energy: 0.642529429622823

minimum gb energy = 0.6215132544055695 eV
minimum distance =  2.51717514038988 Angstroms
sigma value = 15


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

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minimum gb energy = 0.6460052524611779 eV
minimum distance =  2.4341217248174 Angstroms
sigma value = 293


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

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Energy: 0.6724137309148236
Energy: 0.6662254715178088
Energy: 0.7163090459538434
Energy: 0.6724137309146221
Energy: 0.6662254715170028
Energy: 0.7272969359935239
Energy: 0.7030028056515544
Energy: 0.6466928681438397
Energy: 0.7272969359925164
Energy: 0.7030028056515544
Energy: 0.6467924217560604
Energy: 0.7272969359931208
Energy: 0.7030028056523604
Energy: 0.6466928681430336
Energy: 0.7272969359937254
Energy: 0.6691225192629081
Energy: 0.7385025651127065
Energy: 0.6378987695779307
Energy: 0.669122519264117
Energy: 0.7385025651121021
Energy: 0.6378987695783337
Energy: 0.6691225192635126
Energy: 0.7385025651123035
Energy: 0.6378987695793411
Energy: 0.669122519264117
Energy: 0.6497177875150745
Energy: 0.6758118619038794
Energy: 0.646334268927867
Energy: 0.649717787515679
Energy: 0.675811861903275
Energy: 0.6463342689300835
Energy: 0.649717787514873
Energy: 0.6758118619054915
Energy: 0.6463342689302851
Energy: 0.649717787513664
Energy: 0.6942140233672388
Energy: 0.6956087207667823
Energy: 0.6465639684381123
Energy: 0.6753921137665517
Energy: 0.6956087207661777
Energy: 0.6465639684375077
Energy: 0.6942140233670373
Energy: 0.6956087207671853
Energy: 0.6465639684369032
Energy: 0.6753921137653427
Energy: 0.6570172894690508
Energy: 0.6810276150253711
Energy: 0.7343259969610747
Energy: 0.6409897220665084
Energy: 0.6810276150251696
Energy: 0.7343259969624851
Energy: 0.6570172894692523
Energy: 0.6810276150253711
Energy: 0.7343259969614777
Energy: 0.640989722066307
Energy: 0.6758719184514307
Energy: 0.6461932087248178
Energy: 0.6954017343717763
Energy: 0.6758719184504232
Energy: 0.6461932087244149
Energy: 0.6954017343725823
Energy: 0.6758719184508262
Energy: 0.6461932087240118
Energy: 0.6954017343721793
Energy: 0.6758719184508262
Energy: 0.6618951305431362
Energy: 0.6567492886708638
Energy: 0.6795503345684638
Energy: 0.6618951305425317
Energy: 0.6565093400238907
Energy: 0.6795503345682622
Energy: 0.6618951305425317
Energy: 0.6567492886714683
Energy: 0.6795503345680608
Energy: 0.6618951305443453
Energy: 0.6618071013356236
Energy: 0.6370011716605815
Energy: 0.7762751445309153
Energy: 0.6618071013338102
Energy: 0.6376174406623714
Energy: 0.7762751445305124
Energy: 0.6618071013346162
Energy: 0.6370011716605815
Energy: 0.7762751445301094
Energy: 0.6618071013360266
Energy: 0.7213915086639233
Energy: 0.6658395225623426
Energy: 0.6835223528633523
Energy: 0.7213915086645278
Energy: 0.6658395225631486
Energy: 0.6835223528625461
Energy: 0.7213915086651322
Energy: 0.6658395225635516
Energy: 0.6835223528645612
Energy: 0.7213915086641247
Energy: 0.6926438279456435
Energy: 0.7086691364143509
Energy: 0.7162620747064765
Energy: 0.6926438279466508
Energy: 0.7086691364155598
Energy: 0.7162732859159784
Energy: 0.6926438279456435
Energy: 0.7086691364149553
Energy: 0.7162620747076855
Energy: 0.6926438279452404
Energy: 0.637940789965491
Energy: 0.690853999302205
Energy: 0.6545125796094955
Energy: 0.6379407899664985
Energy: 0.6908539993630214
Energy: 0.6545125796080851
Energy: 0.6379407899652894
Energy: 0.6908539993132875
Energy: 0.6545125796078836
Energy: 0.6379407899656924
Energy: 0.717613058285795
Energy: 0.7038544148115823
Energy: 0.6789998194269705
Energy: 0.7176130582851906
Energy: 0.6878794703430793
Energy: 0.6787246274242932
Energy: 0.7176130582847876
Energy: 0.7038544148113808
Energy: 0.6789998194267689
Energy: 0.717613058285795
Energy: 0.6481689944508615
Energy: 0.7136257544194966
Energy: 0.6660387455832747
Energy: 0.6481689944520705
Energy: 0.7136257544194966
Energy: 0.6660387455842823
Energy: 0.6481689944524736
Energy: 0.7136257544186907
Energy: 0.6660387455856928
Energy: 0.6481689944502571
Energy: 0.6662254715168013
Energy: 0.7163090459528358
Energy: 0.6724137309140176
Energy: 0.6662254715172043
Energy: 0.7163090459534404
Energy: 0.6724137309148236
Energy: 0.6662254715176074
Energy: 0.7163090459536419
Energy: 0.6724137309146221
Energy: 0.6662254715165998
Energy: 0.7272969359937254
Energy: 0.7030028056511515
Energy: 0.6467811634414004
Energy: 0.7272969359925164
Energy: 0.7030028056527634
Energy: 0.6470030385265431
Energy: 0.7272969359933222
Energy: 0.7030028056525619
Energy: 0.646781163442591
Energy: 0.7272969359939269
Energy: 0.6691225192629081
Energy: 0.738502565113311
Energy: 0.6378987695781322
Energy: 0.6691225192651246
Energy: 0.7385025651123035
Energy: 0.6378987695781322
Energy: 0.6691225192635126
Energy: 0.7385025651127065
Energy: 0.6378987695791397
Energy: 0.669122519264117

minimum gb energy = 0.6370011716603801 eV
minimum distance =  2.44396830418332 Angstroms
sigma value = 293


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

Energy: 0.6540716665552434
Energy: 0.6820055095382193
Energy: 0.6818477107537586
Energy: 0.6540716665556077
Energy: 0.682005509537491
Energy: 0.6818477107526659
Energy: 0.6540716665552434
Energy: 0.6820055095385836
Energy: 0.6818477107530301
Energy: 0.6540716665559718
Energy: 0.6555276285334148
Energy: 0.6542924236123082
Energy: 0.666416587335482
Energy: 0.6555276285341433
Energy: 0.6542924236119441
Energy: 0.666416587334406
Energy: 0.6555276285348717
Energy: 0.6542924236123082
Energy: 0.6664165873358462
Energy: 0.6555276285330507
Energy: 0.664463893538389
Energy: 0.6808766877797895
Energy: 0.6501092856732914
Energy: 0.6644638935387531
Energy: 0.6808766877805179
Energy: 0.6501100949927371
Energy: 0.6644638935387531
Energy: 0.6808766877801538
Energy: 0.6501096613607293
Energy: 0.6644638935376607
Energy: 0.6511456974733529
Energy: 0.6812926536897937
Energy: 0.6643956672697868
Energy: 0.651166324601945
Energy: 0.6812926536905222
Energy: 0.6643956672697868
Energy: 0.6511564638850839
Energy: 0.6812926536897937
Energy: 0.664395667269075
Energy: 0.6511463608840545
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6555843343139645
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6555843343139645
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6555843343139645
Energy: 0.6663644540667916
Energy: 0.6820055095371268
Energy: 0.6818477107523018
Energy: 0.6540716665552434
Energy: 0.6820055095385836
Energy: 0.6818477107530301
Energy: 0.6540716665556077
Energy: 0.6820055095378551
Energy: 0.6818477107530301
Energy: 0.6540716665552434
Energy: 0.6820055095378551
Energy: 0.6542924236119441
Energy: 0.6664165873351179
Energy: 0.655527628533779
Energy: 0.6542924236123082
Energy: 0.666416587335482
Energy: 0.655527628533779
Energy: 0.6542924236119441
Energy: 0.666416587335482
Energy: 0.655527628533779
Energy: 0.6542924236123082
Energy: 0.6808766877805179
Energy: 0.650107997395592
Energy: 0.6644638935380248
Energy: 0.6808766877805179
Energy: 0.650109038297846
Energy: 0.6644638935380248
Energy: 0.6808766877797895
Energy: 0.6511787906492232
Energy: 0.6644638935376607
Energy: 0.6808766877797895
Energy: 0.6812926536897937
Energy: 0.6643956672697868
Energy: 0.651143420564948
Energy: 0.6812926536908863
Energy: 0.6643956672697868
Energy: 0.6511619180626378
Energy: 0.681292653690158
Energy: 0.6643956672701511
Energy: 0.6500854807444288
Energy: 0.681292653690158
Energy: 0.6542820700680589
Energy: 0.6555843343143286
Energy: 0.6663644540667916
Energy: 0.6542820700680589
Energy: 0.6555843343136003
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6555843343136003
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6818477107533942
Energy: 0.6540716665556077
Energy: 0.6820055095378551
Energy: 0.6818477107526659
Energy: 0.6540716665552434
Energy: 0.6820055095385836
Energy: 0.6818477107523018
Energy: 0.6540716665556077
Energy: 0.6820055095378551
Energy: 0.6818477107530301
Energy: 0.666416587335482
Energy: 0.6555276285334148
Energy: 0.6542924236119441
Energy: 0.6664165873362105
Energy: 0.6555276285330507
Energy: 0.6542924236123082
Energy: 0.6664165873351179
Energy: 0.6555276285334148
Energy: 0.6542924236119441
Energy: 0.6664165873347703
Energy: 0.650106605517236
Energy: 0.6644638935380248
Energy: 0.6808766877794253
Energy: 0.6501037609084601
Energy: 0.664463893538389
Energy: 0.6808766877794253
Energy: 0.6501061955787362
Energy: 0.664463893538389
Energy: 0.6808766877797895
Energy: 0.6511943463651366
Energy: 0.6643956672701511
Energy: 0.6511450136224696
Energy: 0.681292653690158
Energy: 0.6643956672701511
Energy: 0.6511518594945462
Energy: 0.6812926536897937
Energy: 0.6643956672705154
Energy: 0.6511413474363236
Energy: 0.6812926536890653
Energy: 0.6643956672694393
Energy: 0.6555843343139645
Energy: 0.6663644540671557
Energy: 0.6542820700680589
Energy: 0.6555843343143286
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6555843343136003
Energy: 0.6663644540667916
Energy: 0.6542820700680589
Energy: 0.6555843343143286
Energy: 0.6540716665552434
Energy: 0.6820055095385836
Energy: 0.6818477107519375
Energy: 0.6540716665559718
Energy: 0.6820055095378551
Energy: 0.6818477107526659
Energy: 0.6540716665552434
Energy: 0.6820055095389477
Energy: 0.6818477107526659
Energy: 0.6540716665556077
Energy: 0.655527628533779
Energy: 0.6542924236123082
Energy: 0.6664165873351179
Energy: 0.655527628533779
Energy: 0.6542924236119441
Energy: 0.6664165873358462
Energy: 0.6555276285341433
Energy: 0.6542924236123082
Energy: 0.6664165873351179
Energy: 0.6555276285341433
Energy: 0.6644638935380248
Energy: 0.6808766877794253
Energy: 0.6511976731592874
Energy: 0.6644638935380248
Energy: 0.6808766877790611
Energy: 0.6501096684996981
Energy: 0.6644638935380248
Energy: 0.6808766877794253
Energy: 0.6511921112519239
Energy: 0.6644638935376607
Energy: 0.6511474156783535
Energy: 0.6812926536905222
Energy: 0.6643956672697868
Energy: 0.6511446830854736
Energy: 0.681292653690158
Energy: 0.6643956672697868
Energy: 0.6500816440117526
Energy: 0.6812926536897937
Energy: 0.6643956672701511
Energy: 0.6511524120647916
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6555843343136003
Energy: 0.6663644540667916
Energy: 0.6542820700680589
Energy: 0.6555843343143286
Energy: 0.6663644540664274
Energy: 0.6542820700680589
Energy: 0.6555843343143286
Energy: 0.6663644540664274
Energy: 0.682005509537491
Energy: 0.6818477107530301
Energy: 0.6540716665552434
Energy: 0.6820055095382193
Energy: 0.6818477107533942
Energy: 0.6540716665556077
Energy: 0.6820055095382193
Energy: 0.6818477107533942
Energy: 0.6540716665552434
Energy: 0.6820055095378551
Energy: 0.6542924236119441
Energy: 0.6664165873358462
Energy: 0.6555276285334148
Energy: 0.6542924236123082
Energy: 0.6664165873351179
Energy: 0.6555276285334148
Energy: 0.6542924236119441
Energy: 0.6664165873358462
Energy: 0.6555276285334148
Energy: 0.6542924236123082

minimum gb energy = 0.6500816440117526 eV
minimum distance =  2.53077505155824 Angstroms
sigma value = 15


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

Energy: 0.6913232955513533
Energy: 0.7034536182845212
Energy: 0.7017944902947442
Energy: 0.679978626072987
Energy: 0.7034536182828703
Energy: 0.7017944902963649
Energy: 0.6913232955513533
Energy: 0.7034536182812194
Energy: 0.7017944902963649
Energy: 0.6799786260713361
Energy: 0.6588505346483514
Energy: 0.653528454858976
Energy: 0.6906508120560542
Energy: 0.6588505361945239
Energy: 0.653528454858976
Energy: 0.6906508124966558
Energy: 0.6588505486778145
Energy: 0.6535284548573251
Energy: 0.6906508123976337
Energy: 0.6588505471332927
Energy: 0.6526789931843101
Energy: 0.6826648524191002
Energy: 0.7570727509039843
Energy: 0.6526789931843101
Energy: 0.6826648524191002
Energy: 0.7570727509056351
Energy: 0.6526789931876119
Energy: 0.6826648524174493
Energy: 0.7570727509039843
Energy: 0.652678993185961
Energy: 0.6497880861267631
Energy: 0.6826039743854387
Energy: 0.6351662379812728
Energy: 0.6497880862802338
Energy: 0.6826039743854387
Energy: 0.6351662379829236
Energy: 0.649788086225785
Energy: 0.6826039743870896
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Energy: 0.6497880862571215
Energy: 0.6765418594728918
Energy: 0.6499945973749783
Energy: 0.6755221509050399
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Energy: 0.6499945973733274
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Energy: 0.6765418594745426
Energy: 0.6499945973733274
Energy: 0.6755221509033891
Energy: 0.6765418594728918
Energy: 0.671670277080984
Energy: 0.6962308561779611
Energy: 0.6309147381043446
Energy: 0.671670277080984
Energy: 0.6962308561763101
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Energy: 0.671670277080984
Energy: 0.6962308561779611
Energy: 0.6309147381026937
Energy: 0.6716702770826348
Energy: 0.6986048632305011
Energy: 0.6548922695888095
Energy: 0.6685347205163195
Energy: 0.698736219164126
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Energy: 0.6685347204123749
Energy: 0.6986048632305011
Energy: 0.6548922695888095
Energy: 0.6685347205113669
Energy: 0.698736219164126
Energy: 0.648229339591525
Energy: 0.7174782273621756
Energy: 0.7117479435954237
Energy: 0.6482293395882234
Energy: 0.7174782273588739
Energy: 0.711747943592122
Energy: 0.6482293395898742
Energy: 0.7174782273605248
Energy: 0.7117479435937728
Energy: 0.648229339591525
Energy: 0.6876057570862374
Energy: 0.6850617877695371
Energy: 0.6803605758918337
Energy: 0.6876057570845866
Energy: 0.6850617877678863
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Energy: 0.6876057570845866
Energy: 0.6850617877645845
Energy: 0.6803605758918337
Energy: 0.6876057570845866
Energy: 0.6432564850817736
Energy: 0.7439786931210269
Energy: 0.6584823154313585
Energy: 0.6432571905093883
Energy: 0.7439786931193761
Energy: 0.6584823154297075
Energy: 0.6432564850817736
Energy: 0.7439786931210269
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Energy: 0.6432571905110391
Energy: 0.6715909591763007
Energy: 0.6392943391837324
Energy: 0.6667353235566064
Energy: 0.6715909591746498
Energy: 0.6392943391837324
Energy: 0.6667353235566064
Energy: 0.671590959172999
Energy: 0.6392943391853833
Energy: 0.6667353235549555
Energy: 0.671590959172999
Energy: 0.6890989236442361
Energy: 0.6312897600542771
Energy: 0.7069023718093975
Energy: 0.6890989236409343
Energy: 0.6312896482213539
Energy: 0.7069023718093975
Energy: 0.6890989236425852
Energy: 0.6312897600542771
Energy: 0.7069023718077467
Energy: 0.6890989236425852
Energy: 0.6833936598058491
Energy: 0.6298640340247234
Energy: 0.6797079395397428
Energy: 0.68339365980747
Energy: 0.6298640340230724
Energy: 0.679707939536471
Energy: 0.6833936598058491
Energy: 0.6298640340230724
Energy: 0.6797079395380919
Energy: 0.6833936598041983
Energy: 0.6477277766193954
Energy: 0.655449911493742
Energy: 0.6860609640246927
Energy: 0.6477277766193954
Energy: 0.655449911493742
Energy: 0.6860609640263436
Energy: 0.6477277766193954
Energy: 0.655449911493742
Energy: 0.6860609640263436
Energy: 0.6477277766177446
Energy: 0.7025987682487032
Energy: 0.7098643205106113
Energy: 0.6445218057250268
Energy: 0.7025987682520048
Energy: 0.709864320528771
Energy: 0.644521156595059
Energy: 0.7025987682487032
Energy: 0.709864320504038
Energy: 0.6445218057250268
Energy: 0.7025987682487032
Energy: 0.637803613259069
Energy: 0.6466301349454259
Energy: 0.708827982210309
Energy: 0.6378036132607199
Energy: 0.6466301349487276
Energy: 0.7088279822086582
Energy: 0.637803613259069
Energy: 0.6466301349421242
Energy: 0.7088279821723691
Energy: 0.637803613259069
Energy: 0.6623779362881156
Energy: 0.6900815928826839
Energy: 0.7036347257062752
Energy: 0.662377469210905
Energy: 0.690081592881033
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Energy: 0.6623779362848139
Energy: 0.6900815928826839
Energy: 0.7036347257062752
Energy: 0.6623774692142067
Energy: 0.7088852980128939
Energy: 0.6497147812018679
Energy: 0.6975255824609427
Energy: 0.7088852980145447
Energy: 0.6497147812002169
Energy: 0.6975255824592917
Energy: 0.7088852980128939
Energy: 0.6497147812018679
Energy: 0.6975255824592917
Energy: 0.7088852980128939
Energy: 0.6399456733342764
Energy: 0.7535761304994373
Energy: 0.6518914549417706
Energy: 0.6399456733342764
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Energy: 0.6399456733342764
Energy: 0.7535761305010881
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Energy: 0.6711363588161573
Energy: 0.6410773529974875
Energy: 0.6525452818022386
Energy: 0.6711363588161573
Energy: 0.6410773529974875
Energy: 0.6525452818022386
Energy: 0.6711363588178082
Energy: 0.6410773529974875
Energy: 0.6525452818005877
Energy: 0.6711363588161573
Energy: 0.6551589275155053
Energy: 0.6554000876593715
Energy: 0.7177314397241077
Energy: 0.655158927518807
Energy: 0.6554000876610224
Energy: 0.7177314397257585
Energy: 0.655158927518807
Energy: 0.6554000876610224
Energy: 0.7177314397241077
Energy: 0.655158927518807
Energy: 0.7057334294113226
Energy: 0.7089640732278687
Energy: 0.6320233670171845
Energy: 0.7057334294113226
Energy: 0.7089640732262178
Energy: 0.6320233670171845
Energy: 0.7057334294129735
Energy: 0.7089640732262178
Energy: 0.6320233670171845
Energy: 0.7057334294129735
Energy: 0.6893407898180135
Energy: 0.6905865665381646
Energy: 0.6666400407141329
Energy: 0.6893436015682777
Energy: 0.6905802463590495
Energy: 0.6666400407075593
Energy: 0.6893407898196644
Energy: 0.6905865665381646
Energy: 0.6666400407075593
Energy: 0.6893436015715795
Energy: 0.6298378073631944
Energy: 0.6457683207722728
Energy: 0.6661152557017813
Energy: 0.6298378073631944
Energy: 0.645768320770622
Energy: 0.6661152557034321
Energy: 0.6298378073631944
Energy: 0.6457683207690011
Energy: 0.6661152557034321
Energy: 0.6298378073648453
Energy: 0.6411098677570316
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Energy: 0.6870272988305637
Energy: 0.6411098677586825
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Energy: 0.6870272988322146
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Energy: 0.6497489324251691
Energy: 0.6701144384667924
Energy: 0.6761074570677543
Energy: 0.6497497343031629
Energy: 0.6701144384634906
Energy: 0.6764211098197859
Energy: 0.6497489324235183
Energy: 0.6701144384651415
Energy: 0.6761074570661034
Energy: 0.6497497342998612
Energy: 0.686925956414545
Energy: 0.6355376676183494
Energy: 0.6693374932014505
Energy: 0.686925956414545
Energy: 0.6355376676183494
Energy: 0.6693374932031013
Energy: 0.6869259564128942
Energy: 0.6355376676200002
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Energy: 0.686925956414545
Energy: 0.6965337159674135
Energy: 0.6690704672722024
Energy: 0.7131953352116115
Energy: 0.6965337159657626
Energy: 0.6690704672722024
Energy: 0.713195335876611
Energy: 0.6965337159674135
Energy: 0.6690704672722024
Energy: 0.7131953348716829
Energy: 0.6965337159690645
Energy: 0.6719583703590044
Energy: 0.629267446923256
Energy: 0.657989263528938
Energy: 0.6599235402475987
Energy: 0.6292469057185666
Energy: 0.6579892635305888
Energy: 0.6719583703573535
Energy: 0.6292674469248768
Energy: 0.657989263528938
Energy: 0.6599235402459478
Energy: 0.6744329339173011
Energy: 0.6475294665477064
Energy: 0.6441615913300366
Energy: 0.6744329339156501
Energy: 0.6475294665113872
Energy: 0.6441615913283857
Energy: 0.6744329339173011
Energy: 0.6475294665757411
Energy: 0.6441615913283857
Energy: 0.6744329339173011
Energy: 0.6855726741219527
Energy: 0.6984136189038066
Energy: 0.6416338910722462
Energy: 0.6855726741219527
Energy: 0.6984136188625348
Energy: 0.6415620345903446
Energy: 0.6855726741236035
Energy: 0.6984136188411035
Energy: 0.6416338910722462
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Energy: 0.6474903609963674
Energy: 0.6475100617449585
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Energy: 0.6475100617449585
Energy: 0.6356164784618086
Energy: 0.6474903609980185
Energy: 0.6925713602888229
Energy: 0.6427027262661335
Energy: 0.6528131276869009
Energy: 0.6813998208304586
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Energy: 0.6528131276885519
Energy: 0.6925713602921247
Energy: 0.642702726246323
Energy: 0.6528131276852501
Energy: 0.6813998208288077
Energy: 0.6925088645901941
Energy: 0.6601682665752588
Energy: 0.701984938527995
Energy: 0.6812296446538074
Energy: 0.6601682665785605
Energy: 0.7053485404031564
Energy: 0.692508864591845
Energy: 0.6601682665769096
Energy: 0.7019849385296458
Energy: 0.6812296446538074
Energy: 0.646170221447714
Energy: 0.763636756132265
Energy: 0.6849785904176757
Energy: 0.6461702214493648
Energy: 0.763636756132265
Energy: 0.6849785904193266
Energy: 0.6461702214460631
Energy: 0.7636367561306142
Energy: 0.6849785904193266
Energy: 0.646170221447714
Energy: 0.6896944158615513
Energy: 0.6422048699226279
Energy: 0.7254837773157536
Energy: 0.6896944158632023
Energy: 0.6422048699209771
Energy: 0.7254837773174045
Energy: 0.6896944158615513
Energy: 0.6422048699193262
Energy: 0.7254837773157536
Energy: 0.6896944158615513
Energy: 0.6999616764597234
Energy: 0.6323634466422055
Energy: 0.6337855651869797
Energy: 0.6999616764828356
Energy: 0.6323624665793772
Energy: 0.6351202107872818
Energy: 0.6999616764795338
Energy: 0.6323631259088253
Energy: 0.6337855651853289
Energy: 0.6999616764927408
Energy: 0.6787989853166817
Energy: 0.7052379356472015
Energy: 0.6303650782908591
Energy: 0.6787989853150309
Energy: 0.705237935652154
Energy: 0.6303650782892081
Energy: 0.67879898531338
Energy: 0.7052379356637101
Energy: 0.6303650782892081
Energy: 0.67879898531338
Energy: 0.6568453977102507
Energy: 0.7246070318081864
Energy: 0.6443255694600186
Energy: 0.6568453977119016
Energy: 0.7246070318098373
Energy: 0.6443255694583677
Energy: 0.6568453977102507
Energy: 0.7246070318081864
Energy: 0.6443255694583677
Energy: 0.6568453977102507
Energy: 0.7347061169397826
Energy: 0.6431905568515812
Energy: 0.6606294053146717
Energy: 0.7347061165487071
Energy: 0.6431905568532321
Energy: 0.6606294053130208
Energy: 0.7347061164233012
Energy: 0.6431905568515812
Energy: 0.6606294053113699
Energy: 0.7347061166576044
Energy: 0.6444818524166124
Energy: 0.6848764745188562
Energy: 0.6858652637921944
Energy: 0.6444818524182634
Energy: 0.6848764745172055
Energy: 0.6858652637905435
Energy: 0.6444818524182634
Energy: 0.6848764745172055
Energy: 0.6858652637921944
Energy: 0.6444818524182634
Energy: 0.6491037727482554
Energy: 0.684997259565393
Energy: 0.6788182659974779
Energy: 0.6491037736327301
Energy: 0.6849972595670438
Energy: 0.6788182659991286
Energy: 0.6491037736756228
Energy: 0.684997259565393
Energy: 0.6788182659991286
Energy: 0.6491037728142601
Energy: 0.7561000994012181
Energy: 0.6378164946398881
Energy: 0.7027193776568539
Energy: 0.7561000994028689
Energy: 0.6378164946398881
Energy: 0.7027193776568539
Energy: 0.7561000994028689
Energy: 0.6378164946415389
Energy: 0.7027193776568539
Energy: 0.7561000994028689
Energy: 0.6944192242751316
Energy: 0.706028058934461
Energy: 0.6939517300443352
Energy: 0.6944192242734808
Energy: 0.706028058934461
Energy: 0.6939517300459861
Energy: 0.6944192242751316
Energy: 0.706028058934461
Energy: 0.6939517300459861
Energy: 0.6944192242751316
Energy: 0.6793261179189
Energy: 0.6323076139107928
Energy: 0.7697414265903217
Energy: 0.6793261179189
Energy: 0.6323078174020769
Energy: 0.769741426611783
Energy: 0.6793261179205508
Energy: 0.6323076139124437
Energy: 0.76974142662499
Energy: 0.6793261179189
Energy: 0.6469094742840679
Energy: 0.6478746088750006
Energy: 0.6502589167543297
Energy: 0.6469094742824171
Energy: 0.6478746088733497
Energy: 0.6502589167559806
Energy: 0.6469094742840679
Energy: 0.6478746088750006
Energy: 0.6502589167543297
Energy: 0.6469094742840679
Energy: 0.6875507635555435
Energy: 0.671338462630623
Energy: 0.6436522388223972
Energy: 0.6875507635571944
Energy: 0.6713384627329168
Energy: 0.643652380849509
Energy: 0.6875507635571944
Energy: 0.6713384627147573
Energy: 0.6436522388207764
Energy: 0.6875507635571944
Energy: 0.652837294196165
Energy: 0.6481264858728473
Energy: 0.7089468613222992
Energy: 0.652837294196165
Energy: 0.6481264858728473
Energy: 0.7089468613222992
Energy: 0.652837294196165
Energy: 0.6481264858728473
Energy: 0.7089468613222992
Energy: 0.652837294196165
Energy: 0.6585517629302087
Energy: 0.7331064724231312
Energy: 0.6632210522399419
Energy: 0.6584675672347117
Energy: 0.7331064724214803
Energy: 0.663221052050152
Energy: 0.6585517629302087
Energy: 0.7331064724231312
Energy: 0.6632210522217823
Energy: 0.6584675672363625

minimum gb energy = 0.6292469057185666 eV
minimum distance =  2.42579118126778 Angstroms
sigma value = 437


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

Energy: 0.5880280584264559
Energy: 0.6184784647925521
Energy: 0.6176543789379242
Energy: 0.5880280584270574
Energy: 0.6182495502537559
Energy: 0.6183241256715578
Energy: 0.5880280584264559
Energy: 0.6182342432251117
Energy: 0.6181033301065
Energy: 0.5880280584264559
Energy: 0.7679123504773138
Energy: 0.5804792540434229
Energy: 0.6733909717081437
Energy: 0.7679123504785167
Energy: 0.5804792540428216
Energy: 0.6733909717081437
Energy: 0.7679123504779152
Energy: 0.5804792540434229
Energy: 0.6733909717081437
Energy: 0.7679123504785167
Energy: 0.6736432053750689
Energy: 0.571141576277577
Energy: 0.7004564427243523
Energy: 0.6736432053738661
Energy: 0.571141576277577
Energy: 0.7004564427243523
Energy: 0.6736432053750689
Energy: 0.5711415762769755
Energy: 0.7004564427243523
Energy: 0.6736432053738661
Energy: 0.623464274376948
Energy: 0.7136782900129182
Energy: 0.6497023358996095
Energy: 0.6234642743775495
Energy: 0.7136782900141211
Energy: 0.649702335899008
Energy: 0.623464274376948
Energy: 0.7136782900129182
Energy: 0.6497023358996095
Energy: 0.6234642743775495
Energy: 0.6542368659609902
Energy: 0.5861953768588337
Energy: 0.6284398128389115
Energy: 0.6542368659603887
Energy: 0.5861953768594351
Energy: 0.6284398128419185
Energy: 0.6542368659603887
Energy: 0.5861953768588337
Energy: 0.6284398128407158
Energy: 0.6542368659603887
Energy: 0.651525600180343
Energy: 0.7367450157148165
Energy: 0.5809121982580917
Energy: 0.6515256001809446
Energy: 0.7367450157148165
Energy: 0.5809121982586931
Energy: 0.651525600180343
Energy: 0.7367450157154181
Energy: 0.5809121982580917
Energy: 0.6515256001809446
Energy: 0.6240099008609982
Energy: 0.5921952842400532
Energy: 0.578958673672446
Energy: 0.6238199225773552
Energy: 0.5921952842400532
Energy: 0.5789586736718446
Energy: 0.6240048851736147
Energy: 0.5921952842400532
Energy: 0.578958673672446
Energy: 0.6239794003737128
Energy: 0.6366997259447909
Energy: 0.6877347103508672
Energy: 0.6471939223962548
Energy: 0.6366997259459938
Energy: 0.687734710071307
Energy: 0.6471938360089079
Energy: 0.6366997259447909
Energy: 0.6877347100292335
Energy: 0.647193852713686
Energy: 0.6366997259453923
Energy: 0.6898754661156642
Energy: 0.6727209624873262
Energy: 0.5863378448250185
Energy: 0.6898754660699821
Energy: 0.6727209624867247
Energy: 0.5863378448256198
Energy: 0.6898754662966156
Energy: 0.6727209624873262
Energy: 0.5863378448250185
Energy: 0.689875466167962
Energy: 0.6530282841598568
Energy: 0.6755419906197043
Energy: 0.6272764864351486
Energy: 0.6530282841598568
Energy: 0.6755419906185014
Energy: 0.627276486389439
Energy: 0.6530282841598568
Energy: 0.6755419906191029
Energy: 0.6272764864297354
Energy: 0.6530282841598568
Energy: 0.5723795228714585
Energy: 0.6349681122906685
Energy: 0.6107544716257343
Energy: 0.5723795227951031
Energy: 0.6349681122906685
Energy: 0.6107544716257343
Energy: 0.5723795230614317
Energy: 0.6349681122900671
Energy: 0.6107544716251327
Energy: 0.5723795227584425
Energy: 0.6755518219986563
Energy: 0.5804114989724758
Energy: 0.6120063628309247
Energy: 0.6755518219986563
Energy: 0.5804114989724758
Energy: 0.6122284490699423
Energy: 0.6755518219986563
Energy: 0.5804114989724758
Energy: 0.6120482926835766
Energy: 0.6755518219986563
Energy: 0.586241397845268
Energy: 0.6168464913472946
Energy: 0.5861703052511588
Energy: 0.586241397845268
Energy: 0.6168464913472946
Energy: 0.5861703052505574
Energy: 0.586241397845268
Energy: 0.6168464913472946
Energy: 0.5861703052511588
Energy: 0.586241397845268
Energy: 0.6738713136988392
Energy: 0.6105706206777285
Energy: 0.7205954263409969
Energy: 0.6738713137000422
Energy: 0.6105706206777285
Energy: 0.7205954263409969
Energy: 0.6738713137006437
Energy: 0.6105706206777285
Energy: 0.7205954263403954
Energy: 0.6738713137000422

minimum gb energy = 0.5711415762769755 eV
minimum distance =  2.46145751857567 Angstroms
sigma value = 33