Model name: model_name=MEAM_LAMMPS_KoGrabowskiNeugebauer_2015_NiTi__MO_663355627503_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5213917419314393
cohesive_energy=4.450349978305028
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.02221604847037238
Energy: 0.642028649674669
Energy: 1.6582099980871325
Energy: 0.6420404523148047
Energy: 0.02221604847037238
Energy: 0.642028649674669
Energy: 0.7304568098108282
Energy: 0.7298174031899577
Energy: 0.022367826171063275
Energy: 0.31480637796393446
Energy: 0.022415129127754965
Energy: 0.7298174031899577
Energy: 0.022367826171063275
Energy: 0.31480637796393446
Energy: 0.02221604847037238
Energy: 0.642028649674669
Energy: 1.6582099980871325
Energy: 0.6420404523148047
Energy: 0.02221604847037238
Energy: 0.642028649674669
Energy: 0.7304568098108282
Energy: 0.7298174031899577
Energy: 0.022367826171063275
Energy: 0.31480637796393446
Energy: 0.022415129127754965
Energy: 0.7298174031899577
Energy: 0.022367826171063275
Energy: 0.31480637796393446
Energy: 0.02221604847037238
Energy: 0.642028649674669
Energy: 1.6582099980871325
Energy: 0.6420404523148047
Energy: 0.02221604847037238
Energy: 0.642028649674669
Energy: 0.7304568098108282
Energy: 0.7298174031899577
Energy: 0.022367826171063275
Energy: 0.31480637796393446
Energy: 0.022415129127754965
Energy: 0.7298174031899577
Energy: 0.022367826171063275
Energy: 0.31480637796393446

minimum gb energy = 0.02221604847037238 eV
minimum distance =  2.46934699431995 Angstroms
sigma value = 5


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

Energy: 1.638233209824711
Energy: 1.655227438181185
Energy: 1.7133141270794534
Energy: 1.654696837912343
Energy: 1.6382332098182635
Energy: 1.6552274381876324
Energy: 1.714196942041635
Energy: 1.5017443244138495
Energy: 1.5692463320263992
Energy: 1.6876791223227083
Energy: 1.5446857326515786
Energy: 1.5017443244106257
Energy: 1.5692463320263992
Energy: 1.6876791223130378
Energy: 1.526161599360015
Energy: 1.522140102058039
Energy: 1.6985909203113545
Energy: 1.5632458774108249
Energy: 1.5261615993632385
Energy: 1.5221401020516503
Energy: 1.698590920314578
Energy: 1.63391819483978
Energy: 1.5969849397431568
Energy: 1.6875126969959866
Energy: 1.5471965379430024
Energy: 1.6339181948430035
Energy: 1.5969849397399334
Energy: 1.6875126969959866
Energy: 1.5397353939087168
Energy: 1.501546008457195
Energy: 1.6544322419577315
Energy: 1.5760867987199303
Energy: 1.5397353939183875
Energy: 1.501546008457195
Energy: 1.6544322419609554
Energy: 1.572714224165563
Energy: 1.5795664301706778
Energy: 1.6177208758044814
Energy: 1.5819286026916894
Energy: 1.572714224165563
Energy: 1.5795664301706778
Energy: 1.6177208758044814
Energy: 1.52234631666194
Energy: 1.618967801474681
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Energy: 1.6285625996253519
Energy: 1.5223463166587166
Energy: 1.6189678014779045
Energy: 1.681329630007613
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Energy: 1.5517375671674405
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Energy: 1.5860868734034013
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Energy: 1.5542926886145478
Energy: 1.503539164251042
Energy: 1.545130824657532
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Energy: 1.6516859992605346
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Energy: 1.5289032564247327
Energy: 1.6147439649999669
Energy: 1.6516859992637585
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Energy: 1.6120195181605121
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Energy: 1.6489459077782826
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Energy: 1.5594270769188445
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Energy: 1.6314871871448846
Energy: 1.6712555920545407
Energy: 1.5990785973079737
Energy: 1.6874336417316866
Energy: 1.5424333939161234
Energy: 1.671255592057764
Energy: 1.599078597301527
Energy: 1.6874336417316866
Energy: 1.522317609839149
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Energy: 1.6761952111996445
Energy: 1.5241186647157658
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Energy: 1.5063153036701238
Energy: 1.6780959192528544
Energy: 1.523309100715729
Energy: 1.5289146205660726
Energy: 1.5063153036733472
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Energy: 1.6523793718281965
Energy: 1.7082160987720854
Energy: 1.6763530998811893
Energy: 1.5825207139758806
Energy: 1.6523793718249729
Energy: 1.708216098775309
Energy: 1.5601087960987896
Energy: 1.5271505257450602
Energy: 1.5898703099626632
Energy: 1.5624321068916982
Energy: 1.5601087961052367
Energy: 1.5271505257450602
Energy: 1.5898703099562164
Energy: 1.5374963554793997
Energy: 1.5137248834057295
Energy: 1.7085598379836113
Energy: 1.556125216353004
Energy: 1.5374963554793997
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Energy: 1.5637793201711907
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Energy: 1.712926007455459
Energy: 1.5432450537332947
Energy: 1.5637793201647434
Energy: 1.5343211459529513
Energy: 1.7129260074522352
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Energy: 1.5148046371489599
Energy: 1.67489883162502
Energy: 1.589103825498699
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Energy: 1.6328339505051508
Energy: 1.6557769962036537
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Energy: 1.5231229271755327
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Energy: 1.6557769962036537
Energy: 1.5238032839237958
Energy: 1.5978831934571716
Energy: 1.758364450884159
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Energy: 1.5238032839173485
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Energy: 1.7583644508873826
Energy: 1.541895547624317
Energy: 1.5440675170414386
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Energy: 1.5817515733995315
Energy: 1.5418955476178697
Energy: 1.5440675170382152
Energy: 1.726235428184847
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Energy: 1.5912878383054438
Energy: 1.6516623081174073
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Energy: 1.6224674406674473
Energy: 1.66245798468717
Energy: 1.5425621505562561
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Energy: 1.6224674406674473
Energy: 1.6816933026719099
Energy: 1.5618134883410253
Energy: 1.523860883250357
Energy: 1.6359965812680541
Energy: 1.6214423183117954
Energy: 1.5618134883474724
Energy: 1.5238608832535805
Energy: 1.6359965812745012
Energy: 1.6186616150667485
Energy: 1.52013742500744
Energy: 1.6536891879081985
Energy: 1.5521847902475079
Energy: 1.618661615073196
Energy: 1.5201374250042166
Energy: 1.7062728221627077
Energy: 1.5866561296051502
Energy: 1.64592461111247
Energy: 1.668870973643872
Energy: 1.6117217070518914
Energy: 1.5866561296051502
Energy: 1.6459246111156933
Energy: 1.6688709736342011
Energy: 1.5776194041332168
Energy: 1.568715308730998
Energy: 1.7007955495481384
Energy: 1.5193033939618557
Energy: 1.5776194041396638
Energy: 1.568715308730998
Energy: 1.700795549544915
Energy: 1.5049878584245122
Energy: 1.578956990637097
Energy: 1.7341376764453285
Energy: 1.5357641562025706
Energy: 1.504987858427736
Energy: 1.5789569906403205
Energy: 1.7341376764388814
Energy: 1.527393874534152
Energy: 1.6015839464396644
Energy: 1.6962297164745466
Energy: 1.6095570665057037
Energy: 1.527393874534152
Energy: 1.6015839464461112
Energy: 1.6962297164745466
Energy: 1.5834192279682335
Energy: 1.5546857691411355
Energy: 1.592731792052318
Energy: 1.5649430232687933
Energy: 1.5834192279650101
Energy: 1.5546857691379121
Energy: 1.5927317920490944
Energy: 1.5620039598265185
Energy: 1.5944098658434673
Energy: 1.7761084847643482
Energy: 1.5207310596706909
Energy: 1.5620039598265185
Energy: 1.594409865840244
Energy: 1.7761084847643482
Energy: 1.5565858199060174
Energy: 1.5164372361760738
Energy: 1.7138733006145592
Energy: 1.5853590072774795
Energy: 1.556585819909241
Energy: 1.5164372361728502
Energy: 1.7138733006081708
Energy: 1.5267565271797043
Energy: 1.5219246439614704
Energy: 1.5953816624260064
Energy: 1.6006787081227416
Energy: 1.526756527176481
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Energy: 1.595381662416336
Energy: 1.522614733555019
Energy: 1.6184299865475233
Energy: 1.6794284341938592
Energy: 1.5521717912664519
Energy: 1.5226147335646898
Energy: 1.6184299865442997
Energy: 1.6794284341874124
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Energy: 1.5551788106055677
Energy: 1.6973270966658283
Energy: 1.5339130646102341
Energy: 1.510444526699996
Energy: 1.5551788106023443
Energy: 1.6973270966658283
Energy: 1.5236614190452666
Energy: 1.5373737712482545
Energy: 1.713949642396275
Energy: 1.5620869976037293
Energy: 1.5236614190452666
Energy: 1.5373737712514781
Energy: 1.713949642396275
Energy: 1.571483237830613
Energy: 1.5509409549207924
Energy: 1.6650510703866621
Energy: 1.5610203689275681
Energy: 1.5714832378338366
Energy: 1.5509409549175688
Energy: 1.6650510703834387
Energy: 1.5860165088620666
Energy: 1.6210460225671153
Energy: 1.6858728739258488
Energy: 1.6053438953952242
Energy: 1.5860165088652902
Energy: 1.6210460225638919
Energy: 1.6858728739290727
Energy: 1.5982376584879374
Energy: 1.5376533765696867
Energy: 1.6412314221905
Energy: 1.5807444041804348
Energy: 1.5982376584879374
Energy: 1.5376533765696867
Energy: 1.6412314221872764
Energy: 1.588309863835955
Energy: 1.523878868982366
Energy: 1.6758331236179174
Energy: 1.5399954505423288
Energy: 1.5883098638391788
Energy: 1.5238788689791423
Energy: 1.675833123621141
Energy: 1.6905649387242638
Energy: 1.5594954391429823
Energy: 1.6855074302595208
Energy: 1.5970249876319313
Energy: 1.6905649387210406
Energy: 1.5594954391429823
Energy: 1.6855074302659676
Energy: 1.5841266684722164
Energy: 1.5762261548032888
Energy: 1.6712985163551064
Energy: 1.5996510821378398
Energy: 1.584126668481887
Energy: 1.5762261548129595
Energy: 1.6712985163486593
Energy: 1.511264813730563
Energy: 1.5366093220094474
Energy: 1.7089058637495713
Energy: 1.533643283877081
Energy: 1.511264813730563
Energy: 1.5366093220158947
Energy: 1.708905863743124
Energy: 1.527114349058757
Energy: 1.601781428880469
Energy: 1.7210051752168227
Energy: 1.6614763268671557
Energy: 1.527114349058757
Energy: 1.6017814288772454
Energy: 1.7210051752168227
Energy: 1.5033668061918217
Energy: 1.6012366491259726
Energy: 1.6118601845452893
Energy: 1.5358155407567924
Energy: 1.5033668061949865
Energy: 1.6012366491227492
Energy: 1.6118601845485128

minimum gb energy = 1.501546008457195 eV
minimum distance =  2.22193258247952 Angstroms
sigma value = 401


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

Energy: 1.655764547899638
Energy: 1.5782062767789768
Energy: 1.7266879105642419
Energy: 1.5694750308184149
Energy: 1.6557645478959788
Energy: 1.5782062767789768
Energy: 1.730007879190509
Energy: 1.5250186404264505
Energy: 1.5073925807420931
Energy: 1.7461392306299528
Energy: 1.5765545907420138
Energy: 1.5250186404227912
Energy: 1.5073925807420931
Energy: 1.7434698954893975
Energy: 1.559141819040676
Energy: 1.532530138031244
Energy: 1.6627354424393737
Energy: 1.5829604796656145
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Energy: 1.532530138031244
Energy: 1.6627354424393737
Energy: 1.6021698547811942
Energy: 1.5788797180644973
Energy: 1.6550099693638778
Energy: 1.6042703694852956
Energy: 1.6021698547775354
Energy: 1.5788797180644973
Energy: 1.654592206247025
Energy: 1.5870725483922676
Energy: 1.5317183310676412
Energy: 1.6177543352715598
Energy: 1.5475547164028276
Energy: 1.5870725483886088
Energy: 1.5317183310749591
Energy: 1.5822582150107578
Energy: 1.5549311300474196
Energy: 1.5380459969778946
Energy: 1.567343575847727
Energy: 1.586825974785321
Energy: 1.5549311300437605
Energy: 1.5380459969778946
Energy: 1.6001381147794564
Energy: 1.5873321396733484
Energy: 1.5933836363241105
Energy: 1.5748574375437245
Energy: 1.5896742727260162
Energy: 1.5873321396770075
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Energy: 1.5480398203967354
Energy: 1.5766336644012886
Energy: 1.5512069077207153
Energy: 1.6676043080071772
Energy: 1.590201232462059
Energy: 1.5766336644049475
Energy: 1.5512069077207153
Energy: 1.6832722802121625
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Energy: 1.6292281988958317
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Energy: 1.578195428527538
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Energy: 1.6524416870415315
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Energy: 1.5315404500596599
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Energy: 1.5344176811159376
Energy: 1.5569420118105186
Energy: 1.5315404500596599
Energy: 1.70399377115926
Energy: 1.5194516307075574
Energy: 1.5920875229945086
Energy: 1.7224671617076917
Energy: 1.556396884626801
Energy: 1.5194516307112163
Energy: 1.5920875229945086
Energy: 1.7159855522186294
Energy: 1.6041554684711938
Energy: 1.5782062767789768
Energy: 1.730007879190509
Energy: 1.5694750308184149
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Energy: 1.730007879190509
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Energy: 1.7434698954893975
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Energy: 1.532530138031244
Energy: 1.6627354424393737
Energy: 1.6021698547811942
Energy: 1.56420930000342
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Energy: 1.5760757455827668
Energy: 1.5512069077207153
Energy: 1.6832722802121625
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Energy: 1.5510765498962495
Energy: 1.626914476965579
Energy: 1.5150676329230408
Energy: 1.5397231843170514
Energy: 1.5510765498962495
Energy: 1.6269144769582609
Energy: 1.5987290715447282
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Energy: 1.651892023085166
Energy: 1.5157707511372924
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Energy: 1.7552234835590268
Energy: 1.5861214387120535
Energy: 1.602306108128386
Energy: 1.6439080590717925
Energy: 1.7059155989956096
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Energy: 1.6439080590717925
Energy: 1.7214224397030358
Energy: 1.55555528247694
Energy: 1.5315404500596599
Energy: 1.717987652513941
Energy: 1.5344176811159376
Energy: 1.555555282480599
Energy: 1.5315404500596599
Energy: 1.682942806380075
Energy: 1.513463472870096
Energy: 1.5920875229945086
Energy: 1.7191865024105413
Energy: 1.556396884626801
Energy: 1.5134634728737553
Energy: 1.5920875229945086
Energy: 1.7159855522186294
Energy: 1.655764547899638
Energy: 1.5782062767789768
Energy: 1.7266879105642419
Energy: 1.5694750308184149
Energy: 1.6557645478959788
Energy: 1.578206276775318
Energy: 1.730007879190509
Energy: 1.5250186404301092
Energy: 1.5073925807420931
Energy: 1.7461392306299528
Energy: 1.5765545907456728
Energy: 1.5250186404227912
Energy: 1.5073925807420931
Energy: 1.7434698954893975
Energy: 1.559141819044335
Energy: 1.532530138031244
Energy: 1.6627354424393737
Energy: 1.5829604796656145
Energy: 1.5591418190479942
Energy: 1.532530138031244
Energy: 1.6627354424393737
Energy: 1.6021698547811942
Energy: 1.5788797180644973
Energy: 1.6511701544316009
Energy: 1.6042703694816363
Energy: 1.602169854773876
Energy: 1.5788797180644973
Energy: 1.6550099693602187
Energy: 1.5870725483922676
Energy: 1.5317183310676412
Energy: 1.6189509743581652
Energy: 1.5475547164028276
Energy: 1.5870725483886088
Energy: 1.5317183310749591
Energy: 1.5822582150107578
Energy: 1.5549311300474196
Energy: 1.5380459969742355
Energy: 1.567343575847727
Energy: 1.5868259747816622
Energy: 1.5549311300437605
Energy: 1.5380459969778946
Energy: 1.6001381147831153
Energy: 1.5873321396733484
Energy: 1.5933836363241105
Energy: 1.6035717889114183
Energy: 1.5896742727260162
Energy: 1.5873321396733484
Energy: 1.5933836363204514
Energy: 1.6693762406307386
Energy: 1.5766336644049475
Energy: 1.5512069077207153
Energy: 1.6676043080071772
Energy: 1.5902012324657175
Energy: 1.5766336644086067
Energy: 1.5512069077207153
Energy: 1.6832722802085032
Energy: 1.5397231843170514
Energy: 1.5510765498962495
Energy: 1.578195428527538
Energy: 1.5150676329230408
Energy: 1.5397231843170514
Energy: 1.5510765498962495
Energy: 1.578195428527538
Energy: 1.5987290715447282
Energy: 1.7552234835626859
Energy: 1.5861214387120535
Energy: 1.5157707511372924
Energy: 1.598729071548387
Energy: 1.7552234835590268
Energy: 1.5861214387120535
Energy: 1.602306108128386
Energy: 1.6524416870415315
Energy: 1.721422439710354
Energy: 1.5158423149246423
Energy: 1.602306108128386
Energy: 1.6524416870415315
Energy: 1.7214224397066948
Energy: 1.5569420118105186
Energy: 1.5315404500596599
Energy: 1.682942806380075
Energy: 1.5344176811159376
Energy: 1.5569420118105186
Energy: 1.5315404500596599
Energy: 1.677639470408356
Energy: 1.5194516307075574
Energy: 1.5920875229945086
Energy: 1.7159855522186294
Energy: 1.556396884626801
Energy: 1.5194516307112163
Energy: 1.5920875229945086
Energy: 1.7159855522186294
Energy: 1.6041554684711938
Energy: 1.5782062767789768
Energy: 1.7300078791868496
Energy: 1.5694750308184149
Energy: 1.6041554684711938
Energy: 1.5782062767789768
Energy: 1.730007879190509
Energy: 1.5250186404301092
Energy: 1.5073925807420931
Energy: 1.7434698954930565
Energy: 1.582032630740244
Energy: 1.5250186404227912
Energy: 1.5073925807420931
Energy: 1.7434698954893975

minimum gb energy = 1.5073925807420931 eV
minimum distance =  2.22481966232604 Angstroms
sigma value = 311


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

Energy: 1.597538195325355
Energy: 1.5793859985094316
Energy: 1.781296428472394
Energy: 1.580127601710764
Energy: 1.5975381953240873
Energy: 1.5793859985102767
Energy: 1.7440378680965525
Energy: 1.6455052131546632
Energy: 1.589231253615712
Energy: 1.7035732611200611
Energy: 1.643550283082194
Energy: 1.6455052131542407
Energy: 1.589231253614867
Energy: 1.7035732611209062
Energy: 1.5854884209298605
Energy: 1.586567344161809
Energy: 1.7536283000814186
Energy: 1.586464901495139
Energy: 1.585488420928593
Energy: 1.5865673441622314
Energy: 1.7429307072784053
Energy: 1.5865526064529396
Energy: 1.548572628877342
Energy: 1.7250621265294084
Energy: 1.5326465462898042
Energy: 1.5865526064525168
Energy: 1.5485726288769193
Energy: 1.7250621265294084
Energy: 1.5936164936594528
Energy: 1.5855759312822595
Energy: 1.6036779982787945
Energy: 1.58804839169147
Energy: 1.5936164936611428
Energy: 1.5855759312826823
Energy: 1.6539446795121961
Energy: 1.577731659770093
Energy: 1.5522179830137268
Energy: 1.6381138752800508
Energy: 1.590834705806131
Energy: 1.5777316597696707
Energy: 1.5522179830120366
Energy: 1.6381138752800508
Energy: 1.6235301153712014
Energy: 1.6599148879449122
Energy: 1.6950876756428945
Energy: 1.5818219441674017
Energy: 1.6235301153703563
Energy: 1.6599148879440673
Energy: 1.6845831154206976
Energy: 1.584741335858831
Energy: 1.5628231604341627
Energy: 1.7771951092732574
Energy: 1.5588342058047822
Energy: 1.5847413358575637
Energy: 1.5628231604337404
Energy: 1.7771951092724125
Energy: 1.5903622359606866
Energy: 1.536506382068687
Energy: 1.7501756908421815
Energy: 1.5636282810587538
Energy: 1.590362235960264
Energy: 1.5365063820699547
Energy: 1.750175690841759
Energy: 1.5967951769649973
Energy: 1.589287403373519
Energy: 1.814503816602212
Energy: 1.6568577119582
Energy: 1.5967951769633073
Energy: 1.5892874033722517
Energy: 1.8145038166034797
Energy: 1.646493162715581
Energy: 1.6089704200607662
Energy: 1.7177683045429022
Energy: 1.5466019029869316
Energy: 1.6464931627134685
Energy: 1.6089704200637238
Energy: 1.7177683045424799
Energy: 1.5994029429368732
Energy: 1.578596788526092
Energy: 1.6996459250476292
Energy: 1.5863284261143016
Energy: 1.599402942935183
Energy: 1.5785967885265146
Energy: 1.6996459250484743
Energy: 1.5995977654227158
Energy: 1.57486931434824
Energy: 1.6910026021114852
Energy: 1.580030369804404
Energy: 1.5995977654214482
Energy: 1.5748693143473946
Energy: 1.6910026021123303
Energy: 1.5689190490077187
Energy: 1.5833744545935327
Energy: 1.706628101479977
Energy: 1.5936946990092369
Energy: 1.568919049009409
Energy: 1.5833744545935327
Energy: 1.706628101479132
Energy: 1.6124675531672574
Energy: 1.556517685130043
Energy: 1.714336705540128
Energy: 1.5752966845747993
Energy: 1.6124675531681023
Energy: 1.556517685130043
Energy: 1.714336705540128
Energy: 1.6009128785808961
Energy: 1.5861684488571854
Energy: 1.651173578819406
Energy: 1.5940688130096865
Energy: 1.600912878580051
Energy: 1.5861684488584529
Energy: 1.6511735788215183
Energy: 1.6498340851967668
Energy: 1.5366108234949145
Energy: 1.714437270900932
Energy: 1.585122796618949
Energy: 1.6498340851963444
Energy: 1.5366108234940696
Energy: 1.714437270900087
Energy: 1.5986063779682769
Energy: 1.6467740945964144
Energy: 1.7840598606247462
Energy: 1.5950004231754664
Energy: 1.5986063779670092
Energy: 1.6467740945989495
Energy: 1.7840598606272813
Energy: 1.5770395339539263
Energy: 1.5518813418567379
Energy: 1.7535084409679063
Energy: 1.5502620457124041
Energy: 1.5770395339526584
Energy: 1.5518813418554704
Energy: 1.7535084409670612
Energy: 1.5600635030804815
Energy: 1.5443509392219916
Energy: 1.7828195435804133
Energy: 1.5520349848679937
Energy: 1.5600635030809042
Energy: 1.5443509392211465
Energy: 1.7828195435808358
Energy: 1.6140625852257429
Energy: 1.573460061330212
Energy: 1.6724857328784106
Energy: 1.6678716356461711
Energy: 1.6140625852270105
Energy: 1.573460061331902
Energy: 1.6724857328762983
Energy: 1.5774573351732295
Energy: 1.6136429998813193
Energy: 1.655038888436099
Energy: 1.5437448568808345
Energy: 1.577457335171117
Energy: 1.6136429998830093
Energy: 1.6550388884356764
Energy: 1.5939789020436823
Energy: 1.5682241095761118
Energy: 1.6665669163526455
Energy: 1.5889490576667402
Energy: 1.5939789020445274
Energy: 1.5682241095748444
Energy: 1.666566916352223
Energy: 1.5776507045739256
Energy: 1.5324367703011703
Energy: 1.7648736967190894
Energy: 1.567067968507124
Energy: 1.5776507045747703
Energy: 1.5324367703020154
Energy: 1.7648736967195118
Energy: 1.613066656036476
Energy: 1.6015924767470828
Energy: 1.6714137051156217
Energy: 1.5852118804880184
Energy: 1.6130666560377436
Energy: 1.601592476748773
Energy: 1.6714137051130864
Energy: 1.6715931876737509
Energy: 1.6262352483317442
Energy: 1.6912472098776847
Energy: 1.5861026252006514
Energy: 1.6715931876741734
Energy: 1.626235248334279
Energy: 1.6912472098781073
Energy: 1.612580433155751
Energy: 1.5800589328466388
Energy: 1.7094484346591798
Energy: 1.5878410760408814
Energy: 1.6125804331582858
Energy: 1.5800589328470616
Energy: 1.7094484346596022
Energy: 1.6135817401339272
Energy: 1.5896349151971272
Energy: 1.6957012190785312
Energy: 1.643860906131438
Energy: 1.6135817401318147
Energy: 1.5896349151979725
Energy: 1.695701219078109
Energy: 1.5789249395367706
Energy: 1.5866539547084697
Energy: 1.7801754722708103
Energy: 1.5790262557681904
Energy: 1.578924939536348
Energy: 1.586653954707202
Energy: 1.7801754722716556
Energy: 1.5775241663487667
Energy: 1.545778954295465
Energy: 1.7582509454755064
Energy: 1.5559457379417734
Energy: 1.577524166350879
Energy: 1.545778954295465
Energy: 1.7582509454763515
Energy: 1.5945383324222098
Energy: 1.5883039090766122
Energy: 1.7039579341757287
Energy: 1.568587830462401
Energy: 1.5945383324226323
Energy: 1.588303909073232
Energy: 1.7039579341769964
Energy: 1.5696756949474528
Energy: 1.542778860324834
Energy: 1.6384582925752043
Energy: 1.583536621124746
Energy: 1.569675694948298
Energy: 1.5427788603252566
Energy: 1.6384582925743594
Energy: 1.6023607205469064
Energy: 1.6842609418463734
Energy: 1.6043095568828827
Energy: 1.5731704953690884
Energy: 1.6023607205490191
Energy: 1.6842609418463734
Energy: 1.604309556883728
Energy: 1.5848826089115298
Energy: 1.563136292559695
Energy: 1.805792617952537
Energy: 1.6054592621952006
Energy: 1.584882608911107
Energy: 1.56313629256054
Energy: 1.805792617954227
Energy: 1.576991462938875
Energy: 1.5367114759589957
Energy: 1.766161840663324
Energy: 1.5767740806857458
Energy: 1.57699146293803
Energy: 1.5367114759581504
Energy: 1.7661618406645916
Energy: 1.5985167788552737
Energy: 1.5886386485920492
Energy: 1.7616456262306175
Energy: 1.612693961890027
Energy: 1.598516778854006
Energy: 1.5886386485924717
Energy: 1.7616456262323075

minimum gb energy = 1.5324367703011703 eV
minimum distance =  2.20180919717101 Angstroms
sigma value = 39


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

Energy: 1.5935787791765932
Energy: 1.6003010742492145
Energy: 1.666282851395704
Energy: 1.5984646637196733
Energy: 1.5935787791780889
Energy: 1.6003010742477186
Energy: 1.595716510680085
Energy: 1.5369483070202814
Energy: 1.5600305780009251
Energy: 1.5339572358923839
Energy: 1.5596607037316623
Energy: 1.536948307019284
Energy: 1.5600305779999277
Energy: 1.53395723589388
Energy: 1.5935975987346012
Energy: 1.5055525050019147
Energy: 1.5766273899698646
Energy: 1.5725683230283487
Energy: 1.593597598730612
Energy: 1.5055525050029122
Energy: 1.5766273899728562
Energy: 1.5779524624429242
Energy: 1.5599270829820537
Energy: 1.5332389985769863
Energy: 1.5812705653490655
Energy: 1.5779524624399324
Energy: 1.559927082983051
Energy: 1.5332389985774848
Energy: 1.5991676246418947
Energy: 1.5016020992485184
Energy: 1.5671226301289454
Energy: 1.5726692796800406
Energy: 1.5991676246418947
Energy: 1.5016020992485184
Energy: 1.5026407811392408
Energy: 1.577926565643633
Energy: 1.529909056662596
Energy: 1.5611118717050603
Energy: 1.5830198677257095
Energy: 1.577926565648619
Energy: 1.5299090566665854
Energy: 1.5611118717095482
Energy: 1.7197194226044707
Energy: 1.5017100028533126
Energy: 1.5909844266121975
Energy: 1.5723989897527824
Energy: 1.7197194226124493
Energy: 1.501710002855806
Energy: 1.5167360348303862
Energy: 1.5783864065604725
Energy: 1.5022567223145376
Energy: 1.709165296373244
Energy: 1.5022910516193249
Energy: 1.5783864065549875
Energy: 1.502256722315535
Energy: 1.7091652963772335
Energy: 1.7199478025361208
Energy: 1.5724346845658397
Energy: 1.6232511798560383
Energy: 1.5016933195189237
Energy: 1.7199478025306358
Energy: 1.572434684565341
Energy: 1.6232511798580327
Energy: 1.5779145903296996
Energy: 1.5809911729387125
Energy: 1.561102928466103
Energy: 1.5299282781154313
Energy: 1.57791459033319
Energy: 1.58099117293971
Energy: 1.561102928465106
Energy: 1.5991345072473895
Energy: 1.5727652353268442
Energy: 1.642492797018062
Energy: 1.5015274389443702
Energy: 1.5991345072488854
Energy: 1.5727652353263455
Energy: 1.7073020885567056
Energy: 1.5777938157445672
Energy: 1.5820208662150264
Energy: 1.5335647896330553
Energy: 1.5599452857053413
Energy: 1.5777938157460634
Energy: 1.582020866214029
Energy: 1.5335647896330553
Energy: 1.5934879740874823
Energy: 1.572638955414069
Energy: 1.5902789350882292
Energy: 1.5055299788363066
Energy: 1.5934879740914716
Energy: 1.572638955415066
Energy: 1.6053520956005023
Energy: 1.536929827168406
Energy: 1.5596420713823522
Energy: 1.5341262061929892
Energy: 1.5602491366578692
Energy: 1.536929827171398
Energy: 1.5596420713788617
Energy: 1.5341262061924905
Energy: 1.5935787791765932
Energy: 1.6003010742502117
Energy: 1.5957165106840743
Energy: 1.5984646637276514
Energy: 1.5935787791775902
Energy: 1.6003010742477186
Energy: 1.5957165106790878
Energy: 1.5369483070202814
Energy: 1.5600305779989303
Energy: 1.5339572358928826
Energy: 1.5596607037311636
Energy: 1.536948307019284
Energy: 1.560030577999429
Energy: 1.5339572358933813
Energy: 1.5935975987346012
Energy: 1.5055525050029122
Energy: 1.5766273899698646
Energy: 1.5725683230273513
Energy: 1.5935975987301132
Energy: 1.5055525050029122
Energy: 1.576627389971859
Energy: 1.5779524624419268
Energy: 1.5599270829820537
Energy: 1.5332389985769863
Energy: 1.5812705653475698
Energy: 1.5779524624399324
Energy: 1.5599270829825522
Energy: 1.5332389985774848
Energy: 1.5991676246413964
Energy: 1.50160209924802
Energy: 1.502640781137745
Energy: 1.5726692796800406
Energy: 1.599167624642892
Energy: 1.5016020992485184
Energy: 1.5026407811367475
Energy: 1.5779265656431343
Energy: 1.5299090566635933
Energy: 1.5611118717060577
Energy: 1.5830198677252105
Energy: 1.577926565648619
Energy: 1.5299090566675824
Energy: 1.561111871710047
Energy: 1.7197194226049695
Energy: 1.5017100028518164
Energy: 1.5011986720354233
Energy: 1.572398989752284
Energy: 1.7197194226124493
Energy: 1.501710002853811
Energy: 1.5011986720319328
Energy: 1.5783864065599738
Energy: 1.5022567223130419
Energy: 1.709165296373244
Energy: 1.5022910516188261
Energy: 1.5783864065554862
Energy: 1.5022567223150363
Energy: 1.7091652963777322
Energy: 1.7199478025381152
Energy: 1.572434684565341
Energy: 1.5809451311892568
Energy: 1.501693319518425
Energy: 1.7199478025321315
Energy: 1.5724346845648423
Energy: 1.5809451311907525
Energy: 1.577914590329201
Energy: 1.5809911729392112
Energy: 1.5611029284656044
Energy: 1.5299282781154313
Energy: 1.5779145903326912
Energy: 1.580991172940707
Energy: 1.5611029284646072
Energy: 1.5991345072538719
Energy: 1.572765235327343
Energy: 1.7097815281333486
Energy: 1.5015274389438718
Energy: 1.5991345072513787
Energy: 1.5727652353268442
Energy: 1.7097815281348445
Energy: 1.57779381574357
Energy: 1.5820208662135302
Energy: 1.533564789632058
Energy: 1.5599452857053413
Energy: 1.5777938157460634
Energy: 1.5820208662145276
Energy: 1.5335647896325566
Energy: 1.5934879740874823
Energy: 1.572638955414069
Energy: 1.5506634141393965
Energy: 1.5055299788358079
Energy: 1.5934879740909729
Energy: 1.572638955415066
Energy: 1.5506634141438842
Energy: 1.536929827168406
Energy: 1.5596420713833494
Energy: 1.5341262061939867
Energy: 1.5602491366588667
Energy: 1.5369298271718967
Energy: 1.5596420713788617
Energy: 1.5341262061919922
Energy: 1.5935787791775902
Energy: 1.6003010742492145
Energy: 1.5957165106860687
Energy: 1.5984646637485946
Energy: 1.5935787791780889
Energy: 1.6003010742477186
Energy: 1.595716510679586
Energy: 1.5369483070202814
Energy: 1.5600305780009251
Energy: 1.5339572358933813
Energy: 1.5596607037311636
Energy: 1.5369483070197827
Energy: 1.5600305780004264
Energy: 1.5339572358933813

minimum gb energy = 1.5011986720319328 eV
minimum distance =  2.26135881968933 Angstroms
sigma value = 21


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

Energy: 1.6240842161221074
Energy: 1.696800941750977
Energy: 1.8793538829303649
Energy: 1.6968810828413126
Energy: 1.6240842161221074
Energy: 1.6968009417521874
Energy: 1.6556383285115464
Energy: 1.655041378502984
Energy: 1.562033042414551
Energy: 1.6221514927284588
Energy: 1.5612066656035049
Energy: 1.6550413785017732
Energy: 1.562033042414551
Energy: 1.6221514927290641
Energy: 1.6149233233176876
Energy: 1.6142706365825987
Energy: 1.6968561513906695
Energy: 1.5935075241092787
Energy: 1.6149233233164768
Energy: 1.6142706365825987
Energy: 1.6968561513894587
Energy: 1.6480007046875005
Energy: 1.5616750824939878
Energy: 1.7292495878675316
Energy: 1.5679866444381825
Energy: 1.6480007046868954
Energy: 1.5616750824933823
Energy: 1.7292495878669267
Energy: 1.5685873823355514
Energy: 1.6260858192938585
Energy: 1.6016745175716494
Energy: 1.5652251191329252
Energy: 1.5685873823343404
Energy: 1.6260858192920429
Energy: 1.6016745175716494
Energy: 1.6479587445897728
Energy: 1.5709002440081203
Energy: 1.6690254256577024
Energy: 1.5697431788860736
Energy: 1.6479587445879567
Energy: 1.5709002440081203
Energy: 1.6690254256583077
Energy: 1.5722048067847707
Energy: 1.6258987554929012
Energy: 1.576961283763058
Energy: 1.5689613901925263
Energy: 1.5722048067847707
Energy: 1.6258987554941118
Energy: 1.5769612837612696
Energy: 1.6151263885251734
Energy: 1.6228042051944436
Energy: 1.626224745056533
Energy: 1.5698130653568207
Energy: 1.6151263885263838
Energy: 1.6228042051968652
Energy: 1.626224745055928
Energy: 1.5639115180235534
Energy: 1.5795244028435231
Energy: 1.5993630797574285
Energy: 1.672499269941269
Energy: 1.563911518024764
Energy: 1.5795244028435231
Energy: 1.599363079756823
Energy: 1.5701409507154227
Energy: 1.6057867429481236
Energy: 1.550580317961855
Energy: 1.568181787921218
Energy: 1.5701409507166333
Energy: 1.605786742947518
Energy: 1.5505803179612496
Energy: 1.5579599713783014
Energy: 1.623964318981106
Energy: 1.5924650900939308
Energy: 1.5859408495614784
Energy: 1.5579599713783014
Energy: 1.62396431897929
Energy: 1.599080024955159
Energy: 1.5379001802077226
Energy: 1.5730501379963182
Energy: 1.5661572033872693
Energy: 1.5462527895880702
Energy: 1.5379001802089332
Energy: 1.5730501379981339
Energy: 1.5661572033872693
Energy: 1.5563598231762956
Energy: 1.5438756957521373
Energy: 1.6754846419712734
Energy: 1.5736530733921663
Energy: 1.5563598231762956
Energy: 1.5438756957521373
Energy: 1.6754846419712734
Energy: 1.537933030669721
Energy: 1.5762150307763207
Energy: 1.6092081429561353
Energy: 1.6068714001481001
Energy: 1.5379330306691161
Energy: 1.5762150307769258
Energy: 1.6092081429555298
Energy: 1.642179549625953
Energy: 1.5556043947054605
Energy: 1.627368336915668
Energy: 1.5788318973515645
Energy: 1.6421795496265583
Energy: 1.555604394704855
Energy: 1.6273683369162735
Energy: 1.508234000851077
Energy: 1.6292528929022345
Energy: 1.609536497660486
Energy: 1.6220614072424941
Energy: 1.5082340008492612
Energy: 1.62925289290284
Energy: 1.6095364976592754
Energy: 1.6428047556915435
Energy: 1.5554808322365383
Energy: 1.6476575630307657
Energy: 1.566397525411322
Energy: 1.6428047556897276
Energy: 1.5554808322371434
Energy: 1.6476575630301606
Energy: 1.5084161270519798
Energy: 1.5784368033325686
Energy: 1.590631115973479
Energy: 1.6071103734371404
Energy: 1.5084161270501641
Energy: 1.5784368033319636
Energy: 1.5906311159728737
Energy: 1.6019951766912077
Energy: 1.5553555289412315
Energy: 1.6075110431114328
Energy: 1.5667480227318362
Energy: 1.6019951766906024
Energy: 1.5553555289412315
Energy: 1.607511043110222
Energy: 1.50851670977604
Energy: 1.556659531434272
Energy: 1.5481607059040754
Energy: 1.5565913200420263
Energy: 1.50851670977604
Energy: 1.5566595314348772
Energy: 1.5481607059022595
Energy: 1.6019907750573152
Energy: 1.5668856590447282
Energy: 1.6072580075199976
Energy: 1.5553624606740153
Energy: 1.6019907750579205
Energy: 1.5668856590471494
Energy: 1.607258007523024
Energy: 1.508360341637289
Energy: 1.60712099342127
Energy: 1.5906080777081952
Energy: 1.5784784660445046
Energy: 1.5083603416384996
Energy: 1.6071209934236914
Energy: 1.5906080777081952
Energy: 1.6422122446329008
Energy: 1.5666801764645029
Energy: 1.6086957303738598
Energy: 1.555326730616323
Energy: 1.6422122446341119
Energy: 1.5666801764651084
Energy: 1.6086957303720713
Energy: 1.508218327811935
Energy: 1.6222354701422141
Energy: 1.6093041094917757
Energy: 1.6293056668751433
Energy: 1.5082183278107244
Energy: 1.6222354701416086
Energy: 1.6093041094911709
Energy: 1.64443801518649
Energy: 1.5785397491933706
Energy: 1.7220582978922736
Energy: 1.5556012266305426
Energy: 1.6444380151877005
Energy: 1.57853974919216
Energy: 1.7220582978904573

minimum gb energy = 1.5082183278107244 eV
minimum distance =  2.19389367942682 Angstroms
sigma value = 113


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

Energy: 1.677527374249349
Energy: 1.664903905416261
Energy: 1.6214233948060743
Energy: 1.665122296172725
Energy: 1.6775273742459709
Energy: 1.664903905416261
Energy: 1.6605304642830798
Energy: 1.7184302279401023
Energy: 1.591249887938978
Energy: 1.6852602996315866
Energy: 1.5918817425593041
Energy: 1.7184302279401023
Energy: 1.5912498879423562
Energy: 1.6852602996417216
Energy: 1.6759661389137277
Energy: 1.592411546899092
Energy: 1.739882024997175
Energy: 1.5990074991948158
Energy: 1.6759661389137277
Energy: 1.5924115469058486
Energy: 1.739882024997175
Energy: 1.5299538942044715
Energy: 1.6210185527236478
Energy: 1.7567837852791357
Energy: 1.6260807282488299
Energy: 1.529953894201093
Energy: 1.6210185527236478
Energy: 1.7567837852791357
Energy: 1.6948039968793185
Energy: 1.509748690876712
Energy: 1.6597406433078468
Energy: 1.5241984647735765
Energy: 1.69480399687594
Energy: 1.5097486908733337
Energy: 1.659740643311225
Energy: 1.5248711946901525
Energy: 1.559507252160088
Energy: 1.7565344273531693
Energy: 1.5343383992107795
Energy: 1.5248711946969093
Energy: 1.559507252153331
Energy: 1.756534427349791
Energy: 1.6093934002485437
Energy: 1.5219606241678167
Energy: 1.6531469354975359
Energy: 1.5344314691983936
Energy: 1.6093934002417871
Energy: 1.5219606241644383
Energy: 1.6531469354941575
Energy: 1.524777718517891
Energy: 1.5511625405404654
Energy: 1.7084695666995735
Energy: 1.5061365290978996
Energy: 1.5247777185212694
Energy: 1.5511625405404654
Energy: 1.7084695666995735
Energy: 1.627065857917607
Energy: 1.5406777848725532
Energy: 1.7467826003186417
Energy: 1.525748628025016
Energy: 1.6270658579142285
Energy: 1.5406777848759314
Energy: 1.7467826003152633
Energy: 1.4895551843445387
Energy: 1.560368303447926
Energy: 1.6768403904268485
Energy: 1.5411654319241241
Energy: 1.4895551843512953
Energy: 1.5603683034445477
Energy: 1.6768403904234703
Energy: 1.5682956745561534
Energy: 1.6020802715361768
Energy: 1.7175403891850745
Energy: 1.5231194719118706
Energy: 1.5682956745561534
Energy: 1.6020802715429336
Energy: 1.7175403891850745
Energy: 1.510472525858832
Energy: 1.5514662618223563
Energy: 1.833616951382279
Energy: 1.5314716816799991
Energy: 1.510472525858832
Energy: 1.5514662618291128
Energy: 1.833616951382279
Energy: 1.5727178400211907
Energy: 1.5639576355423408
Energy: 1.6890686566082318
Energy: 1.5128043463990668
Energy: 1.5727178400313258
Energy: 1.563957635535584
Energy: 1.7211816671143554
Energy: 1.6495680464256255
Energy: 1.6183918001291497
Energy: 1.8426637761983375
Energy: 1.5658666251713973
Energy: 1.6495680464222473
Energy: 1.6183918001325281
Energy: 1.8426637761983375
Energy: 1.572803409273218
Energy: 1.632968603370462
Energy: 1.8334199033197016
Energy: 1.6156857924395753
Energy: 1.5728034092698395
Energy: 1.6329686033637054
Energy: 1.8334199033163232
Energy: 1.6494239071333712
Energy: 1.5096713111166369
Energy: 1.6967173259768515
Energy: 1.5312602094661247
Energy: 1.6494239071333712
Energy: 1.5096713111132585
Energy: 1.6967173259836084
Energy: 1.628633815968764
Energy: 1.565921045079896
Energy: 1.8038602743263967
Energy: 1.5146707410019389
Energy: 1.6286338159620073
Energy: 1.565921045079896
Energy: 1.8378506759291864
Energy: 1.551785284190066
Energy: 1.5056377867593775
Energy: 1.7584955431367102
Energy: 1.5309287193198862
Energy: 1.5517852841866875
Energy: 1.5056377867661344
Energy: 1.7584955431367102
Energy: 1.628682807121231
Energy: 1.573322894633649
Energy: 1.7291903147697778
Energy: 1.5601488413880436
Energy: 1.628682807121231
Energy: 1.573322894633649
Energy: 1.7291903147697778
Energy: 1.5163568891793318
Energy: 1.5123693260906919
Energy: 1.7091825127636069
Energy: 1.4929271570857237
Energy: 1.516356889172575
Energy: 1.5123693260873134
Energy: 1.7091825127602285
Energy: 1.572005283388617
Energy: 1.5109504929396371
Energy: 1.7035134145894348
Energy: 1.618586594490906
Energy: 1.5720052833852383
Energy: 1.5109504929328805
Energy: 1.7035134145961917
Energy: 1.4837584364730805
Energy: 1.511001672474878
Energy: 1.6717306380560568
Energy: 1.5178642970846916
Energy: 1.4837584364730805
Energy: 1.5110016724714996
Energy: 1.6717306380560568
Energy: 1.5715756982487552
Energy: 1.4992500930485972
Energy: 1.7392692893959116
Energy: 1.6133416075104943
Energy: 1.5715756982555118
Energy: 1.499250093055354
Energy: 1.73926928939929
Energy: 1.60360837151046
Energy: 1.5167916667228074
Energy: 1.6764781551773333
Energy: 1.5108495233460444
Energy: 1.60360837151046
Energy: 1.5167916667228074
Energy: 1.6764781551705765
Energy: 1.5957207934605047
Energy: 1.588280322794612
Energy: 1.7067251119477993
Energy: 1.6684749128493146
Energy: 1.5957207934503697
Energy: 1.5882803227912337
Energy: 1.706725111954556
Energy: 1.5920195128744528
Energy: 1.5951090481521655
Energy: 1.7645747097266986
Energy: 1.5867889478973196
Energy: 1.592019512877831
Energy: 1.595109048155544
Energy: 1.764574709730077
Energy: 1.6599590700763796
Energy: 1.5679829167495234
Energy: 1.6684761611445513
Energy: 1.6735698213466745
Energy: 1.6599590700662445
Energy: 1.5679829167562802
Energy: 1.668476161141173
Energy: 1.566027759236117
Energy: 1.660115566130082
Energy: 1.713886522284955
Energy: 1.6566046639418301
Energy: 1.5660277592394953
Energy: 1.6601155661334603
Energy: 1.7138865222781983
Energy: 1.676115293834791
Energy: 1.568468651192363
Energy: 1.682855308921147
Energy: 1.67649570382821
Energy: 1.676115293834791
Energy: 1.5684686511889845
Energy: 1.682855308921147
Energy: 1.5512181583731515
Energy: 1.5936959797718762
Energy: 1.725446537559056
Energy: 1.5883466910947313
Energy: 1.5512181583832865
Energy: 1.593695979778633
Energy: 1.725446537559056
Energy: 1.5632796222801
Energy: 1.569056720605071
Energy: 1.7188216874229758
Energy: 1.6751184320762895
Energy: 1.563279622290235
Energy: 1.5690567206084494
Energy: 1.718821687416219
Energy: 1.5681241686873613
Energy: 1.5060395957209427
Energy: 1.6860666846849983
Energy: 1.5494715841706272
Energy: 1.5681241686839829
Energy: 1.5060395957209427
Energy: 1.6860666846849983
Energy: 1.5764490299090954
Energy: 1.5121165072357348
Energy: 1.7247774226474342
Energy: 1.6086247756038896
Energy: 1.576449029905717
Energy: 1.5121165072458698
Energy: 1.7247774226440558
Energy: 1.5301592495669387
Energy: 1.5062790400549702
Energy: 1.6043055755633238
Energy: 1.5203458660376092
Energy: 1.5301592495669387
Energy: 1.5062790400482133
Energy: 1.6043055755633238
Energy: 1.54298285871833
Energy: 1.5148364791291042
Energy: 1.688328704956035
Energy: 1.5903143595561129
Energy: 1.54298285871833
Energy: 1.514836479125726
Energy: 1.6883287049526565
Energy: 1.5223454068529207
Energy: 1.5392227955533315
Energy: 1.5962187247159016
Energy: 1.4973470907886526
Energy: 1.5223454068529207
Energy: 1.5392227955499531
Energy: 1.5962187247192183
Energy: 1.5176743418365806
Energy: 1.526409139266611
Energy: 1.6873996801336368
Energy: 1.5973168218441423
Energy: 1.5176743418433372
Energy: 1.5264091392733679
Energy: 1.687399680123563
Energy: 1.525014142286427
Energy: 1.5448024871598887
Energy: 1.655615533169599
Energy: 1.4974464704925885
Energy: 1.5250141422830485
Energy: 1.544802487153132
Energy: 1.655615533169599
Energy: 1.504688398486471
Energy: 1.5851039841411474
Energy: 1.8244382267162937
Energy: 1.5634256997576084
Energy: 1.5046883984830925
Energy: 1.585103984147904
Energy: 1.8244382267196717
Energy: 1.557224920164496
Energy: 1.6087148877047677
Energy: 1.6435381936631983
Energy: 1.5662695289119373
Energy: 1.557224920164496
Energy: 1.608714887708146
Energy: 1.6435381936631983
Energy: 1.6185182526093067
Energy: 1.5987526718289176
Energy: 1.8318671518257303
Energy: 1.563368126061119
Energy: 1.618518252595793
Energy: 1.5987526718356742
Energy: 1.8318671518257303
Energy: 1.533918127584371
Energy: 1.63514064251455
Energy: 1.8156577474093485
Energy: 1.651107413119569
Energy: 1.5339181275877494
Energy: 1.63514064251455
Energy: 1.8156577474093485
Energy: 1.5965683730790832
Energy: 1.598791507364467
Energy: 1.7934447411693566
Energy: 1.590461396498405
Energy: 1.5965683730790832
Energy: 1.598791507364467
Energy: 1.793444741172735
Energy: 1.6107475289070556
Energy: 1.603192148579154
Energy: 1.8084713654904123
Energy: 1.555757107361193
Energy: 1.610747528900299
Energy: 1.6031921485757754
Energy: 1.8084713655005473
Energy: 1.5394826295088575
Energy: 1.5863694503548749
Energy: 1.7843456067848087
Energy: 1.5873222201021016
Energy: 1.539482629512236
Energy: 1.5863694503582533
Energy: 1.7843456067848087

minimum gb energy = 1.4837584364730805 eV
minimum distance =  2.19918546229963 Angstroms
sigma value = 365


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

Energy: 1.5792748499130695
Energy: 1.3721803558015444
Energy: 1.639571780005999
Energy: 1.3721803558038292
Energy: 1.5792748499107847
Energy: 1.372180355802306
Energy: 1.4888871901442167
Energy: 1.579274849912308
Energy: 1.372180355802306
Energy: 1.9891316608156613
Energy: 1.372180355802306
Energy: 1.579274849912308
Energy: 1.3721803558015444
Energy: 1.4888871901411698
Energy: 1.5792748499107847
Energy: 1.372180355802306
Energy: 1.4738887760936497
Energy: 1.372180355802306
Energy: 1.5792748499130695
Energy: 1.3721803558030674
Energy: 1.4888871901449783
Energy: 1.579274849912308
Energy: 1.3721803558038292
Energy: 1.4794827322279656
Energy: 1.372180355802306
Energy: 1.579274849911546
Energy: 1.3721803558038292
Energy: 1.4888871901442167
Energy: 1.5792748499107847
Energy: 1.3721803558030674
Energy: 1.8915402469546785
Energy: 1.3721803558030674
Energy: 1.579274849912308
Energy: 1.3721803558030674
Energy: 1.4888871901419316
Energy: 1.579274849910023
Energy: 1.372180355802306
Energy: 1.4738887760190382
Energy: 1.372180355802306
Energy: 1.579274849912308
Energy: 1.372180355802306
Energy: 1.4888871901457401
Energy: 1.579274849912308
Energy: 1.372180355802306
Energy: 1.7750330448616496
Energy: 1.372180355802306
Energy: 1.579274849910023
Energy: 1.3721803558038292
Energy: 1.4888871901442167
Energy: 1.5792748499107847
Energy: 1.3721803558030674
Energy: 1.9891316608148994
Energy: 1.3721803558030674
Energy: 1.579274849912308
Energy: 1.3721803558015444
Energy: 1.4888871901419316
Energy: 1.5792748499107847
Energy: 1.3721803558015444
Energy: 1.4738887755233847
Energy: 1.3721803558007826
Energy: 1.579274849911546
Energy: 1.3721803558038292
Energy: 1.4888871901449783
Energy: 1.579274849912308
Energy: 1.3721803558030674
Energy: 1.9102088109864317
Energy: 1.3721803558030674
Energy: 1.579274849911546
Energy: 1.3721803558038292
Energy: 1.4888871901442167
Energy: 1.5792748499107847
Energy: 1.372180355802306
Energy: 1.9891316608133762
Energy: 1.3721803558045909
Energy: 1.579274849912308
Energy: 1.372180355802306
Energy: 1.4888871901419316
Energy: 1.579274849911546
Energy: 1.372180355802306
Energy: 1.4738887789753716
Energy: 1.3721803558030674
Energy: 1.579274849912308
Energy: 1.3721803558045909
Energy: 1.4888871901457401
Energy: 1.579274849912308
Energy: 1.3721803558038292
Energy: 1.4988824448024558
Energy: 1.372180355802306
Energy: 1.5792748499107847
Energy: 1.3721803558030674
Energy: 1.4888871901434548
Energy: 1.579274849911546
Energy: 1.372180355802306
Energy: 1.9891316608156613
Energy: 1.3721803558030674
Energy: 1.579274849912308
Energy: 1.372180355802306
Energy: 1.4888871901419316
Energy: 1.579274849911546
Energy: 1.3721803558015444
Energy: 1.4738887780259577
Energy: 1.372180355802306
Energy: 1.579274849912308
Energy: 1.3721803558030674
Energy: 1.4888871901449783
Energy: 1.5792748499130695
Energy: 1.372180355802306
Energy: 1.4794719846901294
Energy: 1.372180355802306
Energy: 1.579274849911546
Energy: 1.3721803558030674
Energy: 1.4888871901442167
Energy: 1.5792748499107847
Energy: 1.3721803558030674
Energy: 1.8915402469539169
Energy: 1.3721803558030674
Energy: 1.579274849912308
Energy: 1.3721803558015444
Energy: 1.4888871901419316
Energy: 1.579274849911546
Energy: 1.3721803558015444
Energy: 1.4738887758933938
Energy: 1.3721803558007826
Energy: 1.579274849912308
Energy: 1.3721803558030674
Energy: 1.4888871901449783
Energy: 1.579274849911546
Energy: 1.3721803558030674
Energy: 1.9494065456640093
Energy: 1.3721803558007826
Energy: 1.579274849910023
Energy: 1.3721803558038292
Energy: 1.4888871901442167
Energy: 1.579274849911546
Energy: 1.3721803558007826
Energy: 1.9891316608148994
Energy: 1.372180355802306
Energy: 1.5792748499130695
Energy: 1.372180355802306
Energy: 1.4888871901419316

minimum gb energy = 1.3721803558007826 eV
minimum distance =  2.31864771531857 Angstroms
sigma value = 23