Model name: model_name=EAM_Dynamo_MendelevKramerBecker_2008_Al__MO_106969701023_005
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=4.045259781181812
cohesive_energy=3.410925190644327
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: 0.011906695387003613
Energy: 0.17790807687460997
Energy: 0.1779080768734556
Energy: 0.011906695387003613
Energy: 0.1779080768734556
Energy: 0.17790807687460997
Energy: 0.011906695388157985
Energy: 0.17790807687460997
Energy: 0.1779080768734556
Energy: 0.011906695388157985
Energy: 0.17662190586760915
Energy: 0.012328197863047808
Energy: 0.17833643197033122
Energy: 0.17662190586760915
Energy: 0.012328197863047808
Energy: 0.17833643197033122
Energy: 0.17662190586876353
Energy: 0.012328197863047808
Energy: 0.17833643197033122
Energy: 0.17662190586760915
Energy: 0.7217672471837145
Energy: 0.012976734590940424
Energy: 0.012976734590940424
Energy: 0.7217672471837145
Energy: 0.012976734590940424
Energy: 0.012976734590940424
Energy: 0.7925662650893093
Energy: 0.012976734589786052
Energy: 0.012976734590940424
Energy: 0.7020316326124186
Energy: 0.17662190586645476
Energy: 0.17833643196802246
Energy: 0.012328197861893438
Energy: 0.17662190586645476
Energy: 0.17833643196802246
Energy: 0.012328197863047808
Energy: 0.17662190586645476
Energy: 0.17833643196802246
Energy: 0.012328197861893438
Energy: 0.17662190586645476
Energy: 0.011906695387003613
Energy: 0.17790807687230123
Energy: 0.17790807687230123
Energy: 0.011906695387003613
Energy: 0.17790807687230123
Energy: 0.17790807687230123
Energy: 0.011906695387003613
Energy: 0.17790807687230123
Energy: 0.17790807687230123
Energy: 0.011906695387003613
Energy: 0.17662190586760915
Energy: 0.012328197863047808
Energy: 0.17833643196802246
Energy: 0.17662190586760915
Energy: 0.012328197861893438
Energy: 0.17833643196802246
Energy: 0.17662190586645476
Energy: 0.012328197863047808
Energy: 0.17833643196802246
Energy: 0.17662190586645476
Energy: 0.7020316326124186
Energy: 0.012976734590940424
Energy: 0.17282859764953087
Energy: 0.7662424856035813
Energy: 0.012976734590940424
Energy: 0.0889127446556815
Energy: 0.3690150604994321
Energy: 0.012976734590940424
Energy: 0.0889127446556815
Energy: 0.713384562925498

minimum gb energy = 0.011906695387003613 eV
minimum distance =  2.32975934315805 Angstroms
sigma value = 3


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

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Energy: 0.6204403446791533
Energy: 0.6204500230756379
Energy: 0.4685709818906623
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Energy: 0.5403429455096075
Energy: 0.4884057371826242
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Energy: 0.6084653992853629
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Energy: 0.527190185329449
Energy: 0.5919579644385725
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Energy: 0.5271901853288835
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Energy: 0.6204403446791533
Energy: 0.6204500230762036
Energy: 0.49267571960996365
Energy: 0.6204403446831119
Energy: 0.6204500230629137
Energy: 0.4685709818900967
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Energy: 0.6204500230702655
Energy: 0.4926757196127912
Energy: 0.5403429455113041
Energy: 0.4884057371817759
Energy: 0.6106233610922105
Energy: 0.5403429455096075
Energy: 0.4884057371854518
Energy: 0.6106233610885345
Energy: 0.5403429455155456
Energy: 0.48840573718573455
Energy: 0.6106233610944725
Energy: 0.5403429455081938
Energy: 0.5571804326649282
Energy: 0.6130920560607256
Energy: 0.630379765523459
Energy: 0.5742741739875594
Energy: 0.6130920560595945
Energy: 0.6303797655195003
Energy: 0.5571804326751078
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Energy: 0.6303797655124312
Energy: 0.5742741739878421
Energy: 0.6190415595905125
Energy: 0.638579435723413
Energy: 0.46878661435034535
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Energy: 0.46878661434808333
Energy: 0.619041559589947
Energy: 0.6385794357214337
Energy: 0.46878661433818664
Energy: 0.6190415595910782

minimum gb energy = 0.45334795987733145 eV
minimum distance =  2.47782072186671 Angstroms
sigma value = 75


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

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Energy: 0.47049280662713766
Energy: 0.47070611264039325
Energy: 0.5537663240096478
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minimum gb energy = 0.46614887547351325 eV
minimum distance =  2.43930339313295 Angstroms
sigma value = 105


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

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Energy: 0.5846653718940821
Energy: 0.5650511962845183
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Energy: 0.5819151108769741
Energy: 0.582615243267412
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Energy: 0.5819151108788421
Energy: 0.5826152432658555
Energy: 0.5505761238834554
Energy: 0.5819151108765214
Energy: 0.5826152432611857
Energy: 0.5505761238865686
Energy: 0.5614816522227917
Energy: 0.5726721967446192
Energy: 0.5614488074974427
Energy: 0.5614816522218578
Energy: 0.5726947464587943
Energy: 0.5614488075028766
Energy: 0.561481652225452
Energy: 0.5726721967443079
Energy: 0.5614488074958863
Energy: 0.5614816522248293
Energy: 0.6083285577692935
Energy: 0.5768504303327561
Energy: 0.6004979881902518
Energy: 0.6083285577714725
Energy: 0.5768456665055989
Energy: 0.6004979881840256
Energy: 0.6083285577724066
Energy: 0.5768504303270109
Energy: 0.6004979881866576
Energy: 0.6083285577759724
Energy: 0.5663109714663402
Energy: 0.5745058795969398
Energy: 0.5327241091852114
Energy: 0.5663109714708401
Energy: 0.5745058795974209
Energy: 0.5327241091850415
Energy: 0.566310971473642
Energy: 0.5745058795953832
Energy: 0.5327241091922018
Energy: 0.5663109714722269
Energy: 0.5575946205635866
Energy: 0.6065225829525805
Energy: 0.5528575301306319
Energy: 0.557594620565313
Energy: 0.606598515077784
Energy: 0.5528575301310847
Energy: 0.5575946205629639
Energy: 0.6065225829505428
Energy: 0.5528575301307733
Energy: 0.5575946205668695
Energy: 0.5999651372847081
Energy: 0.579431194081363
Energy: 0.5899490026337634
Energy: 0.5999651372808309
Energy: 0.5736315321813132
Energy: 0.589949002643414
Energy: 0.5999651372780291
Energy: 0.5794311940821555
Energy: 0.5899490026391973
Energy: 0.5999651372851893
Energy: 0.5838272177660248
Energy: 0.5414191991953078
Energy: 0.5915489445544274
Energy: 0.5838272177584118
Energy: 0.541379546986747
Energy: 0.5915489445581631
Energy: 0.5838272177637042
Energy: 0.5414191991876665
Energy: 0.5915489445586443
Energy: 0.5838272177643268

minimum gb energy = 0.5201211127332294 eV
minimum distance =  2.42525741457823 Angstroms
sigma value = 165


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

Energy: 0.5010305580142722
Energy: 0.5691834357029615
Energy: 0.5691849705139254
Energy: 0.5010305580142722
Energy: 0.569183435705099
Energy: 0.5691849705133909
Energy: 0.5010305580137377
Energy: 0.569183435705099
Energy: 0.5691849705165972
Energy: 0.5010305580142722
Energy: 0.5708753139022951
Energy: 0.5012262235167719
Energy: 0.5830981664344356
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Energy: 0.5012262235087563
Energy: 0.5830981664397793
Energy: 0.5708753139033638
Energy: 0.5012262235263905
Energy: 0.5830981664317637
Energy: 0.5708753139028294
Energy: 0.5437444472474761
Energy: 0.6189935968893924
Energy: 0.4883569667564607
Energy: 0.5437444472480104
Energy: 0.6189935968909954
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Energy: 0.543744447243201
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Energy: 0.5437444472474761
Energy: 0.6079087428005034
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Energy: 0.5063826050319231
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Energy: 0.5063826050329918
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Energy: 0.5373279373111027
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Energy: 0.5689329570496047
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Energy: 0.561810711226379
Energy: 0.5098138447823253
Energy: 0.6071179830890947
Energy: 0.6277042418429172
Energy: 0.5098138447844627
Energy: 0.6071179830864228
Energy: 0.6277042418434516
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Energy: 0.6071179830869572
Energy: 0.6277042418434516
Energy: 0.5098138447849971
Energy: 0.5369407020111308
Energy: 0.5373355001372183
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Energy: 0.5369407020084589
Energy: 0.537335500140959
Energy: 0.5717846107832273
Energy: 0.536940702014337
Energy: 0.5373355001414933
Energy: 0.5717846107885711
Energy: 0.5369407020084589
Energy: 0.6078763422379806
Energy: 0.5063783827679802
Energy: 0.5712203528100245
Energy: 0.6078763422417212
Energy: 0.5063783827679802
Energy: 0.5712203528116278
Energy: 0.6078763422379806
Energy: 0.5063783827706522
Energy: 0.5712203528105589
Energy: 0.6078763422417212
Energy: 0.543746280114417
Energy: 0.48832919823082943
Energy: 0.6189928000719075
Energy: 0.543746280112814
Energy: 0.4883292006632796
Energy: 0.6189928000724417
Energy: 0.5437462801133482
Energy: 0.4883291983878855
Energy: 0.6189928000719075
Energy: 0.543746280112814
Energy: 0.5708809397558879
Energy: 0.5829807975791114
Energy: 0.5012355210550102
Energy: 0.5708809397510787
Energy: 0.5829807975791114
Energy: 0.5012355210608883
Energy: 0.5708809397558879
Energy: 0.5829807975807145
Energy: 0.5012355210582164
Energy: 0.5708809397521474
Energy: 0.5010305580105315
Energy: 0.5691834357045645
Energy: 0.5691849705214065
Energy: 0.5010305580110659
Energy: 0.5691834357045645
Energy: 0.5691849705155284
Energy: 0.5010305580110659
Energy: 0.569183435705099
Energy: 0.5691849705139254
Energy: 0.5010305580116003

minimum gb energy = 0.48832919823082943 eV
minimum distance =  2.61351627108838 Angstroms
sigma value = 41


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

Energy: 0.5261319734671323
Energy: 0.5157839828689916
Energy: 0.5157508796531539
Energy: 0.5261319734671323
Energy: 0.5157839828710649
Energy: 0.5157508796593739
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Energy: 0.5599994117052904
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Energy: 0.4803426720613263
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Energy: 0.5234724030764895
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Energy: 0.5066117986743068
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Energy: 0.5616575290780546
Energy: 0.4880941891394238
Energy: 0.4542659439032759
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Energy: 0.4880941891414972
Energy: 0.45426594389912933
Energy: 0.46384057888026103
Energy: 0.4602327885855705
Energy: 0.4597786500285004
Energy: 0.46384057888026103
Energy: 0.4602327885814239
Energy: 0.4597786500285004
Energy: 0.4638405788823344
Energy: 0.46023278859179045
Energy: 0.4597786500347204
Energy: 0.46384057888440766
Energy: 0.46063873749509265
Energy: 0.46217031527359914
Energy: 0.4750688366848312
Energy: 0.4606387374992394
Energy: 0.4621703152715258
Energy: 0.47506883668275784
Energy: 0.46063873749509265
Energy: 0.46217031527359914
Energy: 0.4750688366848312
Energy: 0.46063873749301937
Energy: 0.5740695164684444
Energy: 0.4615216347129753
Energy: 0.49127802721856284
Energy: 0.574069516466371
Energy: 0.46152163471504865
Energy: 0.4912780272164895
Energy: 0.5740695164684444
Energy: 0.46152163471504865
Energy: 0.4912780272206361
Energy: 0.574069516466371
Energy: 0.5012526978429211
Energy: 0.514561859263201
Energy: 0.4549637484627222
Energy: 0.5012526978429211
Energy: 0.5145618592590544
Energy: 0.4549637484647955
Energy: 0.5012526978408478
Energy: 0.514561859263201
Energy: 0.4549637484627222
Energy: 0.5012526978429211

minimum gb energy = 0.453642904694342 eV
minimum distance =  2.62130571219189 Angstroms
sigma value = 185


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

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Energy: 0.2600478167389673
Energy: 0.25885867976127425
Energy: 0.20821915920035503
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Energy: 0.20835279789232888
Energy: 0.25879477992146865
Energy: 0.2912995956330076
Energy: 0.22822477519724196
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Energy: 0.2599834194680182
Energy: 0.22822477519847256
Energy: 0.24316957433486802
Energy: 0.25998341946875647
Energy: 0.22822477520265647
Energy: 0.24316957433339131
Energy: 0.2599834194680182
Energy: 0.22822477519576534
Energy: 0.20843914803259944
Energy: 0.20879983060640847
Energy: 0.2716130967220268
Energy: 0.20843914803702945
Energy: 0.20879983059461746
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Energy: 0.20843914804242156
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Energy: 0.2716130967222729
Energy: 0.2084391480431599
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Energy: 0.2695016451043202
Energy: 0.2439722247521757
Energy: 0.2653723165056859
Energy: 0.2695016450993979
Energy: 0.24397222475906688

minimum gb energy = 0.20821915919937056 eV
minimum distance =  2.68352386940192 Angstroms
sigma value = 33


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

Energy: 0.45378948728100016
Energy: 0.4917807339455498
Energy: 0.48212245073832427
Energy: 0.43813978982064766
Energy: 0.4917807339455498
Energy: 0.4821224507369732
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Energy: 0.4345013856960271

minimum gb energy = 0.4197963112960137 eV
minimum distance =  2.439953614177 Angstroms
sigma value = 219


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

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Energy: 0.5955683417732879
Energy: 0.5010858572655549
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Energy: 0.501085857266449
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Energy: 0.5353417803289267
Energy: 0.535999136924584
Energy: 0.5667763088572612
Energy: 0.5353417803289267

minimum gb energy = 0.49914346189871417 eV
minimum distance =  2.63674385082134 Angstroms
sigma value = 15


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

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minimum gb energy = 0.5628329322380828 eV
minimum distance =  2.4317971971494 Angstroms
sigma value = 293


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

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Energy: 0.5671852020594422
Energy: 0.6094737977357586
Energy: 0.6022709903747027
Energy: 0.6069276775860198
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Energy: 0.6022709903751067
Energy: 0.6069276775846061
Energy: 0.6094737977357586
Energy: 0.6022709903747027
Energy: 0.6069276775856158
Energy: 0.6094737977351525
Energy: 0.6386106859462565
Energy: 0.5840296709605645
Energy: 0.5656533004808003
Energy: 0.6386106859426208
Energy: 0.5840296709597567
Energy: 0.5656533004805985
Energy: 0.6386106859426208
Energy: 0.5840296709609685
Energy: 0.5656533004810024
Energy: 0.6386106859460544
Energy: 0.6063399961164907
Energy: 0.5974180513125362
Energy: 0.5603076553934702
Energy: 0.606339996115885
Energy: 0.5974180513115264
Energy: 0.5603076553930662
Energy: 0.6063399961164907
Energy: 0.5974180513131422
Energy: 0.5603076553938741
Energy: 0.606339996115885
Energy: 0.5687764964019921
Energy: 0.5679898019907289
Energy: 0.5617889602499406
Energy: 0.5687764964019921
Energy: 0.5679898019885072
Energy: 0.5617889602505283
Energy: 0.5687764964011843
Energy: 0.567989801989719
Energy: 0.5617889602497388
Energy: 0.5687764964013862
Energy: 0.5964092726509882
Energy: 0.5995492174602244
Energy: 0.5689818568038165
Energy: 0.5964092726513922
Energy: 0.5995492174614362
Energy: 0.5689818568046244
Energy: 0.5964092726511903
Energy: 0.5995492174600224
Energy: 0.5689818568042204
Energy: 0.5964092726503823
Energy: 0.5725124226318402
Energy: 0.615950398405769
Energy: 0.6159513483465795
Energy: 0.5725124226314363
Energy: 0.6159503984045571
Energy: 0.6159513483490031
Energy: 0.572512422632042
Energy: 0.6159503984047592
Energy: 0.6159513483481952
Energy: 0.5725124226316382
Energy: 0.596348177677335
Energy: 0.5689424437526233
Energy: 0.599541646270639
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Energy: 0.5689424437530273
Energy: 0.599541646271043
Energy: 0.596348177677537
Energy: 0.5689424437526233
Energy: 0.599541646270841
Energy: 0.5963481776783448
Energy: 0.5687703543340739
Energy: 0.561666711672952
Energy: 0.5679780119274901
Energy: 0.5687703543324583
Energy: 0.561666711672548
Energy: 0.5679780119285001
Energy: 0.56877035433367
Energy: 0.5616667116731541
Energy: 0.5679780119276922
Energy: 0.56877035433367
Energy: 0.6063198150699883
Energy: 0.5602977416422257
Energy: 0.5973160817276278
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Energy: 0.5602977416418218
Energy: 0.5973160817270219
Energy: 0.6063198150697864
Energy: 0.5602977416422257
Energy: 0.5973160817274259
Energy: 0.6063198150701904
Energy: 0.6386361252864171
Energy: 0.5655689918470252
Energy: 0.5840888403355231
Energy: 0.638636125287023
Energy: 0.5655689918466212
Energy: 0.5840888403365329
Energy: 0.638636125286215
Energy: 0.5655689918472272
Energy: 0.5840888403347152
Energy: 0.638636125287831
Energy: 0.609421644657528
Energy: 0.6070486048634027
Energy: 0.6023245784365091
Energy: 0.6094216446571241
Energy: 0.6070486048648165
Energy: 0.6023245784350953
Energy: 0.6094216446573261
Energy: 0.6070486048632007
Energy: 0.6023245784361051
Energy: 0.6094216446565182
Energy: 0.5671803877536321
Energy: 0.5667498451486698
Energy: 0.5698134838943733
Energy: 0.5671803877526221
Energy: 0.566749845148064
Energy: 0.5698134838937672
Energy: 0.5671803877536321
Energy: 0.5667498451484679
Energy: 0.5698134838949791
Energy: 0.567180387753026
Energy: 0.6190238816288712
Energy: 0.5782059040326994
Energy: 0.5782860103910479
Energy: 0.6190238816302852
Energy: 0.5782059040337094
Energy: 0.5782860103904421
Energy: 0.619023881630083
Energy: 0.5782059040329015
Energy: 0.5782860103910479
Energy: 0.6190238816306891
Energy: 0.5671852020596443
Energy: 0.5699294969810811
Energy: 0.5667091782441755
Energy: 0.5671852020582304
Energy: 0.5699294969810811
Energy: 0.5667091782445794
Energy: 0.5671852020592403
Energy: 0.5699294969808791
Energy: 0.56670917824379
Energy: 0.5671852020578265
Energy: 0.6094737977349507
Energy: 0.6022709903751067
Energy: 0.6069276775842021
Energy: 0.6094737977349507
Energy: 0.6022709903755106
Energy: 0.6069276775852119
Energy: 0.6094737977353547
Energy: 0.6022709903747027
Energy: 0.606927677584404
Energy: 0.6094737977359604
Energy: 0.6386106859440348
Energy: 0.584029670963998
Energy: 0.5656533004797905
Energy: 0.6386106859454486
Energy: 0.5840296709635941
Energy: 0.5656533004808003
Energy: 0.6386106859438327
Energy: 0.5840296709631903
Energy: 0.5656533004797905
Energy: 0.6386106859438327
Energy: 0.6063399961160868
Energy: 0.5974180513109203
Energy: 0.5603076553928642
Energy: 0.6063399961166929
Energy: 0.5974180513127382
Energy: 0.5603076553934702
Energy: 0.6063399961160868
Energy: 0.5974180513121322
Energy: 0.5603076553926623
Energy: 0.6063399961164907

minimum gb energy = 0.5602977416416198 eV
minimum distance =  2.49372531242706 Angstroms
sigma value = 293


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

Energy: 0.5574048143108132
Energy: 0.5577487458694109
Energy: 0.5577816062109414
Energy: 0.5574048143060842
Energy: 0.5577487458646653
Energy: 0.5577816062109414
Energy: 0.557404814310083
Energy: 0.5577487458672207
Energy: 0.55778160621275
Energy: 0.5574048143060842
Energy: 0.5574939758411582
Energy: 0.5577339305214553
Energy: 0.5577833107176757
Energy: 0.5574939758407932
Energy: 0.5577339305207252
Energy: 0.5577833107216912
Energy: 0.5574939758422534
Energy: 0.5577339305214553
Energy: 0.5577833107184059
Energy: 0.5574939758407932
Energy: 0.5574156403540276
Energy: 0.5579243066521314
Energy: 0.5995790393494714
Energy: 0.5574156403525674
Energy: 0.5579243066517665
Energy: 0.5995790393451075
Energy: 0.5574156403540276
Energy: 0.5579243066528616
Energy: 0.5995790393472977
Energy: 0.5574156403514724
Energy: 0.5995595593804464
Energy: 0.5579223097433168
Energy: 0.5574119477981934
Energy: 0.599559559378621
Energy: 0.5579223097407615
Energy: 0.5574119477970982
Energy: 0.5995595593811764
Energy: 0.5579223097440469
Energy: 0.5574119477989234
Energy: 0.5995595593797163
Energy: 0.5577629134835386
Energy: 0.557698838911921
Energy: 0.5574628340415697
Energy: 0.5577629134882841
Energy: 0.5576988389144762
Energy: 0.5574628340441083
Energy: 0.5577629134831736
Energy: 0.5576988389115559
Energy: 0.5574628340430132
Energy: 0.5577629134886493
Energy: 0.5577487458650304
Energy: 0.5577816062109414
Energy: 0.5574048143111782
Energy: 0.5577487458694109
Energy: 0.5577816062109414
Energy: 0.5574048143064492
Energy: 0.5577487458639352
Energy: 0.5577816062102113
Energy: 0.5574048143108132
Energy: 0.5577487458694109
Energy: 0.5577339305207252
Energy: 0.5577833107220563
Energy: 0.5574939758418883
Energy: 0.5577339305218204
Energy: 0.5577833107184059
Energy: 0.5574939758415233
Energy: 0.5577339305207252
Energy: 0.5577833107216912
Energy: 0.5574939758418883
Energy: 0.5577339305214553
Energy: 0.5579243066517665
Energy: 0.5995790393462026
Energy: 0.5574156403540276
Energy: 0.5579243066524966
Energy: 0.5995790393483929
Energy: 0.5574156403529326
Energy: 0.5579243066503062
Energy: 0.5995790393462026
Energy: 0.5574156403536625
Energy: 0.5579243066521314
Energy: 0.5579223097418566
Energy: 0.5574119477967331
Energy: 0.5995595593804464
Energy: 0.557922309743682
Energy: 0.5574119477981934
Energy: 0.5995595593793511
Energy: 0.5579223097414916
Energy: 0.5574119477967331
Energy: 0.5995595593808114
Energy: 0.557922309743682
Energy: 0.5576988389148413
Energy: 0.5574628340448384
Energy: 0.5577629134831736
Energy: 0.557698838911921
Energy: 0.5574628340437433
Energy: 0.5577629134882841
Energy: 0.5576988389144762
Energy: 0.5574628340444734
Energy: 0.5577629134831736
Energy: 0.557698838912286
Energy: 0.55778160621275
Energy: 0.5574048143064492
Energy: 0.5577487458646653
Energy: 0.5577816062094813
Energy: 0.5574048143104481
Energy: 0.5577487458686808
Energy: 0.5577816062124016
Energy: 0.5574048143064492
Energy: 0.5577487458653954
Energy: 0.5577816062105764
Energy: 0.5577833107180408
Energy: 0.5574939758407932
Energy: 0.5577339305207252
Energy: 0.5577833107216912
Energy: 0.5574939758422534
Energy: 0.5577339305210903
Energy: 0.5577833107180408
Energy: 0.5574939758415233
Energy: 0.5577339305207252
Energy: 0.5577833107213263
Energy: 0.5995790393476629
Energy: 0.5574156403518373
Energy: 0.5579243066510364
Energy: 0.5995790393465676
Energy: 0.5574156403540276
Energy: 0.5579243066514014
Energy: 0.5995790393483929
Energy: 0.5574156403529326
Energy: 0.5579243066492112
Energy: 0.5995790393454725
Energy: 0.5574119477992885
Energy: 0.5995595593797163
Energy: 0.5579223097407615
Energy: 0.5574119477963682
Energy: 0.5995595593808114
Energy: 0.557922309743682
Energy: 0.5574119477985584
Energy: 0.5995595593789862
Energy: 0.5579223097411266
Energy: 0.5574119477970982
Energy: 0.5574628340433783
Energy: 0.5577629134886493
Energy: 0.5576988389148413
Energy: 0.5574628340448384
Energy: 0.5577629134831736
Energy: 0.5576988389115559
Energy: 0.5574628340430132
Energy: 0.5577629134882841
Energy: 0.5576988389148413
Energy: 0.5574628340444734
Energy: 0.557404814310083
Energy: 0.5577487458686808
Energy: 0.5577816062120365
Energy: 0.5574048143060842
Energy: 0.5577487458643003
Energy: 0.5577816062098463
Energy: 0.5574048143104481
Energy: 0.5577487458679508
Energy: 0.5577816062116715
Energy: 0.5574048143068143
Energy: 0.5574939758415233
Energy: 0.5577339305210903
Energy: 0.5577833107176757
Energy: 0.5574939758418883
Energy: 0.5577339305203602
Energy: 0.5577833107209612
Energy: 0.5574939758418883
Energy: 0.5577339305210903
Energy: 0.5577833107180408
Energy: 0.5574939758415233
Energy: 0.5574156403558528
Energy: 0.5579243066528616
Energy: 0.5995790393480278
Energy: 0.5574156403536625
Energy: 0.557924306648116
Energy: 0.5995790393454725
Energy: 0.5574156403547578
Energy: 0.5579243066539402
Energy: 0.5995790393472977
Energy: 0.5574156403525674
Energy: 0.5995595593800813
Energy: 0.5579223097440469
Energy: 0.5574119477981934
Energy: 0.5995595593782561
Energy: 0.5579223097407615
Energy: 0.5574119477974633
Energy: 0.5995595593800813
Energy: 0.557922309743682
Energy: 0.5574119477985584
Energy: 0.5995595593789862
Energy: 0.5577629134831736
Energy: 0.5576988389115559
Energy: 0.5574628340448384
Energy: 0.5577629134879192
Energy: 0.5576988389148413
Energy: 0.5574628340455685
Energy: 0.5577629134824436
Energy: 0.5576988389111909
Energy: 0.5574628340444734
Energy: 0.5577629134886493
Energy: 0.5577487458643003
Energy: 0.5577816062113065
Energy: 0.5574048143108132
Energy: 0.5577487458686808
Energy: 0.5577816062105764
Energy: 0.5574048143068143
Energy: 0.5577487458639352
Energy: 0.5577816062094813
Energy: 0.5574048143108132
Energy: 0.5577487458675856
Energy: 0.5577339305207252
Energy: 0.5577833107216912
Energy: 0.5574939758422534
Energy: 0.5577339305214553
Energy: 0.5577833107180408
Energy: 0.5574939758415233
Energy: 0.5577339305207252
Energy: 0.5577833107209612
Energy: 0.5574939758418883
Energy: 0.5577339305214553

minimum gb energy = 0.5574048143060842 eV
minimum distance =  2.6168656784167 Angstroms
sigma value = 15


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

Energy: 0.5905546748074274
Energy: 0.5992526928429935
Energy: 0.5927805852343082
Energy: 0.582713886569731
Energy: 0.5992526928446483
Energy: 0.5927805852376177
Energy: 0.5905546748024632
Energy: 0.5992526928413389
Energy: 0.5927805852326534
Energy: 0.582713886569731
Energy: 0.5712822538822389
Energy: 0.5805889095731398
Energy: 0.6053340247333622
Energy: 0.5712822538872031
Energy: 0.5805889095698303
Energy: 0.6053340247317075
Energy: 0.5712822538937918
Energy: 0.5805889095764192
Energy: 0.605334024735017
Energy: 0.5712822538838935
Energy: 0.5899847365702466
Energy: 0.5858385064014615
Energy: 0.6775376154360881
Energy: 0.5899847365652824
Energy: 0.5858385064014615
Energy: 0.6775376154443618
Energy: 0.5899847365785204
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Energy: 0.6775376154410524
Energy: 0.5899847365834845
Energy: 0.5578584657844962
Energy: 0.5856608256858488
Energy: 0.5550837385679958
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Energy: 0.5550837385580973
Energy: 0.5578584657778772
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Energy: 0.6228738737251269
Energy: 0.57553631663357
Energy: 0.6277106445389045
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Energy: 0.5806224454229215
Energy: 0.6311031686797732
Energy: 0.5487201880274416
Energy: 0.5806224454212668
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Energy: 0.6311031686748091
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Energy: 0.5898615824977625
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Energy: 0.5897172087400648
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Energy: 0.589717208745029
Energy: 0.5680139573947052
Energy: 0.6209656135950798
Energy: 0.6083639551130109
Energy: 0.5680139573881164
Energy: 0.6209656135884609
Energy: 0.6083639551080466
Energy: 0.5680139573980147
Energy: 0.6209656135868064
Energy: 0.6083639551097013
Energy: 0.5680139574013242
Energy: 0.6506686129967411
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Energy: 0.5841593144611396
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Energy: 0.5789330819450662
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Energy: 0.6506686131919099
Energy: 0.5672654040253221
Energy: 0.6450339183446414
Energy: 0.6324032257195347
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Energy: 0.5560957293512518
Energy: 0.5947088773070685
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Energy: 0.5560957293462876
Energy: 0.59470887729714
Energy: 0.5912688707278696
Energy: 0.6091774974823854
Energy: 0.5476218005542495
Energy: 0.6520697778139762
Energy: 0.6091774974890043
Energy: 0.5476227261891736
Energy: 0.6520697778139762
Energy: 0.6091774974906289
Energy: 0.5476218005492852
Energy: 0.6520697778106668
Energy: 0.6091774974906289
Energy: 0.6339628948454924
Energy: 0.552552888543887
Energy: 0.6095265823534887
Energy: 0.6339628948454924
Energy: 0.5525528885372981
Energy: 0.6095265823485244
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Energy: 0.5525528885290243
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Energy: 0.5516112428069342
Energy: 0.5488114306160979
Energy: 0.7000924774456738
Energy: 0.5516112428085889
Energy: 0.5488114306144432
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Energy: 0.5488114306194074
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Energy: 0.6046662303536282
Energy: 0.6402446371731115
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Energy: 0.64024463718304
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Energy: 0.6481431881090761
Energy: 0.6201888029590596
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Energy: 0.6481431881123856
Energy: 0.6201888029673333
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Energy: 0.6201888029673333
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Energy: 0.5704040911230979
Energy: 0.573630773771111
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Energy: 0.5704040911230979
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Energy: 0.5736307737744206
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Energy: 0.5801167075450759
Energy: 0.6049990246740644
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Energy: 0.5590552591138865
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Energy: 0.5966735388584763
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Energy: 0.5590552591023034
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Energy: 0.5590552591006486
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Energy: 0.6211044688035667
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Energy: 0.5756436445037075
Energy: 0.6211044688068762
Energy: 0.58515434071346
Energy: 0.5756443875880682
Energy: 0.6337331634526882
Energy: 0.5851543407151147
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Energy: 0.6337331634526882
Energy: 0.5851543407118052
Energy: 0.5756443875979966
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Energy: 0.585154340706841
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Energy: 0.6867731087488558
Energy: 0.5488996526999597
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Energy: 0.6867731087422368
Energy: 0.5488996526867217
Energy: 0.6086163861575811
Energy: 0.6867731087438915
Energy: 0.548899652691686
Energy: 0.6086163861724737
Energy: 0.5943020336627961
Energy: 0.5890478200155691
Energy: 0.5769459030175288
Energy: 0.5943051726951614
Energy: 0.589024526032611
Energy: 0.5769459030158741
Energy: 0.5943020336561772
Energy: 0.5890478200205334
Energy: 0.5769459030125645
Energy: 0.5943051726935067
Energy: 0.5567799227504615
Energy: 0.5950860279497538
Energy: 0.5508180490100275
Energy: 0.5567799227471519
Energy: 0.5950860279414801
Energy: 0.5508180490017539
Energy: 0.5567799227471519
Energy: 0.5950860279431349
Energy: 0.5508180490050633
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Energy: 0.5961397370502607
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Energy: 0.6232130014128765
Energy: 0.603578164940083
Energy: 0.5675399335529375
Energy: 0.6232130014145313
Energy: 0.6035781649433622
Energy: 0.5675386813747223
Energy: 0.6232130014178408
Energy: 0.6035781649417076
Energy: 0.567539933556247
Energy: 0.6099073450740132
Energy: 0.549502520146584
Energy: 0.5955269263956898
Energy: 0.6099073450773227
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Energy: 0.6099073450756679
Energy: 0.6228215216217042
Energy: 0.6207511150067924
Energy: 0.652784538246146
Energy: 0.6228215216250138
Energy: 0.6207511150101019
Energy: 0.6527845382511102
Energy: 0.6228215216183949
Energy: 0.6207511150067924
Energy: 0.6527845382511102
Energy: 0.6228215216167401
Energy: 0.6429029124246988
Energy: 0.5471851493333872
Energy: 0.5915658626840783
Energy: 0.6428308214995729
Energy: 0.5471348470230828
Energy: 0.5915658626906672
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Energy: 0.6428308214830255
Energy: 0.6071386442227292
Energy: 0.5480537008700355
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Energy: 0.6071386442276935
Energy: 0.5480537008749997
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Energy: 0.5480537008749997
Energy: 0.6235086301036039
Energy: 0.6071386442343124
Energy: 0.6285683590280847
Energy: 0.6105258833168656
Energy: 0.55514218656786
Energy: 0.628568359024775
Energy: 0.6105258833251394
Energy: 0.5551421401399688
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Energy: 0.6105258833234847
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Energy: 0.651608791743749
Energy: 0.622896369881496
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Energy: 0.5909574247868992
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Energy: 0.5901080849840256
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Energy: 0.5901080849906447
Energy: 0.5830920627826945
Energy: 0.5912202328465953
Energy: 0.6519016602097651
Energy: 0.6123479797624621
Energy: 0.5834940333874421
Energy: 0.6519016602031463
Energy: 0.6116220361487874
Energy: 0.591220232841631
Energy: 0.6519016601965274
Energy: 0.6123479797574979
Energy: 0.5834940333890968
Energy: 0.5506537357588447
Energy: 0.6890906439595367
Energy: 0.6289919223971171
Energy: 0.5506537357671183
Energy: 0.689090643957882
Energy: 0.6289919223938075
Energy: 0.5506537357638087
Energy: 0.689090643957882
Energy: 0.6289919223971171
Energy: 0.5506537357621542
Energy: 0.6437506719849707
Energy: 0.5561772571761162
Energy: 0.6127713774176812
Energy: 0.6437506719948991
Energy: 0.5561772571810805
Energy: 0.6127713773994791
Energy: 0.6437506719882801
Energy: 0.5561772571794257
Energy: 0.6127713774027886
Energy: 0.6437506719915896
Energy: 0.6133956870425739
Energy: 0.6248141680476743
Energy: 0.5481994649036561
Energy: 0.6133956870425739
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Energy: 0.5562486959542808
Energy: 0.6133956870359549
Energy: 0.6248141680559481
Energy: 0.5481994648953825
Energy: 0.6133956870376097
Energy: 0.6654425996529205
Energy: 0.6057040382527068
Energy: 0.5475529508325444
Energy: 0.6654425996545752
Energy: 0.6057040382493974
Energy: 0.5475529508308897
Energy: 0.6654425996529205
Energy: 0.6057040382543616
Energy: 0.5475529508358538
Energy: 0.6654425996595394
Energy: 0.6263126280358822
Energy: 0.6288205093682586
Energy: 0.6010720428944514
Energy: 0.6263126280358822
Energy: 0.6288205093566754
Energy: 0.6010720428977608
Energy: 0.6263126280259537
Energy: 0.6288205093599849
Energy: 0.6010720428994155
Energy: 0.6263126280325726
Energy: 0.6640671605074279
Energy: 0.5960322157422551
Energy: 0.5508717599420369
Energy: 0.6640671605057733
Energy: 0.5960322157439099
Energy: 0.5508717599337632
Energy: 0.6640671604974996
Energy: 0.5960322157406004
Energy: 0.5508717599387274
Energy: 0.6640671604991543
Energy: 0.5677903897129724
Energy: 0.615825967695637
Energy: 0.5913813051123014
Energy: 0.5677903897162517
Energy: 0.6158259676923274
Energy: 0.5913813051156109
Energy: 0.5677903897113176
Energy: 0.6158259676939821
Energy: 0.591381305113956
Energy: 0.567790389708008
Energy: 0.6179968968547912
Energy: 0.57990494398423
Energy: 0.5786199827478876
Energy: 0.6179968968531365
Energy: 0.5799164366224704
Energy: 0.5786461111255244
Energy: 0.6179968968547912
Energy: 0.5799049439891942
Energy: 0.578619982739614
Energy: 0.6179968968514816
Energy: 0.6539421578023484
Energy: 0.5480348910796816
Energy: 0.5593557015206624
Energy: 0.6539421578006938
Energy: 0.548034891076372
Energy: 0.5593557015206624
Energy: 0.6539421578040032
Energy: 0.5480348910863005
Energy: 0.5593557015256266
Energy: 0.6539421578106221
Energy: 0.5941273562404445
Energy: 0.6300550648105219
Energy: 0.5942922654241249
Energy: 0.5941273562437541
Energy: 0.6300550648171108
Energy: 0.5942922654390176
Energy: 0.5941273562354804
Energy: 0.6300550648138012
Energy: 0.5942922654373628
Energy: 0.5941273562354804
Energy: 0.5777252001311955
Energy: 0.5476389191944101
Energy: 0.6684689686507926
Energy: 0.5777252001345049
Energy: 0.5476391885670692
Energy: 0.6684689686541021
Energy: 0.5777252001361597
Energy: 0.5476389191960648
Energy: 0.6684689686474831
Energy: 0.5777252001262313
Energy: 0.6041739564162311
Energy: 0.56268227678906
Energy: 0.6189852923129188
Energy: 0.6041739564195405
Energy: 0.5626822767907147
Energy: 0.6189852923162282
Energy: 0.6041739564096121
Energy: 0.5626822767857806
Energy: 0.6189852923195376
Energy: 0.6041739564129216
Energy: 0.5966719263086765
Energy: 0.5760190637495377
Energy: 0.5554010992425378
Energy: 0.5966719263152954
Energy: 0.5760190637511925
Energy: 0.5554014407595244
Energy: 0.596671926318605
Energy: 0.5760190637462282
Energy: 0.5554010992392284
Energy: 0.5966719263152954
Energy: 0.5510362248768994
Energy: 0.5911533804886525
Energy: 0.646780527684842
Energy: 0.5510362248735899
Energy: 0.5911533804853432
Energy: 0.6467805276765681
Energy: 0.5510362248835183
Energy: 0.5911533804903074
Energy: 0.6467805276765681
Energy: 0.5510362248851731
Energy: 0.5668218976633344
Energy: 0.619362520556536
Energy: 0.6353692010422646
Energy: 0.5668218976484416
Energy: 0.619362520556536
Energy: 0.6353692010389551
Energy: 0.5668218976517512
Energy: 0.6193625205532265
Energy: 0.6353692010472288
Energy: 0.5668218976666437

minimum gb energy = 0.5471348470230828 eV
minimum distance =  2.48187012325829 Angstroms
sigma value = 437


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

Energy: 0.5453645365373607
Energy: 0.5497610748215938
Energy: 0.5495233433602527
Energy: 0.5453645365397721
Energy: 0.5497610748197853
Energy: 0.5495233433554298
Energy: 0.5453645365373607
Energy: 0.5497610748215938
Energy: 0.549523343359047
Energy: 0.5453645365397721
Energy: 0.6710394309168042
Energy: 0.5363576424779899
Energy: 0.5868144377051917
Energy: 0.6710394309192157
Energy: 0.5363576424791957
Energy: 0.5868144377051917
Energy: 0.6710394309180099
Energy: 0.5363576424779899
Energy: 0.5868144377045887
Energy: 0.6710394309192157
Energy: 0.6060466691747548
Energy: 0.5293245559708589
Energy: 0.6228366977361761
Energy: 0.6060466691759605
Energy: 0.5293245559708589
Energy: 0.643812741885023
Energy: 0.6060466691735492
Energy: 0.5293245559708589
Energy: 0.6228366977367791
Energy: 0.6060466691747548
Energy: 0.5873799186500724
Energy: 0.6311601852420489
Energy: 0.5823965969325879
Energy: 0.5873799186500724
Energy: 0.6311601852468717
Energy: 0.582396596936205
Energy: 0.5873799186500724
Energy: 0.6311601852426518
Energy: 0.5823965969325879
Energy: 0.5873799186500724
Energy: 0.5584112844711426
Energy: 0.5393592947563114
Energy: 0.6717295792527548
Energy: 0.5584112844723483
Energy: 0.53935929475812
Energy: 0.6717295792509462
Energy: 0.5584112844651141
Energy: 0.5393592947563114
Energy: 0.6717295792527548
Energy: 0.5584112844693341
Energy: 0.5575046271846962
Energy: 0.6098068253749825
Energy: 0.5357573929331396
Energy: 0.5575046271834905
Energy: 0.6098068253773938
Energy: 0.5357573929271112
Energy: 0.5575046271852991
Energy: 0.6098068253749825
Energy: 0.5357573929325368
Energy: 0.5575046271834905
Energy: 0.6180260588745429
Energy: 0.5462704229446694
Energy: 0.5294588827965523
Energy: 0.6180260588775572
Energy: 0.5462704229476838
Energy: 0.529458882797758
Energy: 0.6180260588757485
Energy: 0.5462704229446694
Energy: 0.5294588827971553
Energy: 0.6180260588775572
Energy: 0.5791593978611737
Energy: 0.6273401343417057
Energy: 0.5760800164648572
Energy: 0.579159397859968
Energy: 0.6273401343447199
Energy: 0.5760800164612402
Energy: 0.5791593978611737
Energy: 0.6273401343417057
Energy: 0.5760800164642543
Energy: 0.579159397859968
Energy: 0.7230797715456924
Energy: 0.586274222295283
Energy: 0.5399862680338717
Energy: 0.7230797715475009
Energy: 0.586274222300106
Energy: 0.5399862680350773
Energy: 0.7230797715462952
Energy: 0.5862742222946802
Energy: 0.5399862680332688
Energy: 0.7230797715468981
Energy: 0.581698277726464
Energy: 0.596823411218963
Energy: 0.6018023872247712
Energy: 0.581698277726464
Energy: 0.5968234112237857
Energy: 0.6018023872307997
Energy: 0.581698277726464
Energy: 0.596823411218963
Energy: 0.6018023873145685
Energy: 0.581698277725861
Energy: 0.5744743109316616
Energy: 0.5342959931069619
Energy: 0.5526076614525707
Energy: 0.574474310934073
Energy: 0.5342959931039476
Energy: 0.5526076614549821
Energy: 0.5744743109316616
Energy: 0.5342959931069619
Energy: 0.5526076614519678
Energy: 0.5744743109346758
Energy: 0.5963361190729012
Energy: 0.5359897580731873
Energy: 0.5403097305761706
Energy: 0.5963361190741069
Energy: 0.5359897580749957
Energy: 0.5403097305743622
Energy: 0.5963361190729012
Energy: 0.5359897580731873
Energy: 0.5403097305761706
Energy: 0.596336119073504
Energy: 0.5396963194835595
Energy: 0.5688842606556871
Energy: 0.5396529459338018
Energy: 0.5396963194841622
Energy: 0.5688842606556871
Energy: 0.539652945936816
Energy: 0.5396963194841622
Energy: 0.5688842606550842
Energy: 0.5396529459338018
Energy: 0.5396963194841622
Energy: 0.5447998300024285
Energy: 0.5445537136322042
Energy: 0.5770596267330609
Energy: 0.5447998300036341
Energy: 0.5445537136322042
Energy: 0.5770596267318552
Energy: 0.5447998300024285
Energy: 0.544553713632807
Energy: 0.5770596267312522
Energy: 0.544799830004237

minimum gb energy = 0.5293245559708589 eV
minimum distance =  2.497146527906 Angstroms
sigma value = 33