Model name: model_name=EAM_Dynamo_WuTrinkle_2009_CuAg__MO_270337113239_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.492127545177937
cohesive_energy=3.2787006807142314
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: -0.0422236321099957 eV

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

Energy: 0.013576365588586124
Energy: 0.539881154178005
Energy: 0.013576365588586124
Energy: 0.5398811541783037
Energy: 0.013576365588586124
Energy: 0.5398811541783037
Energy: 0.5398811541783037
Energy: 0.5569210724255433
Energy: 0.5398811541783037
Energy: 0.5569210724255433
Energy: 0.5398811541783037
Energy: 0.5569210724255433
Energy: 0.013576365588586124
Energy: 0.539881154178005
Energy: 0.013576365588586124
Energy: 0.5398811541783037
Energy: 0.013576365588586124
Energy: 0.5398811541783037
Energy: 0.539881154178005
Energy: 0.5569210724252073
Energy: 0.5398811541783037
Energy: 0.5569210724255433
Energy: 0.5398811541783037
Energy: 0.5569210724255433
Energy: 0.013576365588586124
Energy: 0.5398811541783037
Energy: 0.013576365588586124
Energy: 0.5398811541783037
Energy: 0.013576365588586124
Energy: 0.5398811541783037
Energy: 0.5398811541783037
Energy: 0.5569210724255433
Energy: 0.5398811541783037
Energy: 0.5569210724255433
Energy: 0.5398811541783037
Energy: 0.5569210724255433

minimum gb energy = 0.013576365588586124 eV
minimum distance =  2.27274536442453 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 0.648187668576428
Energy: 0.6078468693082933
Energy: 0.6481876685756189
Energy: 0.6078468693082933
Energy: 0.6481876685756189
Energy: 0.6078468693082933
Energy: 0.6997919927777726
Energy: 0.5690877447663832
Energy: 0.6997919927777726
Energy: 0.5690877447663832
Energy: 0.6997919927761547
Energy: 0.5690877447663832
Energy: 0.6135764062993406
Energy: 0.6409728624004162
Energy: 0.6135764063001496
Energy: 0.6409728624012252
Energy: 0.6135764063001496
Energy: 0.6409728624012252
Energy: 0.6903126129791355
Energy: 0.5957783865569126
Energy: 0.6903126129791355
Energy: 0.5957783865569126
Energy: 0.6903126129783266
Energy: 0.5957783865569126
Energy: 0.6249210444818711
Energy: 0.6775813226539509
Energy: 0.6249210444818711
Energy: 0.6775813226539509
Energy: 0.6249210444818711
Energy: 0.677581322654723
Energy: 0.6464189191139319
Energy: 0.588794070615518
Energy: 0.6464189191139319
Energy: 0.588794070614709
Energy: 0.6464189191139319
Energy: 0.588794070615518
Energy: 0.6138017350871764
Energy: 0.6373328911084264
Energy: 0.6138017350847496
Energy: 0.6373328911092353
Energy: 0.6138017350855585
Energy: 0.6373328911068085
Energy: 0.5963537731820101
Energy: 0.6854377923045362
Energy: 0.596353773182819
Energy: 0.685437792306963
Energy: 0.596353773182819
Energy: 0.6854377923037271
Energy: 0.658267733559712
Energy: 0.6412068357298124
Energy: 0.6582677335605209
Energy: 0.6412068357298124
Energy: 0.658267733559712
Energy: 0.6412068357306214
Energy: 0.5618199257259676
Energy: 0.6770563310337756
Energy: 0.5618199257267765
Energy: 0.6770563310370115
Energy: 0.5618199257259676
Energy: 0.6770563310362024
Energy: 0.6725313446877969
Energy: 0.5796622856345732
Energy: 0.6725313446877969
Energy: 0.5796622856345732
Energy: 0.6725313446861789
Energy: 0.5796622856345732
Energy: 0.5494939058748183
Energy: 0.6610104118554089
Energy: 0.5494939058748183
Energy: 0.6610104118594535
Energy: 0.5494939058740093
Energy: 0.6610104118594535
Energy: 0.7123386658969001
Energy: 0.5466782648974383
Energy: 0.7123386658960911
Energy: 0.5466782648966293
Energy: 0.7123386658960911
Energy: 0.5466782648974383
Energy: 0.588780406248137
Energy: 0.5986891635617094
Energy: 0.588780406248137
Energy: 0.5986891635609004
Energy: 0.5887804062473281
Energy: 0.5986891635617094
Energy: 0.7260353774210041
Energy: 0.5686813250321386
Energy: 0.7260353774210041
Energy: 0.5686813250321386
Energy: 0.7260353774210041
Energy: 0.5686813250321386
Energy: 0.7174733417701671
Energy: 0.6474720435989256
Energy: 0.7174733417701671
Energy: 0.6474720435989256
Energy: 0.7174733417693583
Energy: 0.6474720435973077
Energy: 0.6311730050114315
Energy: 0.6322688287829944
Energy: 0.6311730050130494
Energy: 0.6322688287838034
Energy: 0.6311730050122404
Energy: 0.6322688287838034
Energy: 0.6313412501808923
Energy: 0.6033441563548679
Energy: 0.6313412501808923
Energy: 0.6033441563548679
Energy: 0.6313412501792743
Energy: 0.6033441563548679
Energy: 0.5656037982102532
Energy: 0.59565856005242
Energy: 0.5656037982102532
Energy: 0.595658560053229
Energy: 0.5656037982102532
Energy: 0.595658560054847
Energy: 0.6555837154800989
Energy: 0.5890789305213232
Energy: 0.6555837154800989
Energy: 0.5890789305213232
Energy: 0.6555837154800989
Energy: 0.5890789305213232
Energy: 0.575147222778164
Energy: 0.6808229683027774
Energy: 0.575147222778164
Energy: 0.6808229683052043
Energy: 0.575147222778164
Energy: 0.6808229683035865
Energy: 0.647493694614333
Energy: 0.6382936307892296
Energy: 0.647493694613524
Energy: 0.6382936307892296
Energy: 0.647493694614333
Energy: 0.6382936307892296
Energy: 0.5415786843740117
Energy: 0.6832885354836974
Energy: 0.5415786843740117
Energy: 0.6832885354820795
Energy: 0.5415786843732028
Energy: 0.6832885354828885

minimum gb energy = 0.5415786843732028 eV
minimum distance =  2.21231945911578 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 0.7048452515818338
Energy: 0.6868018811552528
Energy: 0.6483725545725575
Energy: 0.686801881156173
Energy: 0.7048452515850546
Energy: 0.6868018811575534
Energy: 0.6933399180447785
Energy: 0.6026871709634443
Energy: 0.6933399180406373
Energy: 0.6026871709611437
Energy: 0.6933399180443185
Energy: 0.6026871709593032
Energy: 0.5937921832309724
Energy: 0.5427549983839944
Energy: 0.5937921832328128
Energy: 0.5427549983881357
Energy: 0.5937921832392545
Energy: 0.5427549983844546
Energy: 0.603268213355731
Energy: 0.6794446604247218
Energy: 0.6032682142985756
Energy: 0.6794446604228814
Energy: 0.603268215091502
Energy: 0.6794446604201206
Energy: 0.6508882004242331
Energy: 0.5729945713269282
Energy: 0.6508882004205521
Energy: 0.5729945712970617
Energy: 0.650888200420092
Energy: 0.5729945712496686
Energy: 0.5911131619211146
Energy: 0.5883715925490373
Energy: 0.5911131619234152
Energy: 0.5884232684715864
Energy: 0.5911131619211146
Energy: 0.5883715925439758
Energy: 0.6880682901532751
Energy: 0.6414865831420867
Energy: 0.6880682901578764
Energy: 0.5445753476167695
Energy: 0.6880682901509745
Energy: 0.6414865831158595
Energy: 0.5443028517646904
Energy: 0.6535525306365504
Energy: 0.54430285176331
Energy: 0.6535525307441785
Energy: 0.5443028517656106
Energy: 0.6535525308568682
Energy: 0.5754690512399122
Energy: 0.5903620986877487
Energy: 0.5754690512348508
Energy: 0.5903620986854479
Energy: 0.5754690512330103
Energy: 0.5903620986826872
Energy: 0.5797322898262156
Energy: 0.6008403598847528
Energy: 0.5797346527664903
Energy: 0.600840356835483
Energy: 0.5797322898252953
Energy: 0.6008403533786649
Energy: 0.6441112661275377
Energy: 0.5805106226794925
Energy: 0.6441112661238567
Energy: 0.5805106226836336
Energy: 0.6441112661275377
Energy: 0.5805106226804129
Energy: 0.5884127278754387
Energy: 0.6288177240680773
Energy: 0.5884113511225041
Energy: 0.628817724063936
Energy: 0.588412727869457
Energy: 0.628817724063476
Energy: 0.613859156274182
Energy: 0.5891362004723104
Energy: 0.6138591562645193
Energy: 0.5891362004713901
Energy: 0.6138591562677402
Energy: 0.5891362004704698
Energy: 0.653737417578087
Energy: 0.6891803862922199
Energy: 0.6537374175776269
Energy: 0.6891803862958591
Energy: 0.653737417578087
Energy: 0.6891803862944786
Energy: 0.6527997785001706
Energy: 0.6011576168404861
Energy: 0.6527997785020111
Energy: 0.601157616847388
Energy: 0.6527997784969497
Energy: 0.6011576168368049
Energy: 0.5884863017544727
Energy: 0.5499741782109053
Energy: 0.5884863017563132
Energy: 0.5499741781548115
Energy: 0.5884863017586139
Energy: 0.5499741780954549
Energy: 0.591891198599923
Energy: 0.6556038659328095
Energy: 0.5918912059738964
Energy: 0.6556038659328095
Energy: 0.5918912121198293
Energy: 0.6556038659332696
Energy: 0.6481545867358066
Energy: 0.5881791951752257
Energy: 0.6481545867404078
Energy: 0.5883370699632404
Energy: 0.6481545867440889
Energy: 0.5881791951747655
Energy: 0.6198320445637899
Energy: 0.6007783498014623
Energy: 0.6198320445614893
Energy: 0.5829876028505375
Energy: 0.6198320445679311
Energy: 0.6007783497977813
Energy: 0.6878308678255591
Energy: 0.6497380171315098
Energy: 0.6878308678232584
Energy: 0.677979409966225
Energy: 0.6878308678301605
Energy: 0.6497380171338104
Energy: 0.5417112459495482
Energy: 0.6528943661940849
Energy: 0.541711245949088
Energy: 0.652894366148114
Energy: 0.5417112459500084
Energy: 0.6528943660924802
Energy: 0.5373710315405666
Energy: 0.5901805866672356
Energy: 0.5373710315313641
Energy: 0.5901805866630945
Energy: 0.5373710315263027
Energy: 0.5901805866630945
Energy: 0.5783934653914047
Energy: 0.5985786345787504
Energy: 0.578396312714829
Energy: 0.5985786413392056
Energy: 0.5783934653854231
Energy: 0.5985786498256853
Energy: 0.5807864361837795
Energy: 0.6511761494399626
Energy: 0.5807864362031049
Energy: 0.6511761494367417
Energy: 0.580786436214608
Energy: 0.6511761494372019
Energy: 0.5944587852842829
Energy: 0.5917087610022117
Energy: 0.5945818304238089
Energy: 0.5917087610095737
Energy: 0.5944587852852031
Energy: 0.5917087610146351
Energy: 0.6692035996594673
Energy: 0.6837632353877645
Energy: 0.5444719411690472
Energy: 0.6837632353919056
Energy: 0.6692035996705104
Energy: 0.6837632353863841
Energy: 0.6647747337471551
Energy: 0.5479543887859032
Energy: 0.6140479049911571
Energy: 0.5479543895511801
Energy: 0.6647747338368383
Energy: 0.5479543905644244
Energy: 0.5941534859996738
Energy: 0.6025608221193272
Energy: 0.5941534859950726
Energy: 0.6025608221239284
Energy: 0.5941534859982933
Energy: 0.6025608221243886
Energy: 0.6002757704653858
Energy: 0.6028856047835093
Energy: 0.6002757828253926
Energy: 0.6028856047830491
Energy: 0.6002757937301809
Energy: 0.6028856047839694
Energy: 0.5784941596647792
Energy: 0.5825462542713112
Energy: 0.5784941596693804
Energy: 0.5825462542749503
Energy: 0.5784941596684602
Energy: 0.5825462542749503
Energy: 0.6484961623486157
Energy: 0.5904002413455423
Energy: 0.6484961623458549
Energy: 0.5904085382146192
Energy: 0.6484961623527569
Energy: 0.5904002413446219
Energy: 0.5883949394887605
Energy: 0.6282185239619918
Energy: 0.5883949394906011
Energy: 0.5233677165732309
Energy: 0.5883949394919814
Energy: 0.6282185244288129
Energy: 0.6876633475381105
Energy: 0.6779842342217325
Energy: 0.6876633475358098
Energy: 0.6497185367013588
Energy: 0.6876633475316687
Energy: 0.67798423421299
Energy: 0.6028841166820915
Energy: 0.6524082345492836
Energy: 0.6028841166853125
Energy: 0.6524082345437621
Energy: 0.6028841166816316
Energy: 0.6524082345511241
Energy: 0.5503261593075541
Energy: 0.5884199246905781
Energy: 0.5503261593089345
Energy: 0.5884199246905781
Energy: 0.5503261593116954
Energy: 0.588419924686437
Energy: 0.6586748641995371
Energy: 0.5859576470659845
Energy: 0.6586748642018379
Energy: 0.5859576469156063
Energy: 0.658674864202298
Energy: 0.5859576467601249
Energy: 0.5883253293008934
Energy: 0.6485385218298085
Energy: 0.588349619109811
Energy: 0.6485385218265877
Energy: 0.5883253293008934
Energy: 0.648538521831189
Energy: 0.6032551178219734
Energy: 0.5909539729404139
Energy: 0.6032551178178324
Energy: 0.5909539729367329
Energy: 0.6032551178150716
Energy: 0.5909539729385734
Energy: 0.6537094420475391
Energy: 0.690289561609532
Energy: 0.6537094420433979
Energy: 0.690289561609532
Energy: 0.6537094420420174
Energy: 0.6902895616122928
Energy: 0.5926888133828978
Energy: 0.5426707946805767
Energy: 0.5926888107907863
Energy: 0.5426707946805767
Energy: 0.5926888087174486
Energy: 0.5426707946787361
Energy: 0.5884429929065311
Energy: 0.5739434406194505
Energy: 0.5884429929111324
Energy: 0.5739434406194505
Energy: 0.5884429929120527
Energy: 0.5739434406194505

minimum gb energy = 0.5233677165732309 eV
minimum distance =  2.31511832981119 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 0.632060402109412
Energy: 0.6384931018258737
Energy: 0.632060402109412
Energy: 0.6384931018248076
Energy: 0.632060402109412
Energy: 0.6384931018248076
Energy: 0.6733710004060756
Energy: 0.6013844095842802
Energy: 0.6733710004060756
Energy: 0.6013844095842802
Energy: 0.6733710004071417
Energy: 0.6013844095842802
Energy: 0.6052960500688538
Energy: 0.6327226463942586
Energy: 0.6052960500688538
Energy: 0.6327226463953247
Energy: 0.6052960500677876
Energy: 0.6327226463942586
Energy: 0.6266222417499289
Energy: 0.5537160998102629
Energy: 0.6266222417499289
Energy: 0.5537160998102629
Energy: 0.626622241750995
Energy: 0.5537160998102629
Energy: 0.6410250250468118
Energy: 0.6128140010631937
Energy: 0.6410250250457457
Energy: 0.6128140010642598
Energy: 0.6410250250457457
Energy: 0.6128140010642598
Energy: 0.6405939838780544
Energy: 0.6127072870497003
Energy: 0.6405939838791206
Energy: 0.6127072870497003
Energy: 0.6405939838791206
Energy: 0.6127072870507664
Energy: 0.6283018947359839
Energy: 0.6128269958379674
Energy: 0.6283018947359839
Energy: 0.6128269958390336
Energy: 0.6283018947359839
Energy: 0.6128269958400996
Energy: 0.5842111182589899
Energy: 0.6132799733044907
Energy: 0.5842111182589899
Energy: 0.6132799733055568
Energy: 0.5842111182600559
Energy: 0.6132799733055568
Energy: 0.721334383813906
Energy: 0.5510981789972815
Energy: 0.721334383813906
Energy: 0.5510981789972815
Energy: 0.721334383813906
Energy: 0.5510981789972815
Energy: 0.5663676496213436
Energy: 0.7221312896949169
Energy: 0.5663676496213436
Energy: 0.7221312896938508
Energy: 0.5663676496213436
Energy: 0.7221312896938508
Energy: 0.6606211346226177
Energy: 0.55492605795745
Energy: 0.6606211346226177
Energy: 0.55492605795745
Energy: 0.6606211346226177
Energy: 0.55492605795745
Energy: 0.6336606343042345
Energy: 0.639826750592169
Energy: 0.6336606343031683
Energy: 0.639826750592169
Energy: 0.6336606343031683
Energy: 0.639826750592169
Energy: 0.671285658010664
Energy: 0.6000772807692029
Energy: 0.6712856580127962
Energy: 0.6000772807692029
Energy: 0.6712856580138622
Energy: 0.6000772807692029
Energy: 0.605228602387759
Energy: 0.5921114043547505
Energy: 0.605228602387759
Energy: 0.5921114043547505
Energy: 0.605228602387759
Energy: 0.5921114043557925
Energy: 0.6341493923292155
Energy: 0.6370049734865547
Energy: 0.6341493923281494
Energy: 0.6370049734865547
Energy: 0.6341493923292155
Energy: 0.6370049734865547
Energy: 0.639610130846851
Energy: 0.6127098854554289
Energy: 0.6396101308447187
Energy: 0.6127098854554289
Energy: 0.6396101308457849
Energy: 0.6127098854554289
Energy: 0.6421652089023518
Energy: 0.6663836517891414
Energy: 0.642165208903418
Energy: 0.6663836517902075
Energy: 0.6421652089023518
Energy: 0.6663836517891414
Energy: 0.6247693629351991
Energy: 0.6157620660298156
Energy: 0.6247693629351991
Energy: 0.6157620660298156
Energy: 0.6247693629351991
Energy: 0.6157620660298156

minimum gb energy = 0.5510981789972815 eV
minimum distance =  2.21254182840157 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.5226325040306969
Energy: 0.5269031812553102
Energy: 0.5226325040306969
Energy: 0.5269031812553102
Energy: 0.5226325040300646
Energy: 0.5269031812553102
Energy: 0.5757908776647104
Energy: 0.6339315144576863
Energy: 0.5757908776666076
Energy: 0.6339315144576863
Energy: 0.5757908776653428
Energy: 0.6339315144576863
Energy: 0.49904947383675635
Energy: 0.6324979890318337
Energy: 0.4990494738354916
Energy: 0.6324979890318337
Energy: 0.4990494738354916
Energy: 0.6324979890318337
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5139752965487752
Energy: 0.5208168616815603
Energy: 0.5139752965487752
Energy: 0.5208168616815603
Energy: 0.5139752965494075
Energy: 0.5208168616815603
Energy: 0.5139301794089863
Energy: 0.5210099998104174
Energy: 0.5139301794070893
Energy: 0.5210099998116821
Energy: 0.5139301794058244
Energy: 0.5210099998110498
Energy: 0.5466022347706975
Energy: 0.49914383558257375
Energy: 0.5466022347700652
Energy: 0.49914383558257375
Energy: 0.5466022347706975
Energy: 0.49914383558257375
Energy: 0.49903263849962237
Energy: 0.6323980701638257
Energy: 0.49903263849962237
Energy: 0.6323980701631933
Energy: 0.49903263849962237
Energy: 0.6323980701631933
Energy: 0.575877799348635
Energy: 0.633971981398705
Energy: 0.575877799348635
Energy: 0.633971981398705
Energy: 0.575877799348635
Energy: 0.633971981398705
Energy: 0.5226325040306969
Energy: 0.5269031812553102
Energy: 0.5226325040306969
Energy: 0.5269031812553102
Energy: 0.5226325040300646
Energy: 0.5269031812546777
Energy: 0.5757908776653428
Energy: 0.6339315144576863
Energy: 0.5757908776647104
Energy: 0.6339315144576863
Energy: 0.5757908776653428
Energy: 0.6339315144570539
Energy: 0.4990494738354916
Energy: 0.6324979890318337
Energy: 0.4990494738335944
Energy: 0.6324979890318337
Energy: 0.4990494738354916
Energy: 0.6324979890318337
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5139752965487752
Energy: 0.5208168616815603
Energy: 0.5139752965481428
Energy: 0.5208168616815603
Energy: 0.5139752965487752
Energy: 0.5208168616815603
Energy: 0.513930179408354
Energy: 0.5210099998116821
Energy: 0.5139301794077216
Energy: 0.5210099998116821
Energy: 0.5139301794064568
Energy: 0.5210099998116821
Energy: 0.5466022347706975
Energy: 0.49914383558257375
Energy: 0.5466022347706975
Energy: 0.49914383558257375
Energy: 0.5466022347706975
Energy: 0.49914383558257375
Energy: 0.49903263849962237
Energy: 0.6323980701638257
Energy: 0.49903263849962237
Energy: 0.6323980701644579
Energy: 0.49903263849962237
Energy: 0.6323980701638257
Energy: 0.575877799348635
Energy: 0.633971981398705
Energy: 0.5758777993480027
Energy: 0.633971981398705
Energy: 0.575877799348635
Energy: 0.633971981398705
Energy: 0.5226325040306969
Energy: 0.5269031812553102
Energy: 0.5226325040306969
Energy: 0.5269031812553102
Energy: 0.5226325040300646
Energy: 0.5269031812553102
Energy: 0.5757908776659753
Energy: 0.6339315144576863
Energy: 0.5757908776653428
Energy: 0.6339315144576863
Energy: 0.5757908776659753
Energy: 0.6339315144570539
Energy: 0.4990494738354916
Energy: 0.6324979890324661
Energy: 0.4990494738361239
Energy: 0.6324979890318337
Energy: 0.49904947383485915
Energy: 0.6324979890318337
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5464346512140963
Energy: 0.49905852356798436
Energy: 0.5464346512147287
Energy: 0.49905852356798436
Energy: 0.5139752965494075
Energy: 0.5208168616815603
Energy: 0.5139752965487752
Energy: 0.5208168616815603
Energy: 0.5139752965487752
Energy: 0.5208168616815603
Energy: 0.5139301794070893
Energy: 0.5210099998104174
Energy: 0.5139301794064568
Energy: 0.5210099998110498
Energy: 0.513930179405192
Energy: 0.5210099998110498
Energy: 0.5466022347706975
Energy: 0.49914383558257375
Energy: 0.5466022347706975
Energy: 0.49914383558257375
Energy: 0.5466022347700652
Energy: 0.49914383558257375
Energy: 0.49903263849899
Energy: 0.6323980701638257
Energy: 0.49903263849962237
Energy: 0.6323980701638257
Energy: 0.49903263849962237
Energy: 0.6323980701631933
Energy: 0.5758777993505322
Energy: 0.633971981398705
Energy: 0.5758777993480027
Energy: 0.633971981398705
Energy: 0.5758777993480027
Energy: 0.633971981398705
Energy: 0.5226325040300646
Energy: 0.5269031812553102
Energy: 0.5226325040300646
Energy: 0.5269031812553102
Energy: 0.5226325040300646
Energy: 0.5269031812553102
Energy: 0.5757908776659753
Energy: 0.6339315144576863
Energy: 0.5757908776659753
Energy: 0.6339315144576863
Energy: 0.5757908776653428
Energy: 0.6339315144570539
Energy: 0.4990494738354916
Energy: 0.6324979890318337
Energy: 0.4990494738354916
Energy: 0.6324979890318337
Energy: 0.4990494738361239
Energy: 0.6324979890318337

minimum gb energy = 0.49903263849899 eV
minimum distance =  2.2221780060507 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.5182150404800002
Energy: 0.5021536799140162
Energy: 0.5182150404800002
Energy: 0.5021536799140162
Energy: 0.5182150404800002
Energy: 0.5021536799140162
Energy: 0.5936239929152155
Energy: 0.5229295103113275
Energy: 0.5936239929152155
Energy: 0.5229295103113275
Energy: 0.5936239929152155
Energy: 0.5229295103113275
Energy: 0.5198023034049022
Energy: 0.5739953156320329
Energy: 0.5198023034049022
Energy: 0.5739953156304839
Energy: 0.5198023034049022
Energy: 0.5739953156320329
Energy: 0.5809279781115997
Energy: 0.49176179859549674
Energy: 0.5809279781115997
Energy: 0.49176179859549674
Energy: 0.5809279781115997
Energy: 0.49176179859549674
Energy: 0.5795202824889649
Energy: 0.48856992177522046
Energy: 0.579520282490514
Energy: 0.48856992177522046
Energy: 0.579520282490514
Energy: 0.48856992177522046
Energy: 0.5907036489423382
Energy: 0.614946796024887
Energy: 0.5907036489423382
Energy: 0.614946796024887
Energy: 0.5907036489423382
Energy: 0.614946796024887
Energy: 0.5538750836004531
Energy: 0.5246737111102382
Energy: 0.5538750836004531
Energy: 0.5246737111102382
Energy: 0.5538750836020022
Energy: 0.5246737111102382
Energy: 0.5142564541663797
Energy: 0.5048233225856523
Energy: 0.5142564541679286
Energy: 0.5048233225856523
Energy: 0.5142564541679286
Energy: 0.5048233225856523
Energy: 0.5894034381955011
Energy: 0.5199705686274307
Energy: 0.5894034381955011
Energy: 0.5199705686351759
Energy: 0.5894034381955011
Energy: 0.5199705686289797
Energy: 0.5655114533790235
Energy: 0.5963361996608082
Energy: 0.5655114533790235
Energy: 0.5963361996608082
Energy: 0.5655114533790235
Energy: 0.5963361996623573
Energy: 0.5026543608325204
Energy: 0.48910802017416605
Energy: 0.5026543608325204
Energy: 0.48910802017416605
Energy: 0.5026543608325204
Energy: 0.48910802017416605
Energy: 0.6122442124611163
Energy: 0.5625216638196778
Energy: 0.6122442124611163
Energy: 0.5625216638196778
Energy: 0.6122442124611163
Energy: 0.5625216638196778

minimum gb energy = 0.48856992177522046 eV
minimum distance =  2.20838670981442 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.5227976553537802
Energy: 0.5003998028585022
Energy: 0.5227976553533449
Energy: 0.5003998028585022
Energy: 0.5227976553533449
Energy: 0.5003998028585022
Energy: 0.4950582972915869
Energy: 0.47788394453563754
Energy: 0.49505829728984596
Energy: 0.47788394453607286
Energy: 0.49505829729245737
Energy: 0.47788394453563754
Energy: 0.455205157159373
Energy: 0.5068720020144732
Energy: 0.45520515716111387
Energy: 0.506872002014038
Energy: 0.4552051571598082
Energy: 0.5068720020144732
Energy: 0.4699419456709627
Energy: 0.4580523917702824
Energy: 0.4699419456705274
Energy: 0.45805239177071755
Energy: 0.46994194567226844
Energy: 0.45805239177071755
Energy: 0.4930988126825959
Energy: 0.4833370485151299
Energy: 0.4930988126817255
Energy: 0.4833370485151299
Energy: 0.49309881268216077
Energy: 0.4833370485146946
Energy: 0.5066825646520587
Energy: 0.5344535384110283
Energy: 0.5066825646511881
Energy: 0.5183659107012742
Energy: 0.506682564652929
Energy: 0.518365910700839
Energy: 0.47965852685734817
Energy: 0.5194881065248593
Energy: 0.4796585268586539
Energy: 0.5194881065248593
Energy: 0.47965852685952437
Energy: 0.5194881065248593
Energy: 0.44172989287302156
Energy: 0.5178824039785715
Energy: 0.44172989287215114
Energy: 0.5178824039785715
Energy: 0.44172989287258635
Energy: 0.5178824039785715
Energy: 0.505157666240069
Energy: 0.48285283403927387
Energy: 0.5051576662409393
Energy: 0.48285283403927387
Energy: 0.5051576662370221
Energy: 0.48285283403927387
Energy: 0.4897393003401884
Energy: 0.5581276394227077
Energy: 0.4897393003388827
Energy: 0.5581276394222725
Energy: 0.48973930033975316
Energy: 0.558127639424884
Energy: 0.4713202135262572
Energy: 0.4546984759222026
Energy: 0.4713202135253867
Energy: 0.45469847592176743
Energy: 0.4713202135262572
Energy: 0.4546984759222026
Energy: 0.470601202897921
Energy: 0.4983754529022455
Energy: 0.4706012028987915
Energy: 0.4983754529070331
Energy: 0.4706012028974858
Energy: 0.4983754529061626
Energy: 0.49374569811689845
Energy: 0.49077728743579385
Energy: 0.49374569811472224
Energy: 0.4907772874349233
Energy: 0.4937456981164632
Energy: 0.49077728743231197
Energy: 0.5196096622559064
Energy: 0.46799318009480595
Energy: 0.5196096622563418
Energy: 0.46799318009437074
Energy: 0.5196096622532951
Energy: 0.4679931800961117
Energy: 0.4605877760639643
Energy: 0.5040046852430617
Energy: 0.4605877760639643
Energy: 0.5040046852430617
Energy: 0.460587776063529
Energy: 0.5040046852434972
Energy: 0.46093375322739893
Energy: 0.4965933253899629
Energy: 0.460933753225658
Energy: 0.4965933253895278
Energy: 0.46093375322739893
Energy: 0.4965933253899629
Energy: 0.6064874527349725
Energy: 0.4509881348869843
Energy: 0.606487452735843
Energy: 0.4509881348878548
Energy: 0.6064874527362782
Energy: 0.45098813488567857
Energy: 0.4694158355543824
Energy: 0.48432707971550365
Energy: 0.4694158355552528
Energy: 0.4843270797150685
Energy: 0.46941583555481764
Energy: 0.48432707971550365
Energy: 0.4451782563899537
Energy: 0.5368703106653715
Energy: 0.44517825638908326
Energy: 0.5368703104426484
Energy: 0.4451782563899537
Energy: 0.5368703104417779
Energy: 0.539875177906455
Energy: 0.47724140035006635
Energy: 0.5398751779055845
Energy: 0.4546770362049256
Energy: 0.5398751779060197
Energy: 0.45467703620710187
Energy: 0.4456635222748516
Energy: 0.5366442324962368
Energy: 0.445663522273546
Energy: 0.5366442324453535
Energy: 0.4456635222748516
Energy: 0.5366442325127757
Energy: 0.4694117090392928
Energy: 0.48435645642579445
Energy: 0.4694117090388575
Energy: 0.48435645642579445
Energy: 0.4694117090392928
Energy: 0.48435645642579445
Energy: 0.6065179765601574
Energy: 0.45105604038678965
Energy: 0.6065179765592869
Energy: 0.45105604038591923
Energy: 0.6065179765597221
Energy: 0.4510560403863544
Energy: 0.4614863494018597
Energy: 0.5114715963316794
Energy: 0.4614863494018597
Energy: 0.5114715963334204
Energy: 0.46148634940055394
Energy: 0.5114715963342908
Energy: 0.4606053203705883
Energy: 0.5044319447932435
Energy: 0.46060532036884744
Energy: 0.5044319447932435
Energy: 0.46060532037015317
Energy: 0.5044319447932435
Energy: 0.5196363203208516
Energy: 0.5023827756782592
Energy: 0.5196363203121468
Energy: 0.5023827756773888
Energy: 0.5196363203256391
Energy: 0.502382775676083
Energy: 0.4939376633671172
Energy: 0.49074777090917615
Energy: 0.49393766336798767
Energy: 0.4907477709113523
Energy: 0.49393766336581146
Energy: 0.4907477709065647
Energy: 0.47060330796907246
Energy: 0.49089008815513013
Energy: 0.47060330796824157
Energy: 0.4908900881533892
Energy: 0.4706033079686768
Energy: 0.4908900881560006
Energy: 0.4713840646878725
Energy: 0.45489636289562135
Energy: 0.4713840646878725
Energy: 0.45489636289562135
Energy: 0.4713840646883077
Energy: 0.45489636289605667
Energy: 0.48968728216557716
Energy: 0.4762581919127936
Energy: 0.4896872821629657
Energy: 0.4762581919171065
Energy: 0.48968728216557716
Energy: 0.4762581919140599
Energy: 0.5049486401360143
Energy: 0.4828787412874561
Energy: 0.504948640133838
Energy: 0.48287874128702085
Energy: 0.5049486401360143
Energy: 0.4828787412878913
Energy: 0.4417222474195002
Energy: 0.5178760472321597
Energy: 0.44172224741906496
Energy: 0.5178760472317244
Energy: 0.4417222474186297
Energy: 0.5178760472321597
Energy: 0.47978353234578774
Energy: 0.5197420012071864
Energy: 0.47978353234665816
Energy: 0.5197420012071864
Energy: 0.4797835323453524
Energy: 0.5197420012067513
Energy: 0.506359639857694
Energy: 0.4943180864721818
Energy: 0.5063596398581293
Energy: 0.4943180864700056
Energy: 0.5063596398581293
Energy: 0.4943180864704409
Energy: 0.4930934079354217
Energy: 0.48421694425849593
Energy: 0.49309340793368084
Energy: 0.4842169442558846
Energy: 0.49309340793498657
Energy: 0.4842169442580608
Energy: 0.47043051782668477
Energy: 0.4579990354140187
Energy: 0.47043051782668477
Energy: 0.4579990354140187
Energy: 0.4704305178271201
Energy: 0.4579990354140187
Energy: 0.45492772735778003
Energy: 0.5069070946666882
Energy: 0.45492772735690956
Energy: 0.5069070946666882
Energy: 0.45492772735690956
Energy: 0.5069070946636415
Energy: 0.49478483829264763
Energy: 0.45242465153286754
Energy: 0.4947848382930829
Energy: 0.45242465153286754
Energy: 0.49478483829090675
Energy: 0.45242465153286754
Energy: 0.5227976553568269
Energy: 0.5003998028567612
Energy: 0.5227976553572621
Energy: 0.5003998028576316
Energy: 0.5227976553568269
Energy: 0.5003998028571964
Energy: 0.49505829729245737
Energy: 0.4778839445343319
Energy: 0.49505829729115164
Energy: 0.47788394453389665
Energy: 0.4950582972915869
Energy: 0.4778839445343319
Energy: 0.45520515715893767
Energy: 0.5068720020175199
Energy: 0.4552051571598082
Energy: 0.5068720020162143
Energy: 0.455205157159373
Energy: 0.506872002015779
Energy: 0.46994194566791603
Energy: 0.45805239177376417
Energy: 0.4699419456674807
Energy: 0.4580523917741995
Energy: 0.46994194566922176
Energy: 0.45805239177376417
Energy: 0.49309881268303124
Energy: 0.48333704851295367
Energy: 0.49309881268303124
Energy: 0.48333704851295367
Energy: 0.4930988126817255
Energy: 0.48333704851295367

minimum gb energy = 0.4417222474186297 eV
minimum distance =  2.28030047317925 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.2352678683348868
Energy: 0.24012567433562737
Energy: 0.2352678683348868
Energy: 0.24012567432774637
Energy: 0.2352678683348868
Energy: 0.24012567433166432
Energy: 0.28691257279180843
Energy: 0.23604369735505826
Energy: 0.28691257279279925
Energy: 0.23604369735505826
Energy: 0.28691257279279925
Energy: 0.23604369735505826
Energy: 0.2587437318210141
Energy: 0.2829991855366078
Energy: 0.2587437318210141
Energy: 0.2829991855366078
Energy: 0.2587437318210141
Energy: 0.28299918553759856
Energy: 0.24257673848348588
Energy: 0.24011398413983892
Energy: 0.24257673848348588
Energy: 0.24011398413983892
Energy: 0.24257673848447664
Energy: 0.24011398414182045
Energy: 0.28699144590555753
Energy: 0.29202901559902134
Energy: 0.28699144590555753
Energy: 0.29202901559902134
Energy: 0.28699144590555753
Energy: 0.29202901559902134
Energy: 0.23540603383471273
Energy: 0.25915229137463736
Energy: 0.23540603383471273
Energy: 0.25915229137463736
Energy: 0.23540603383471273
Energy: 0.2591522913766189
Energy: 0.23556488983865193
Energy: 0.2591692539019144
Energy: 0.23556488984162421
Energy: 0.2591692539058775
Energy: 0.2355648898396427
Energy: 0.2591692539009237
Energy: 0.28700119709986177
Energy: 0.29201918774323204
Energy: 0.28700119709986177
Energy: 0.29201918774323204
Energy: 0.28700119709986177
Energy: 0.29201918774323204
Energy: 0.24257304829528992
Energy: 0.2401314192470257
Energy: 0.24257304829528992
Energy: 0.24013141924405343
Energy: 0.24257304829528992
Energy: 0.24013141924504416
Energy: 0.2586988070303588
Energy: 0.2830895242479468
Energy: 0.2586988070303588
Energy: 0.2830895242479468
Energy: 0.2586988070303588
Energy: 0.2830895242479468
Energy: 0.2869393975379688
Energy: 0.23612430393081138
Energy: 0.28693939753697806
Energy: 0.23612430393180214
Energy: 0.2869393975379688
Energy: 0.23612430393081138
Energy: 0.2352678683348868
Energy: 0.24012567433265508
Energy: 0.2352678683348868
Energy: 0.24012567433166432
Energy: 0.235267868333896
Energy: 0.24012567433067358
Energy: 0.28691257279180843
Energy: 0.23604369735604902
Energy: 0.28691257279279925
Energy: 0.23604369735505826
Energy: 0.28691257279279925
Energy: 0.23604369735505826
Energy: 0.2587437318210141
Energy: 0.2829991855366078
Energy: 0.2587437318210141
Energy: 0.28299918553759856
Energy: 0.25874373182200483
Energy: 0.2829991855366078
Energy: 0.24257673848348588
Energy: 0.24011398414182045
Energy: 0.24257673848348588
Energy: 0.24011398414082968
Energy: 0.24257673848447664
Energy: 0.24011398414281118
Energy: 0.28699144590555753
Energy: 0.29202901559902134
Energy: 0.28699144590555753
Energy: 0.29202901559902134
Energy: 0.28699144590555753
Energy: 0.29202901559902134
Energy: 0.23540603383471273
Energy: 0.2591522913766189
Energy: 0.23540603383471273
Energy: 0.25915229137463736
Energy: 0.23540603383471273
Energy: 0.2591522913766189
Energy: 0.23556488983865193
Energy: 0.2591692538989872
Energy: 0.2355648898396427
Energy: 0.2591692538950242
Energy: 0.2355648898396427
Energy: 0.25916925389997797
Energy: 0.28700119709986177
Energy: 0.29201918774323204
Energy: 0.28700119709986177
Energy: 0.29201918774323204
Energy: 0.28700119709986177
Energy: 0.29201918774323204

minimum gb energy = 0.235267868333896 eV
minimum distance =  2.35344203591265 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.4157084363722322
Energy: 0.49808159565588894
Energy: 0.4157084363722322
Energy: 0.49808159565588894
Energy: 0.41570843637150645
Energy: 0.49808159565588894
Energy: 0.5078474740482468
Energy: 0.4340636666489409
Energy: 0.5078474740482468
Energy: 0.4340636666482151
Energy: 0.5078474740482468
Energy: 0.43406366664748935
Energy: 0.5050019221809946
Energy: 0.5686101922362197
Energy: 0.5050019221817204
Energy: 0.5686101922362197
Energy: 0.5050019221809946
Energy: 0.5686101922362197
Energy: 0.5190573458292239
Energy: 0.39377916193338175
Energy: 0.5190573458298836
Energy: 0.39377916193338175
Energy: 0.5190573458306094
Energy: 0.39377916193265605
Energy: 0.38869176979248543
Energy: 0.3779991999849084
Energy: 0.388691769791034
Energy: 0.3779991999849084
Energy: 0.38869176979175973
Energy: 0.3779991999849084
Energy: 0.47223954837053295
Energy: 0.38841370664509145
Energy: 0.4722395483698072
Energy: 0.38841370664509145
Energy: 0.47223954837053295
Energy: 0.38841370664509145
Energy: 0.37594809397024
Energy: 0.41236759251313454
Energy: 0.37594809397096574
Energy: 0.412367592514586
Energy: 0.37594809397096574
Energy: 0.41236759251386024
Energy: 0.5097062567097088
Energy: 0.36342703923977815
Energy: 0.5097062567097088
Energy: 0.36342703923977815
Energy: 0.5097062567104346
Energy: 0.36342703923977815
Energy: 0.507738337781285
Energy: 0.36528458483686693
Energy: 0.5077383377805591
Energy: 0.36528458483686693
Energy: 0.5077383377798333
Energy: 0.36528458483686693
Energy: 0.37097262950547116
Energy: 0.5346796279228984
Energy: 0.37097262950547116
Energy: 0.5346796279228984
Energy: 0.37097262950619686
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Energy: 0.38971517717557813
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Energy: 0.3959106000307568
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Energy: 0.4938956744447922
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Energy: 0.5162820445602277
Energy: 0.43558539008613056
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Energy: 0.516282044559502
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Energy: 0.4061171305448189
Energy: 0.4121097105960297
Energy: 0.4061171305433674
Energy: 0.41210971059530394
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Energy: 0.4491669438734913
Energy: 0.43290622735250567
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Energy: 0.5804336182687422
Energy: 0.43336221930353314
Energy: 0.5804336182701937
Energy: 0.4333622193057104
Energy: 0.5804336182694679
Energy: 0.4333622193049847
Energy: 0.4671599240487988
Energy: 0.39195677568282794
Energy: 0.46715992404734724
Energy: 0.3919567756821022
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Energy: 0.39195677568282794
Energy: 0.38994118672928507
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Energy: 0.38994118673001077
Energy: 0.45503184176706574
Energy: 0.3899411867321881
Energy: 0.45503184176706574
Energy: 0.3711560890731487
Energy: 0.38941254529925867
Energy: 0.3711560890716972
Energy: 0.3894125453007102
Energy: 0.3711560890716972
Energy: 0.3894125452985329
Energy: 0.3967923993975119
Energy: 0.41165250180068375
Energy: 0.3967923993975119
Energy: 0.4116525017992322
Energy: 0.3967923993975119
Energy: 0.4116525017992322
Energy: 0.4450878855053881
Energy: 0.44867052276387664
Energy: 0.4450878855046623
Energy: 0.4486705227646024
Energy: 0.4450878855053881
Energy: 0.44867052276387664
Energy: 0.4603597871292481
Energy: 0.4299531746725089
Energy: 0.4603597871285223
Energy: 0.4299531746725089
Energy: 0.4603597871292481
Energy: 0.4299531746725089
Energy: 0.3712211968456782
Energy: 0.5361444751618324
Energy: 0.371221196846404
Energy: 0.5361444751647354
Energy: 0.3712211968456782
Energy: 0.5361444751618324
Energy: 0.6902149051603684
Energy: 0.48598594674699297
Energy: 0.6902149051610943
Energy: 0.48598594674699297
Energy: 0.6902149051603684
Energy: 0.48598594674699297

minimum gb energy = 0.36342703923977815 eV
minimum distance =  2.27206121899728 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.45974651952566076
Energy: 0.4127155665036649
Energy: 0.45974651952566076
Energy: 0.4127155665036649
Energy: 0.45974651952508877
Energy: 0.4127155665036649
Energy: 0.44533462879931146
Energy: 0.4385546718691634
Energy: 0.44533462879816743
Energy: 0.43855467186973546
Energy: 0.44533462879816743
Energy: 0.4385546718680194
Energy: 0.48496983779913655
Energy: 0.48224223277017525
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Energy: 0.4822422327696032
Energy: 0.48496983779913655
Energy: 0.4822422327696032
Energy: 0.4403116662193172
Energy: 0.408901031318839
Energy: 0.4403116662187452
Energy: 0.408901031318839
Energy: 0.4403116662193172
Energy: 0.408901031318839
Energy: 0.4037702659711717
Energy: 0.4316645218629984
Energy: 0.40377026597174376
Energy: 0.4316645218629984
Energy: 0.40377026597059973
Energy: 0.4316645218629984
Energy: 0.5411560667925868
Energy: 0.44250709692411894
Energy: 0.5411560667925868
Energy: 0.44250709692354695
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Energy: 0.44250709692411894
Energy: 0.4060966267741777
Energy: 0.5866652397745794
Energy: 0.4060966267741777
Energy: 0.5866652397751515
Energy: 0.4060966267741777
Energy: 0.5866652397751515
Energy: 0.402025711535789
Energy: 0.4089127516966966
Energy: 0.402025711536361
Energy: 0.4089127516972686
Energy: 0.40202571153524297
Energy: 0.4089127516966966
Energy: 0.4061682855931542
Energy: 0.42584319102164636
Energy: 0.4061682855931542
Energy: 0.42584319102164636
Energy: 0.40616828559372614
Energy: 0.42584319102164636
Energy: 0.43657334646523643
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Energy: 0.43657334646523643
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Energy: 0.43657334646580837
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Energy: 0.4337542960050698
Energy: 0.447999264510651
Energy: 0.4337542960056418
Energy: 0.44799926451007904
Energy: 0.4337542960050698
Energy: 0.4479992645089349
Energy: 0.39739734918421993
Energy: 0.4261873420123176
Energy: 0.39739734918421993
Energy: 0.426187341990581
Energy: 0.39739734918536396
Energy: 0.426187341990581
Energy: 0.3958283265836802
Energy: 0.4059663941896022
Energy: 0.3958283265836802
Energy: 0.40596639418845815
Energy: 0.3958283265836802
Energy: 0.4059663941896022
Energy: 0.3819956728297504
Energy: 0.4466567822279093
Energy: 0.3819956728297504
Energy: 0.44665678222733735
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Energy: 0.4344207990006824
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Energy: 0.4256479612698628
Energy: 0.3818748383609829
Energy: 0.4787341776084319
Energy: 0.38187483836041086
Energy: 0.4189055913450446
Energy: 0.38187483836041086
Energy: 0.4189055913450446
Energy: 0.3989959841971152
Energy: 0.4059721285935258
Energy: 0.3989959841982592
Energy: 0.4059721285935258
Energy: 0.3989959841976872
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Energy: 0.41574182292382056
Energy: 0.4833455522762068
Energy: 0.41574182292553663
Energy: 0.48334555227506276
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Energy: 0.48334555227563486
Energy: 0.44325564830911207
Energy: 0.4386076987545737
Energy: 0.44325564830854003
Energy: 0.4386076987540017
Energy: 0.44325564830911207
Energy: 0.4386076987562898
Energy: 0.43400946035094096
Energy: 0.4096679740922388
Energy: 0.43400946035094096
Energy: 0.4096679740950989
Energy: 0.4340094603549451
Energy: 0.4096679740950989
Energy: 0.412787102848521
Energy: 0.43806357625554543
Energy: 0.41278710284909303
Energy: 0.4380635762503973
Energy: 0.41278710284737696
Energy: 0.4380635762503973
Energy: 0.42504604586521927
Energy: 0.4806741521936798
Energy: 0.4250460458657913
Energy: 0.48067415219596793
Energy: 0.42504604586636324
Energy: 0.48067415219711196
Energy: 0.43655528098947954
Energy: 0.4056323496162222
Energy: 0.43655528098947954
Energy: 0.4056323496167943
Energy: 0.4365552809900515
Energy: 0.4056323496162222
Energy: 0.3820062522429401
Energy: 0.4355454617966029
Energy: 0.3820062522435121
Energy: 0.4355454617971749
Energy: 0.3820062522429401
Energy: 0.435545461798319
Energy: 0.3854417382262511
Energy: 0.535968087871807
Energy: 0.3854417382256791
Energy: 0.535968087869519
Energy: 0.3854417382256791
Energy: 0.535968087871807
Energy: 0.40690670968895826
Energy: 0.4472572553068759
Energy: 0.40690670968895826
Energy: 0.4472572553063038
Energy: 0.40690670968838627
Energy: 0.4472572553068759
Energy: 0.3975124744202482
Energy: 0.4054981507128539
Energy: 0.3975124744202482
Energy: 0.4054981507122819
Energy: 0.39751247442082016
Energy: 0.4054981507122819
Energy: 0.40357190914320923
Energy: 0.43040567356598236
Energy: 0.40357190914320923
Energy: 0.4304056735665544
Energy: 0.40357190914320923
Energy: 0.43040567356598236
Energy: 0.4424950936572374
Energy: 0.45046415648833604
Energy: 0.4424950936583814
Energy: 0.45046415614185137
Energy: 0.4424950936572374
Energy: 0.45046415605836326
Energy: 0.47441219513898564
Energy: 0.4247855631611469
Energy: 0.4744121951384136
Energy: 0.4247855631605749
Energy: 0.47441219513669763
Energy: 0.42478556315943083
Energy: 0.3927075632119876
Energy: 0.5130974398122301
Energy: 0.3927075632119876
Energy: 0.5130974398128021
Energy: 0.39270756321255956
Energy: 0.5130974398128021
Energy: 0.4075823822534308
Energy: 0.42537216187113047
Energy: 0.40758238225457477
Energy: 0.42537216187113047
Energy: 0.4075823822534308
Energy: 0.42537216187113047
Energy: 0.38513200641028644
Energy: 0.4183085066106945
Energy: 0.38513200641028644
Energy: 0.4183085066106945
Energy: 0.38513200641028644
Energy: 0.4183085066106945

minimum gb energy = 0.38187483836041086 eV
minimum distance =  2.28954438814844 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.4794074518348762
Energy: 0.4304193398212175
Energy: 0.4794074518344748
Energy: 0.4304193398212175
Energy: 0.4794074518336719
Energy: 0.4304193398204146
Energy: 0.47744711384937855
Energy: 0.41123371515116564
Energy: 0.4774471138485757
Energy: 0.41123371515156704
Energy: 0.47744711384937855
Energy: 0.41123371515116564
Energy: 0.44374448738894606
Energy: 0.4933877506604913
Energy: 0.44374448738854466
Energy: 0.4933877506604913
Energy: 0.4437444873873403
Energy: 0.4933877506633015
Energy: 0.4403996305437524
Energy: 0.4221307091671681
Energy: 0.44039963054495673
Energy: 0.4221307091671681
Energy: 0.4403996305457596
Energy: 0.4221307091671681
Energy: 0.4415816060809895
Energy: 0.4668609519157471
Energy: 0.4415816060809895
Energy: 0.4668609519169515
Energy: 0.4415816060809895
Energy: 0.4668609519181558
Energy: 0.49427662419466495
Energy: 0.4331927549254939
Energy: 0.49427662419787655
Energy: 0.4331927549258954
Energy: 0.49427662419506646
Energy: 0.4331927549258954
Energy: 0.43096744327006503
Energy: 0.47233677469883745
Energy: 0.43096744327006503
Energy: 0.47233677469883745
Energy: 0.4309674432684593
Energy: 0.47233677469883745
Energy: 0.4594828359461342
Energy: 0.47010326306403705
Energy: 0.45948283594533124
Energy: 0.47010326306403705
Energy: 0.45948283594533124
Energy: 0.4701032630632342
Energy: 0.4927267021059202
Energy: 0.443646669661969
Energy: 0.4927267021035115
Energy: 0.4436466696623705
Energy: 0.4927267021011028
Energy: 0.443646669661969
Energy: 0.6500585679589546
Energy: 0.4244127204003071
Energy: 0.6500585679585532
Energy: 0.4244127204003071
Energy: 0.6500585679597575
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Energy: 0.4528309838963589
Energy: 0.4520990009368136
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Energy: 0.4528309838963589
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Energy: 0.4689025603042793
Energy: 0.42134746260427797
Energy: 0.4689025602938417
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Energy: 0.46890256030066624
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Energy: 0.4450205179709812
Energy: 0.4935512324995921
Energy: 0.4450205179721855
Energy: 0.4935512324979864
Energy: 0.44502051797178405
Energy: 0.4935512324983877
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Energy: 0.45634957757435046
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Energy: 0.43014492956935324
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Energy: 0.430144929566543
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Energy: 0.49466466101782386
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Energy: 0.49466466102384554
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Energy: 0.4293701378959438
Energy: 0.4671119260748088
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Energy: 0.4671119260238618
Energy: 0.4293701378959438
Energy: 0.41929555110402655
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Energy: 0.41929555110362504
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Energy: 0.4950836293438873
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Energy: 0.49508362934308436
Energy: 0.44331064853074553
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Energy: 0.44546705067879366
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Energy: 0.4964248670363383
Energy: 0.4454670506795965
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Energy: 0.4301992221705548
Energy: 0.46594743481564116
Energy: 0.40939402597794283
Energy: 0.47762283327486077
Energy: 0.40939402597794283
Energy: 0.47762283327526217
Energy: 0.40939402597794283
Energy: 0.47762283327486077
Energy: 0.4612451295484289
Energy: 0.4062748630060416
Energy: 0.4612451295480275
Energy: 0.4062748630056402
Energy: 0.4612451295472245
Energy: 0.40627486300644305
Energy: 0.4243521993640911
Energy: 0.46332315166253885
Energy: 0.4243521993640911
Energy: 0.46332315166253885
Energy: 0.4243521993644925
Energy: 0.4633231516621374
Energy: 0.46736696900757513
Energy: 0.42915976050663623
Energy: 0.4673669690216257
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Energy: 0.46736696901560404
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Energy: 0.43117457900726625
Energy: 0.4634679680422366
Energy: 0.43117457900967493
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Energy: 0.431174579008872
Energy: 0.46346796804183515
Energy: 0.4757934288116802
Energy: 0.43283628864466495
Energy: 0.4757934288104758
Energy: 0.43283628864466495
Energy: 0.4757934288108772
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Energy: 0.42488643166313156
Energy: 0.4630793369395831
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Energy: 0.4630793369399845
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Energy: 0.4455175588503829
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Energy: 0.4455175588519888
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Energy: 0.4220928365614009
Energy: 0.4973284697377093
Energy: 0.42209283656099955
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Energy: 0.45401549291984616
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Energy: 0.45401549292064913
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Energy: 0.4963878364514536
Energy: 0.4401573057982305
Energy: 0.4963878364534609
Energy: 0.4401573057986319
Energy: 0.4963878364518552
Energy: 0.4401573057982305
Energy: 0.42438186165779085
Energy: 0.4687300234577989
Energy: 0.4243818616581923
Energy: 0.4687300234634192
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Energy: 0.4687300234577989
Energy: 0.43882343036426047
Energy: 0.4171748978863009
Energy: 0.43882343036345767
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Energy: 0.438823430364662
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Energy: 0.42210178246889
Energy: 0.4976441352378383
Energy: 0.4221017824684886
Energy: 0.4976441352362325
Energy: 0.4221017824684886
Energy: 0.4976441352370355
Energy: 0.44555681732723734
Energy: 0.4943805016633151
Energy: 0.44555681732603303
Energy: 0.4943805016637165
Energy: 0.44555681732723734
Energy: 0.4943805016633151
Energy: 0.4629881206196715
Energy: 0.4249931035107737
Energy: 0.4629881206196715
Energy: 0.4249931035099707
Energy: 0.462988120620073
Energy: 0.4249931035103722
Energy: 0.4759649870110371
Energy: 0.4327212140665144
Energy: 0.4759649870122415
Energy: 0.4327212140669158
Energy: 0.4759649870122415
Energy: 0.4327212140669158
Energy: 0.4311654746385149
Energy: 0.46348651912332495
Energy: 0.4311654746389163
Energy: 0.4634865191241278
Energy: 0.4311654746393177
Energy: 0.46348651912573363
Energy: 0.46698326882568597
Energy: 0.42915770044789264
Energy: 0.46698326882729174
Energy: 0.42915770044789264
Energy: 0.4669832688264889
Energy: 0.42915770044789264
Energy: 0.42423988738420887
Energy: 0.47585348277559997
Energy: 0.42423988738420887
Energy: 0.4758534827760015
Energy: 0.42423988738340596
Energy: 0.4758534827760015
Energy: 0.4613005223214552
Energy: 0.40658695459489896
Energy: 0.4613005223206522
Energy: 0.40658695459570177
Energy: 0.4613005223214552
Energy: 0.40658695459449745
Energy: 0.40923350742478093
Energy: 0.4775199340608663
Energy: 0.40923350742357656
Energy: 0.47751993405685184
Energy: 0.40923350742357656
Energy: 0.4775199340608663

minimum gb energy = 0.4062748630056402 eV
minimum distance =  2.29621537767834 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.4929243130142333
Energy: 0.457057008282392
Energy: 0.4929243130139589
Energy: 0.4570570082826664
Energy: 0.4929243130145077
Energy: 0.457057008282392
Energy: 0.4804913619713317
Energy: 0.4300357541862623
Energy: 0.48049136197078285
Energy: 0.43003575418601847
Energy: 0.4804913619710573
Energy: 0.4300357541862623
Energy: 0.4518724408354404
Energy: 0.5381873587272136
Energy: 0.6416310765613568
Energy: 0.5381873587280063
Energy: 0.4691560343836283
Energy: 0.5381873587285246
Energy: 0.48050490468931484
Energy: 0.42998198983412583
Energy: 0.48050490468931484
Energy: 0.42998198983412583
Energy: 0.4805049046890404
Energy: 0.42998198983412583
Energy: 0.49292431301341005
Energy: 0.457057008282392
Energy: 0.4929243130139589
Energy: 0.457057008282392
Energy: 0.49292431301341005
Energy: 0.4570570082826664
Energy: 0.4804913619699902
Energy: 0.4300357541881526
Energy: 0.4804913619705085
Energy: 0.43003575418787826
Energy: 0.4804913619699902
Energy: 0.43003575418787826
Energy: 0.6363419366588723
Energy: 0.5381873587269391
Energy: 0.4691560343820125
Energy: 0.5381873587277319
Energy: 0.469156034381738
Energy: 0.5381873587274575

minimum gb energy = 0.42998198983412583 eV
minimum distance =  2.29962259649995 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.6717131071965544
Energy: 0.5586304254350704
Energy: 0.6474109960215356
Energy: 0.5586304254372609
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Energy: 0.5586304254368627
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Energy: 0.5268075476385093
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Energy: 0.526807547643289
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Energy: 0.6024015110309816
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Energy: 0.5426145334959994
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Energy: 0.6091962312541173
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Energy: 0.6087538786782044
Energy: 0.5631833015103739
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Energy: 0.546231503313515
Energy: 0.5805234042463003
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Energy: 0.5805234042481591
Energy: 0.5462315033120546
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Energy: 0.5667773003770531
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Energy: 0.5476528767424331
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Energy: 0.5474474672817529
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Energy: 0.5565065316769714
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Energy: 0.5481926511784216
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Energy: 0.5526601789544947
Energy: 0.5481926511707211
Energy: 0.5526601789548267
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Energy: 0.4995961732023017
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Energy: 0.5374653476468655
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Energy: 0.5789342974670058
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Energy: 0.55281726601645
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Energy: 0.5518165590265558
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Energy: 0.5376311022137634
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Energy: 0.5633923532790488
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Energy: 0.5633923532874795
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Energy: 0.5460084719677559
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Energy: 0.5460084719666938
Energy: 0.5275672589156778
Energy: 0.5424525826307425
Energy: 0.5273356257599386
Energy: 0.5424521855728279
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Energy: 0.6032196405263931
Energy: 0.5296883465366873
Energy: 0.603219640526725
Energy: 0.5296883465297834
Energy: 0.6032196405263931
Energy: 0.5296883465293851
Energy: 0.534269668617831
Energy: 0.528786221684899
Energy: 0.5342696686192916
Energy: 0.5287862216728837
Energy: 0.534269668617831
Energy: 0.5287862216732155
Energy: 0.5691859193471391
Energy: 0.5141529131976263
Energy: 0.5691859193515205
Energy: 0.5141529131968962
Energy: 0.5691859193474711
Energy: 0.5141529131968962
Energy: 0.5379169965592455
Energy: 0.5795765150534276
Energy: 0.5379169965574531
Energy: 0.5795765150610617
Energy: 0.5379169965570548
Energy: 0.5795765150610617
Energy: 0.59124446097109
Energy: 0.5215854265739751
Energy: 0.5912444609732805
Energy: 0.521585426570324
Energy: 0.5912444609688993
Energy: 0.521585426570656
Energy: 0.5722985041980665
Energy: 0.518969168672193
Energy: 0.5725181554743929
Energy: 0.5189691686696041
Energy: 0.5722985041940835
Energy: 0.5189691686688739
Energy: 0.5645304028561505
Energy: 0.533503328480995
Energy: 0.5645304028558186
Energy: 0.5335033284857084
Energy: 0.564530402853628
Energy: 0.5335033284861065
Energy: 0.5273433077605143
Energy: 0.5809576787678368
Energy: 0.5273433077528803
Energy: 0.5809576787656461
Energy: 0.5273433077532123
Energy: 0.5809576787609328
Energy: 0.5553176959995406
Energy: 0.5570203303270982
Energy: 0.5553176960010011
Energy: 0.5570203303285586
Energy: 0.5553176959973499
Energy: 0.5570203303296207
Energy: 0.5600028802518994
Energy: 0.5602577555935658
Energy: 0.5599573176952867
Energy: 0.5602577556052493
Energy: 0.560002880257741
Energy: 0.560257755604519

minimum gb energy = 0.49959617319792043 eV
minimum distance =  2.2634253170688 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 0.6359545861148372
Energy: 0.5621004328187863
Energy: 0.5998966121845483
Energy: 0.5621004328187863
Energy: 0.6359545861158395
Energy: 0.5621004328157797
Energy: 0.5538871654865932
Energy: 0.538390686271985
Energy: 0.5538871654825844
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Energy: 0.5538871654865932
Energy: 0.5383906862659718
Energy: 0.5482606451619441
Energy: 0.48583142208710406
Energy: 0.5482312809862073
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Energy: 0.48583142208760516
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Energy: 0.5362106673363954
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Energy: 0.5362106673268744
Energy: 0.55902142096803
Energy: 0.48351719482437544
Energy: 0.5590214209700343
Energy: 0.48351719482437544
Energy: 0.5590214209675288
Energy: 0.48351719482733657
Energy: 0.5407429938645874
Energy: 0.5470231815919926
Energy: 0.5407429938635852
Energy: 0.5470231815914914
Energy: 0.5407429938640862
Energy: 0.5470231815914914
Energy: 0.47731439031965595
Energy: 0.5556440631583058
Energy: 0.47731439032015704
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Energy: 0.47731439031965595
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Energy: 0.533757100373008
Energy: 0.5527067175552822
Energy: 0.5337571005267565
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Energy: 0.53375710027634
Energy: 0.5543619463416778
Energy: 0.5394363608413665
Energy: 0.554361946343181
Energy: 0.5394363608413665
Energy: 0.554361946342179
Energy: 0.5394363608373577
Energy: 0.5459618951101484
Energy: 0.47728452397431
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Energy: 0.5459618951111507
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Energy: 0.49681654782716017
Energy: 0.5721005195630473
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Energy: 0.5721005195645508
Energy: 0.49681654782565676
Energy: 0.5394135395079538
Energy: 0.47963414773792634
Energy: 0.5394135395079538
Energy: 0.47963414773792634
Energy: 0.5394135395084548
Energy: 0.47963414774293744
Energy: 0.5917917831420313
Energy: 0.5471875586845116
Energy: 0.5921353311448497
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Energy: 0.5917917831445368
Energy: 0.5471875586855139
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Energy: 0.48224007821545156
Energy: 0.5299063897075846
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Energy: 0.5299063897065825
Energy: 0.48224007821545156
Energy: 0.5299063897085868
Energy: 0.5363117894232231
Energy: 0.5985641817702098
Energy: 0.5363117894242252
Energy: 0.5985641817727153
Energy: 0.5363117894222209
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Energy: 0.48461068426595333
Energy: 0.5393878685184532
Energy: 0.4846106842679578
Energy: 0.5393878685189543
Energy: 0.48461068426545223
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Energy: 0.5609030261902687
Energy: 0.5206215377815774
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Energy: 0.5695786751281302
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Energy: 0.5748071094736111
Energy: 0.4693480560995372
Energy: 0.5371076039466733
Energy: 0.46934805609903607
Energy: 0.5748071094736111
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Energy: 0.5307085445525298
Energy: 0.5477191940582984
Energy: 0.5307072765895089
Energy: 0.5733408599969194
Energy: 0.6351467751885562
Energy: 0.5733408599959172
Energy: 0.6351467751865517
Energy: 0.5733408599964184
Energy: 0.6351467751865517
Energy: 0.5331017186886378
Energy: 0.5249950809040346
Energy: 0.5331017186921454
Energy: 0.5249950809040346
Energy: 0.5331017186886378
Energy: 0.5249950809050367
Energy: 0.5420413375972273
Energy: 0.5468258716421122
Energy: 0.5420413376027394
Energy: 0.54682587164111
Energy: 0.5420413375972273
Energy: 0.5468258716421122
Energy: 0.5402453625216418
Energy: 0.553741736253637
Energy: 0.5400533363332167
Energy: 0.553741736253637
Energy: 0.5402453625216418
Energy: 0.5537417362561426
Energy: 0.4775504309481642
Energy: 0.49715304332746474
Energy: 0.47755043094515753
Energy: 0.49715304332696364
Energy: 0.47755043094766314
Energy: 0.49715304332495924
Energy: 0.5361088583546852
Energy: 0.56817615256225
Energy: 0.5361088583556874
Energy: 0.5681761525627511
Energy: 0.5361088583546852
Energy: 0.5681761525597444
Energy: 0.4844347210909594
Energy: 0.5931615159463828
Energy: 0.48443472109146046
Energy: 0.5931615159463828
Energy: 0.4844347210904583
Energy: 0.5931615159433762
Energy: 0.5523644860360918
Energy: 0.5354381982190448
Energy: 0.5523745371003508
Energy: 0.5354382076657161
Energy: 0.5523644860360918
Energy: 0.5354381928095125
Energy: 0.5564926584690025
Energy: 0.5066483998639236
Energy: 0.5564937366356922
Energy: 0.5066483998639236
Energy: 0.5564926584695036
Energy: 0.5066483998624204
Energy: 0.5292363921172126
Energy: 0.653866960143683
Energy: 0.5292290584481718
Energy: 0.6538669601431819
Energy: 0.5292363921172126
Energy: 0.6538669601456875
Energy: 0.5493175746880815
Energy: 0.536491673222741
Energy: 0.5493175746840726
Energy: 0.5364916732217386
Energy: 0.5493175746850749
Energy: 0.5364916732222399
Energy: 0.5400109034357774
Energy: 0.5285822960997619
Energy: 0.5400109034342742
Energy: 0.5285822960997619
Energy: 0.5400109034352764
Energy: 0.5285822961017663
Energy: 0.5601489003170449
Energy: 0.5474108098446209
Energy: 0.5601489003170449
Energy: 0.5474108098446209
Energy: 0.5601489003165437
Energy: 0.5474108098521374

minimum gb energy = 0.4693480560955283 eV
minimum distance =  2.28790154333827 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.6258040004116626
Energy: 0.4939710966763706
Energy: 0.625804000411047
Energy: 0.4939710966763706
Energy: 0.6258040004116626
Energy: 0.4939710966769862
Energy: 0.5477133361218253
Energy: 0.4931627944981265
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Energy: 0.5700774647875775
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Energy: 0.49555548872531147
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Energy: 0.5395137193516527
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Energy: 0.5236779567355639
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Energy: 0.5236779567361793
Energy: 0.5698778134235059
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Energy: 0.5698778134259679
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Energy: 0.4752699049318424
Energy: 0.5964652481293956
Energy: 0.47526990493122684
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Energy: 0.47526990493122684
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Energy: 0.5426128122594552
Energy: 0.546968199594052
Energy: 0.5426128122588397
Energy: 0.546968199594052
Energy: 0.5426128122588397
Energy: 0.546968199594052
Energy: 0.5344528756200841
Energy: 0.5295696559233992
Energy: 0.5344528756206997
Energy: 0.529569655919706
Energy: 0.5344528756194685
Energy: 0.5295696559203216
Energy: 0.5542452748961582
Energy: 0.4923915652934053
Energy: 0.5542452748943115
Energy: 0.4923915652934053
Energy: 0.5542452748961582
Energy: 0.4923915652927897
Energy: 0.5730152813133232
Energy: 0.5231054822413798
Energy: 0.5730152813139388
Energy: 0.5231054822413798
Energy: 0.5730152813133232
Energy: 0.5231054822419953
Energy: 0.572973933943897
Energy: 0.514912386682373
Energy: 0.572973933943897
Energy: 0.514912386682373
Energy: 0.5729739339445125
Energy: 0.514912386682373
Energy: 0.5536292182607284
Energy: 0.4922655160353274
Energy: 0.5536292182619593
Energy: 0.4922655160347119
Energy: 0.5536292182607284
Energy: 0.4922655160353274
Energy: 0.5338536587937842
Energy: 0.5415754276886404
Energy: 0.5338536587937842
Energy: 0.5415754276892559
Energy: 0.5338536587937842
Energy: 0.5415754276886404
Energy: 0.5666454745790778
Energy: 0.5483705018100441
Energy: 0.5666454745796934
Energy: 0.5483705018100441
Energy: 0.5666454745796934
Energy: 0.5483705018100441
Energy: 0.4758351778732948
Energy: 0.5591217674603151
Energy: 0.4758351778726793
Energy: 0.5591217674603151
Energy: 0.47583517787206386
Energy: 0.5591217674609305
Energy: 0.5699088704573398
Energy: 0.5323255465776481
Energy: 0.5699088704573398
Energy: 0.5323255465770327
Energy: 0.5699088704573398
Energy: 0.5323255465770327
Energy: 0.5179168306299502
Energy: 0.5149305085481104
Energy: 0.5179168306299502
Energy: 0.5149305085487258
Energy: 0.5179168306299502
Energy: 0.5149305085487258
Energy: 0.5673092386017772
Energy: 0.5320580885008952
Energy: 0.5673092386017772
Energy: 0.5320580885015106
Energy: 0.5673092386011617
Energy: 0.5320580885008952
Energy: 0.5139875492725889
Energy: 0.49275978969475387
Energy: 0.5139875492719733
Energy: 0.49275978969475387
Energy: 0.5139875492725889
Energy: 0.4927597896941383
Energy: 0.5587614486731887
Energy: 0.4954422642158164
Energy: 0.5587614486719575
Energy: 0.4954422642158164
Energy: 0.5587614486719575
Energy: 0.4954422642158164
Energy: 0.5179453572935794
Energy: 0.5402659874969592
Energy: 0.5179453572935794
Energy: 0.5402659874969592
Energy: 0.5179453572935794
Energy: 0.5402659874975746
Energy: 0.5437232396426885
Energy: 0.5566485682529876
Energy: 0.5437232396426885
Energy: 0.5566485682529876
Energy: 0.5437232396426885
Energy: 0.5566485682529876
Energy: 0.5168969265138279
Energy: 0.5321758587731461
Energy: 0.5168969265144434
Energy: 0.5321758587731461
Energy: 0.5168969265144434
Energy: 0.5321758587731461

minimum gb energy = 0.47526990493122684 eV
minimum distance =  2.27940580414893 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.560557528296449
Energy: 0.48826822418148463
Energy: 0.5605575282956521
Energy: 0.48826822418148463
Energy: 0.560557528297246
Energy: 0.48826822418148463
Energy: 0.5238294495733837
Energy: 0.4731494068132919
Energy: 0.5238294495741808
Energy: 0.4731494068140889
Energy: 0.5238294495733837
Energy: 0.4731494068140889
Energy: 0.5333325293979116
Energy: 0.5857911584561325
Energy: 0.5333325293971146
Energy: 0.5857911584569295
Energy: 0.5333325293987086
Energy: 0.5857911584569295
Energy: 0.5317878763037037
Energy: 0.5457121709837546
Energy: 0.5317878763029068
Energy: 0.5457121709837546
Energy: 0.5317878763037037
Energy: 0.5457121709813637
Energy: 0.5063191079239617
Energy: 0.5466327125031217
Energy: 0.5063191079247586
Energy: 0.5466327125023248
Energy: 0.5063191079231649
Energy: 0.5466327125023248
Energy: 0.5273221246300303
Energy: 0.524671994668183
Energy: 0.5273221246340151
Energy: 0.524671994668183
Energy: 0.527322124635609
Energy: 0.524671994668183
Energy: 0.5314204698631911
Energy: 0.5759146412519129
Energy: 0.531420469863988
Energy: 0.5759146412519129
Energy: 0.5314204698631911
Energy: 0.5759146412519129
Energy: 0.5311569974467107
Energy: 0.47156941613973585
Energy: 0.5311569974475078
Energy: 0.471569416137345
Energy: 0.5311569974475078
Energy: 0.471569416137345
Energy: 0.5091093341625651
Energy: 0.4728027722629271
Energy: 0.509109334160174
Energy: 0.4728027722629271
Energy: 0.5091093341617681
Energy: 0.4728027722629271
Energy: 0.46725094099463005
Energy: 0.524785818201162
Energy: 0.4672509409954271
Energy: 0.524785818201162
Energy: 0.46725094099463005
Energy: 0.524785818201162
Energy: 0.5311836014740098
Energy: 0.5474105986647185
Energy: 0.5311836014740098
Energy: 0.5474105986647185
Energy: 0.5311836014740098
Energy: 0.5474105986639215
Energy: 0.5113173489778583
Energy: 0.5587237239449804
Energy: 0.5113173489778583
Energy: 0.5587237239465743
Energy: 0.5113173489778583
Energy: 0.5587237239481683
Energy: 0.5084759244586903
Energy: 0.4725562588167935
Energy: 0.5084759244586903
Energy: 0.47255625881599655
Energy: 0.5084759244562993
Energy: 0.47255625881599655
Energy: 0.5344063513828569
Energy: 0.4803785167731842
Energy: 0.5344063513812628
Energy: 0.4803785167731842
Energy: 0.5344063513908264
Energy: 0.4803785167731842
Energy: 0.5126630905508027
Energy: 0.4744505262382222
Energy: 0.5126630905054119
Energy: 0.47445052623742523
Energy: 0.5126630905269299
Energy: 0.4744505262382222
Energy: 0.5121854624797769
Energy: 0.47488519471446394
Energy: 0.5121854624789799
Energy: 0.4748851947112761
Energy: 0.5121854624797769
Energy: 0.47488519471526097
Energy: 0.46280101135409585
Energy: 0.5253895963907596
Energy: 0.46280101135409585
Energy: 0.5253895963907596
Energy: 0.4628010113556898
Energy: 0.5253895963907596
Energy: 0.5293675858907878
Energy: 0.523983470109306
Energy: 0.5293675858915847
Energy: 0.5239834701101029
Energy: 0.5293675858923816
Energy: 0.523983470109306
Energy: 0.463010712892607
Energy: 0.5252868032989054
Energy: 0.46301071289180995
Energy: 0.5252868032981084
Energy: 0.46301071289180995
Energy: 0.5252868032981084
Energy: 0.5121551889527756
Energy: 0.47481936488082616
Energy: 0.5121551889527756
Energy: 0.47481936488082616
Energy: 0.5121551889527756
Energy: 0.47481936487923215
Energy: 0.5124224097016693
Energy: 0.47458823496654945
Energy: 0.5124224097024663
Energy: 0.47458823496575253
Energy: 0.5124224097032634
Energy: 0.47458823496654945
Energy: 0.5357618929338254
Energy: 0.48780099156497936
Energy: 0.5357618929330284
Energy: 0.4878009915641824
Energy: 0.5357618929330284
Energy: 0.4878009915641824
Energy: 0.508518185942059
Energy: 0.47251837316987816
Energy: 0.5085181859468408
Energy: 0.47251837316987816
Energy: 0.5085181859500287
Energy: 0.47251837316987816
Energy: 0.5114466325723923
Energy: 0.5584143584203084
Energy: 0.5114466325723923
Energy: 0.5584143584258873
Energy: 0.5114466325723923
Energy: 0.5584143584250902

minimum gb energy = 0.46280101135409585 eV
minimum distance =  2.29952953352789 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.5325541052060911
Energy: 0.48131391720052985
Energy: 0.5325541052072182
Energy: 0.48131391720052985
Energy: 0.5325541052060911
Energy: 0.48131391720052985
Energy: 0.4676084794778081
Energy: 0.4619435139126022
Energy: 0.467608479476681
Energy: 0.4619435139126022
Energy: 0.467608479475554
Energy: 0.4619435139137293
Energy: 0.5184397610989063
Energy: 0.5469360454203785
Energy: 0.5184397610989063
Energy: 0.5469360454203785
Energy: 0.5184397610989063
Energy: 0.5469360454203785
Energy: 0.4490782336275044
Energy: 0.5355477964623988
Energy: 0.4490782336286315
Energy: 0.5355477964623988
Energy: 0.4490782336275044
Energy: 0.5355477964623988
Energy: 0.5214189778541597
Energy: 0.5141992264172321
Energy: 0.5214189778552867
Energy: 0.5141992264172321
Energy: 0.5214189778541597
Energy: 0.514199226416105
Energy: 0.4898123267933572
Energy: 0.527825324143452
Energy: 0.4898123267933572
Energy: 0.5278253241423249
Energy: 0.4898123267933572
Energy: 0.527825324143452
Energy: 0.5259606738792828
Energy: 0.4647255635585956
Energy: 0.5259606738781557
Energy: 0.4647255635585956
Energy: 0.5259606738792828
Energy: 0.4647255635585956
Energy: 0.4482206418037779
Energy: 0.5257513242911244
Energy: 0.4482206418026508
Energy: 0.5257513242911244
Energy: 0.4482206418026508
Energy: 0.5257513242899973
Energy: 0.5145249501540503
Energy: 0.46182172333862204
Energy: 0.5145249501551774
Energy: 0.46182172333862204
Energy: 0.5145249501551774
Energy: 0.461821723337495
Energy: 0.4939766603664575
Energy: 0.46465560738544776
Energy: 0.4939766603675845
Energy: 0.46465560738544776
Energy: 0.4939766603675845
Energy: 0.46465560738544776
Energy: 0.487832336342712
Energy: 0.5241584402102223
Energy: 0.48783233634383905
Energy: 0.5241584402102223
Energy: 0.487832336342712
Energy: 0.5241584402102223
Energy: 0.49615249151422414
Energy: 0.46240937802275917
Energy: 0.4961524915153512
Energy: 0.46240937802275917
Energy: 0.49615249151422414
Energy: 0.46240937802163207
Energy: 0.4398432568753514
Energy: 0.5301622434516298
Energy: 0.4398432568753514
Energy: 0.5301622434516298
Energy: 0.4398432568753514
Energy: 0.5301622434516298
Energy: 0.49434532316934227
Energy: 0.5206792233427217
Energy: 0.49434532316934227
Energy: 0.5206792233427217
Energy: 0.49434532316934227
Energy: 0.5206792233427217
Energy: 0.4942486288752331
Energy: 0.5852610971758859
Energy: 0.494248628874106
Energy: 0.5852610971758859
Energy: 0.4942486288729789
Energy: 0.5852610971758859
Energy: 0.4897520252850233
Energy: 0.5315902920379811
Energy: 0.4897520252850233
Energy: 0.5315902920379811
Energy: 0.4897520252850233
Energy: 0.5315902920379811
Energy: 0.4933506628246467
Energy: 0.5202580518681025
Energy: 0.4933506628246467
Energy: 0.5202580518681025
Energy: 0.4933506628246467
Energy: 0.5202580518681025

minimum gb energy = 0.4398432568753514 eV
minimum distance =  2.26452438618149 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.48312543421712495
Energy: 0.4366442086240193
Energy: 0.48312543421886583
Energy: 0.4366442086240193
Energy: 0.48312543421712495
Energy: 0.4366442086235842
Energy: 0.44526352060725
Energy: 0.4375013967278565
Energy: 0.44526352060681484
Energy: 0.4375013967209323
Energy: 0.4452635206076853
Energy: 0.4375013967213675
Energy: 0.4601348705706303
Energy: 0.4635344645679919
Energy: 0.46013487057367697
Energy: 0.4635344645684271
Energy: 0.46013487057150076
Energy: 0.4635344645679919
Energy: 0.41204740155994674
Energy: 0.47970755943619414
Energy: 0.41204740155994674
Energy: 0.47970755943619414
Energy: 0.41204740155951153
Energy: 0.47970755944011123
Energy: 0.4985710719906983
Energy: 0.42441518350284746
Energy: 0.49857107199113354
Energy: 0.4244151835011065
Energy: 0.49857107199156875
Energy: 0.42441518350023594
Energy: 0.46760133601370296
Energy: 0.44436671536207445
Energy: 0.46760133601370296
Energy: 0.44436671536207445
Energy: 0.4676013360145735
Energy: 0.44436671536207445
Energy: 0.4453588183557175
Energy: 0.44734002927234984
Energy: 0.4453588183578936
Energy: 0.44734002927234984
Energy: 0.4453588183574584
Energy: 0.44734002927234984
Energy: 0.4528389284676531
Energy: 0.4960730853493728
Energy: 0.4528389284633007
Energy: 0.4960730853485022
Energy: 0.45283892845981877
Energy: 0.4960730853489375
Energy: 0.4565321126292189
Energy: 0.4683861361518837
Energy: 0.4565321126292189
Energy: 0.4683861361514485
Energy: 0.45653211262878357
Energy: 0.4683861361518837
Energy: 0.4445828943156326
Energy: 0.4024743737730917
Energy: 0.44458289431476206
Energy: 0.4024743737730917
Energy: 0.44458289431345643
Energy: 0.4024743737730917
Energy: 0.4107157859397858
Energy: 0.5451370469645449
Energy: 0.41071578594065633
Energy: 0.5451370469645449
Energy: 0.4107157859393506
Energy: 0.5451370469641096
Energy: 0.4932409189679448
Energy: 0.4350524486981282
Energy: 0.4932409189679448
Energy: 0.43505244869856335
Energy: 0.49324091896925054
Energy: 0.43505244869856335
Energy: 0.45458134113678444
Energy: 0.43486495417527987
Energy: 0.45458134113721965
Energy: 0.43486495417527987
Energy: 0.45458134113765497
Energy: 0.4348649541757151
Energy: 0.4468541027033218
Energy: 0.48597123937813486
Energy: 0.44685410270462755
Energy: 0.48597123937857006
Energy: 0.44685410270462755
Energy: 0.48597123937769965
Energy: 0.466991571685176
Energy: 0.43700903278727565
Energy: 0.4669915716834351
Energy: 0.43700903278684033
Energy: 0.4669915716834351
Energy: 0.43700903278727565
Energy: 0.4164594593900265
Energy: 0.48444682270010025
Energy: 0.41645945939089707
Energy: 0.48444682269835937
Energy: 0.4164594593913322
Energy: 0.4624555756392836
Energy: 0.4535123108412149
Energy: 0.46075132812276504
Energy: 0.4535123108403445
Energy: 0.4607513281232003
Energy: 0.45351231084077964
Energy: 0.46075132812276504
Energy: 0.4709343570211306
Energy: 0.4603892683655533
Energy: 0.47093435702026015
Energy: 0.460389268365118
Energy: 0.4709343570198249
Energy: 0.460389268365118
Energy: 0.4594167724411743
Energy: 0.4641044711794823
Energy: 0.45941677244073903
Energy: 0.4641044711794823
Energy: 0.4594167724411743
Energy: 0.4641044711786118
Energy: 0.45287088014921323
Energy: 0.3998209179795517
Energy: 0.45287088014921323
Energy: 0.3998209179795517
Energy: 0.4528708801479075
Energy: 0.3998209179795517
Energy: 0.459412314550508
Energy: 0.46364615017178584
Energy: 0.459412314550508
Energy: 0.46364615017178584
Energy: 0.4594123145509433
Energy: 0.46364615016438676
Energy: 0.4708004323432493
Energy: 0.4601493912489114
Energy: 0.47080043234455504
Energy: 0.46014939124847615
Energy: 0.47080043234020263
Energy: 0.46014939124804094
Energy: 0.4532279920867517
Energy: 0.46043367430897325
Energy: 0.4532279920854856
Energy: 0.46043367430940846
Energy: 0.4532279920867517
Energy: 0.46043367430897325
Energy: 0.4166296844680659
Energy: 0.49942624991700324
Energy: 0.41662968446719545
Energy: 0.4994262499187443
Energy: 0.4166296844680659
Energy: 0.49942624991743856
Energy: 0.46700116534719827
Energy: 0.43702453758003773
Energy: 0.46700116534589253
Energy: 0.43702453758134346
Energy: 0.4670011653476336
Energy: 0.43702453758173915
Energy: 0.4468714824661008
Energy: 0.4860919566789822
Energy: 0.4468714824634894
Energy: 0.486091956678547
Energy: 0.4468714824652304
Energy: 0.486091956678547
Energy: 0.4549187615916083
Energy: 0.43476354003557827
Energy: 0.45491876159247896
Energy: 0.4347635400360135
Energy: 0.45491876159247896
Energy: 0.43476354003557827
Energy: 0.4929996660913029
Energy: 0.43514534574566655
Energy: 0.4929996660917381
Energy: 0.4351453457452313
Energy: 0.4929996660921734
Energy: 0.43514534574566655
Energy: 0.41085472771626885
Energy: 0.5452783949382974
Energy: 0.4108547277171394
Energy: 0.5452783949382974
Energy: 0.41085472771670417
Energy: 0.5452783949382974
Energy: 0.4441326860622961
Energy: 0.402453263933026
Energy: 0.44413268606055517
Energy: 0.402453263933026
Energy: 0.44413268606447226
Energy: 0.402453263933026
Energy: 0.4566786780426148
Energy: 0.4682848274134692
Energy: 0.45667867804305007
Energy: 0.46828482741433974
Energy: 0.45667867804305007
Energy: 0.4682848274125987
Energy: 0.4527821459065712
Energy: 0.495266785263065
Energy: 0.45278214590613586
Energy: 0.49526678526219453
Energy: 0.45278214591048827
Energy: 0.4952667852613241
Energy: 0.4451101783715213
Energy: 0.44761469032189105
Energy: 0.44511017837369743
Energy: 0.4476146903214559
Energy: 0.4451101783719565
Energy: 0.44761469032232637
Energy: 0.46761575025645324
Energy: 0.42845580684085044
Energy: 0.4676157502568885
Energy: 0.42845580684085044
Energy: 0.4676157502568885
Energy: 0.42845580684085044
Energy: 0.49829300656905096
Energy: 0.42434267128975334
Energy: 0.4982930065699214
Energy: 0.42434267129018866
Energy: 0.49829300656905096
Energy: 0.42434267128975334
Energy: 0.4120222854350243
Energy: 0.4761740414700723
Energy: 0.4120222854311071
Energy: 0.4761740414700723
Energy: 0.4120222854350243
Energy: 0.47617404147050746
Energy: 0.45999424510312653
Energy: 0.4636031102020452
Energy: 0.4599942450992094
Energy: 0.4636031102024805
Energy: 0.459994245103997
Energy: 0.4636031102024805
Energy: 0.4453058752377503
Energy: 0.42340629458516
Energy: 0.4453058752386207
Energy: 0.42340629458516
Energy: 0.4453058752386207
Energy: 0.42340629458559514
Energy: 0.4831254342214773
Energy: 0.43664420862184317
Energy: 0.48312543422278303
Energy: 0.43664420862184317
Energy: 0.48312543422104204
Energy: 0.43664420862184317
Energy: 0.44526352060550906
Energy: 0.4277711710595228
Energy: 0.44526352060550906
Energy: 0.4277711710595228
Energy: 0.44526352060507385
Energy: 0.42777117105995804
Energy: 0.4601348705697599
Energy: 0.4635344645679919
Energy: 0.4601348705710656
Energy: 0.4635344645675567
Energy: 0.46013487057019514
Energy: 0.4635344645679919
Energy: 0.41204740155951153
Energy: 0.46644353994303106
Energy: 0.412047401558641
Energy: 0.46644353994303106
Energy: 0.412047401558641
Energy: 0.46644353994303106
Energy: 0.49857107199635636
Energy: 0.42441518350284746
Energy: 0.4985710719937449
Energy: 0.4244151835041532
Energy: 0.49857107199548595
Energy: 0.42441518350371793

minimum gb energy = 0.3998209179795517 eV
minimum distance =  2.29074880379566 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.4165230275140706
Energy: 0.40702401533658344
Energy: 0.4165230275140706
Energy: 0.4070240153351661
Energy: 0.4165230275133619
Energy: 0.4070240153358748
Energy: 0.456775804012964
Energy: 0.40174411218690004
Energy: 0.4567758040136727
Energy: 0.40174411218690004
Energy: 0.456775804012964
Energy: 0.40174411218690004
Energy: 0.4574978517022855
Energy: 0.43334140927312864
Energy: 0.45749785170299423
Energy: 0.43334140927312864
Energy: 0.45749785170299423
Energy: 0.43334140927312864
Energy: 0.3896977059934822
Energy: 0.447185410520715
Energy: 0.3896977059934822
Energy: 0.447185410520715
Energy: 0.38969770599277354
Energy: 0.44718541052142374
Energy: 0.45971950428220587
Energy: 0.37710159929997356
Energy: 0.45971950428220587
Energy: 0.37710159930068227
Energy: 0.45971950428220587
Energy: 0.37710159930068227
Energy: 0.4441642661142558
Energy: 0.4026855902835337
Energy: 0.4441642661142558
Energy: 0.4026855902835337
Energy: 0.4441642661142558
Energy: 0.40268559028282497
Energy: 0.5151317389479712
Energy: 0.4310285824654903
Energy: 0.5151317389444278
Energy: 0.4310285824654903
Energy: 0.5151317389472625
Energy: 0.4310285824654903
Energy: 0.5016195018191434
Energy: 0.419141092273473
Energy: 0.5016195018184346
Energy: 0.41914109227205576
Energy: 0.5016195018191434
Energy: 0.4191410922713471
Energy: 0.4055596196412715
Energy: 0.40350018919041575
Energy: 0.4055596196412715
Energy: 0.40350018919041575
Energy: 0.40555961963985426
Energy: 0.4035001891897071
Energy: 0.4130178982040116
Energy: 0.4138157694176076
Energy: 0.413017898203303
Energy: 0.4138157694176076
Energy: 0.4130178982040116
Energy: 0.4138157694176076
Energy: 0.49554920031369704
Energy: 0.5074239285800828
Energy: 0.49554920031369704
Energy: 0.5074239285800828
Energy: 0.49554920031298844
Energy: 0.5074239285800828
Energy: 0.42239071276607604
Energy: 0.38608163736484996
Energy: 0.42239071276607604
Energy: 0.38608163736484996
Energy: 0.42239071276607604
Energy: 0.38608163736484996
Energy: 0.41138120036679454
Energy: 0.4359742707290227
Energy: 0.4113812003660859
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Energy: 0.4113812003660859
Energy: 0.43597427072831396
Energy: 0.38930384045293726
Energy: 0.47588125850240304
Energy: 0.38930384045222854
Energy: 0.47588125850169444
Energy: 0.38930384045293726
Energy: 0.47588125850169444
Energy: 0.4534175035022791
Energy: 0.4085536555165664
Energy: 0.4534175035022791
Energy: 0.40855365552081846
Energy: 0.45341750350086174
Energy: 0.40855365552152717
Energy: 0.4104785996004996
Energy: 0.45263145120559606
Energy: 0.4104785996004996
Energy: 0.45263145120559606
Energy: 0.4104785995997908
Energy: 0.45263145120559606
Energy: 0.42196939340395156
Energy: 0.46028244194923923
Energy: 0.42196939340324285
Energy: 0.46028244194994783
Energy: 0.42196939340395156
Energy: 0.46028244194994783
Energy: 0.43530942487915614
Energy: 0.41261441319145614
Energy: 0.43530942488057345
Energy: 0.4126144131907475
Energy: 0.43530942487915614
Energy: 0.4126144131900388
Energy: 0.396345203145146
Energy: 0.48091813414046947
Energy: 0.396345203145146
Energy: 0.48091813414046947
Energy: 0.39634520314443733
Energy: 0.48091813414046947
Energy: 0.3993206334006162
Energy: 0.44128360526914373
Energy: 0.3993206334013249
Energy: 0.4412836052698524
Energy: 0.3993206334013249
Energy: 0.44128360526914373
Energy: 0.4418942926572783
Energy: 0.42734020889450897
Energy: 0.4418942926586956
Energy: 0.42734020889450897
Energy: 0.4418942926551523
Energy: 0.4273402088952176
Energy: 0.3915850775490353
Energy: 0.4841112791976453
Energy: 0.3915850775483266
Energy: 0.4841112791976453
Energy: 0.3915850775490353
Energy: 0.4841112791976453
Energy: 0.4233886340411014
Energy: 0.42321847443561533
Energy: 0.42338863404181
Energy: 0.42321847443490673
Energy: 0.4233886340411014
Energy: 0.42321847443490673
Energy: 0.4248396926936763
Energy: 0.48382436276891483
Energy: 0.4248396926936763
Energy: 0.4838243627674975
Energy: 0.4248396926936763
Energy: 0.4838243627682061
Energy: 0.4278330314661758
Energy: 0.5162056443576641
Energy: 0.4278330314661758
Energy: 0.5162056443583729
Energy: 0.4278330314690104
Energy: 0.5162056443583729
Energy: 0.40895545124826466
Energy: 0.4223163459611421
Energy: 0.40895545124755595
Energy: 0.4223163459611421
Energy: 0.40895545124755595
Energy: 0.4223163459611421
Energy: 0.38872014275677697
Energy: 0.4808383890921038
Energy: 0.38872014275677697
Energy: 0.48083838909281246
Energy: 0.38872014275677697
Energy: 0.48083838909281246

minimum gb energy = 0.37710159929997356 eV
minimum distance =  2.24965313759332 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.38957001272764946
Energy: 0.36522289748899905
Energy: 0.38957001272764946
Energy: 0.36522289748899905
Energy: 0.38957001272764946
Energy: 0.36522289748899905
Energy: 0.398687887368816
Energy: 0.3704958456292187
Energy: 0.398687887368816
Energy: 0.3704958456292187
Energy: 0.3986878873698486
Energy: 0.3704958456287024
Energy: 0.4160377856963154
Energy: 0.37348065121331914
Energy: 0.4160377856957991
Energy: 0.37348065121331914
Energy: 0.4160377856963154
Energy: 0.3734806512138355
Energy: 0.37655969419509167
Energy: 0.38231124956228707
Energy: 0.37655969419509167
Energy: 0.3823112495617707
Energy: 0.3765596941966407
Energy: 0.3823112495617707
Energy: 0.3986648925636585
Energy: 0.35318702670771734
Energy: 0.39866489256262577
Energy: 0.35318702670771734
Energy: 0.3986648925615931
Energy: 0.35318702670771734
Energy: 0.37592186628587065
Energy: 0.35929040481635965
Energy: 0.37592186628587065
Energy: 0.35929040481635965
Energy: 0.3759218662853544
Energy: 0.35929040481635965
Energy: 0.4386546160969344
Energy: 0.37644298300860346
Energy: 0.4386546160969344
Energy: 0.37644298300860346
Energy: 0.4386546160969344
Energy: 0.3764429830080872
Energy: 0.40004823435820475
Energy: 0.34752088939200676
Energy: 0.4000482343587211
Energy: 0.34752088939303943
Energy: 0.40004823435820475
Energy: 0.34752088939200676
Energy: 0.36173371121431086
Energy: 0.3543828103586712
Energy: 0.36173371121384146
Energy: 0.35438281035815494
Energy: 0.36173371121431086
Energy: 0.3543828103586712
Energy: 0.40021379015135594
Energy: 0.35971074879706166
Energy: 0.40021379015135594
Energy: 0.35971074879757803
Energy: 0.4002137901508397
Energy: 0.35971074879706166
Energy: 0.43204612975047657
Energy: 0.42643003485634606
Energy: 0.43204612974996026
Energy: 0.4264300348568624
Energy: 0.43204612974996026
Energy: 0.42643003485634606
Energy: 0.3431097706497932
Energy: 0.35561834843614615
Energy: 0.3431097706497932
Energy: 0.3556183484356298
Energy: 0.3431097706497932
Energy: 0.3556183484356298
Energy: 0.3996396226779819
Energy: 0.3420893598773609
Energy: 0.3996396226779819
Energy: 0.3420893598773609
Energy: 0.39963962267849823
Energy: 0.3420893598778772
Energy: 0.42991358588317935
Energy: 0.4276350214081183
Energy: 0.42991358588317935
Energy: 0.4276350214081183
Energy: 0.42991358588317935
Energy: 0.4276350214081183
Energy: 0.355169379575228
Energy: 0.35620043923548006
Energy: 0.3551693795747117
Energy: 0.35620043923496375
Energy: 0.3551693795757444
Energy: 0.35620043923548006
Energy: 0.3759176242810362
Energy: 0.38925879720696227
Energy: 0.3759176242831015
Energy: 0.38925879720696227
Energy: 0.3759176242831015
Energy: 0.38925879720696227
Energy: 0.43737024328523316
Energy: 0.4260356842083527
Energy: 0.4373702432857496
Energy: 0.4260356842083527
Energy: 0.43737024328471685
Energy: 0.4260356842083527
Energy: 0.3666108576886394
Energy: 0.3538523396652471
Energy: 0.3666108576886394
Energy: 0.3538523396657634
Energy: 0.3666108576891557
Energy: 0.3538523396714432
Energy: 0.3440107167449552
Energy: 0.3929849205260925
Energy: 0.3440107167439225
Energy: 0.3929849205260925
Energy: 0.3440107167439225
Energy: 0.3929849205260925
Energy: 0.3744082276993117
Energy: 0.38865116703675345
Energy: 0.37440822769879534
Energy: 0.38865116703675345
Energy: 0.37440822769879534
Energy: 0.3886511670362371
Energy: 0.39415982627728263
Energy: 0.3708617269061797
Energy: 0.39415982627728263
Energy: 0.3708617269061797
Energy: 0.39415982627728263
Energy: 0.3708617269061797
Energy: 0.3720889557223101
Energy: 0.39546333659960237
Energy: 0.3720889557223101
Energy: 0.39546333659960237
Energy: 0.37208895572282635
Energy: 0.39546333659960237
Energy: 0.37349972080610805
Energy: 0.39502108099794503
Energy: 0.37349972080610805
Energy: 0.39502108099794503
Energy: 0.37349972080610805
Energy: 0.39502108099794503
Energy: 0.4134168540691902
Energy: 0.3620435321778433
Energy: 0.4134168540691902
Energy: 0.3620435321778433
Energy: 0.4134168540691902
Energy: 0.3620435321778433
Energy: 0.34297789002059276
Energy: 0.3872654985347203
Energy: 0.34297789002059276
Energy: 0.3872654985347203
Energy: 0.342977890021109
Energy: 0.38726549853420394
Energy: 0.3505777345962674
Energy: 0.3810707612752997
Energy: 0.35057773459575114
Energy: 0.3810707612752997
Energy: 0.3505777345962674
Energy: 0.3810707612752997
Energy: 0.37454631301778013
Energy: 0.3504147848761041
Energy: 0.3745463130172638
Energy: 0.3504147848761041
Energy: 0.3745463130172638
Energy: 0.3504147848755878
Energy: 0.3383696402404189
Energy: 0.38477379221672176
Energy: 0.3383696402404189
Energy: 0.38477379221672176
Energy: 0.33836964023990257
Energy: 0.38477379221672176
Energy: 0.35053779273042146
Energy: 0.3599756092424753
Energy: 0.35053779272990515
Energy: 0.3599756092424753
Energy: 0.3505377927293888
Energy: 0.3599756092424753
Energy: 0.3519592107317507
Energy: 0.3855130451187673
Energy: 0.3519592107327834
Energy: 0.3855130451192837
Energy: 0.3519592107322671
Energy: 0.38551304511825096
Energy: 0.3638151567758453
Energy: 0.38631866422116734
Energy: 0.3458395595687651
Energy: 0.3863186642201346
Energy: 0.34583955956824886
Energy: 0.3863186642206509
Energy: 0.35086030493712744
Energy: 0.34797865126230343
Energy: 0.35086030493712744
Energy: 0.34797865126230343
Energy: 0.35086030493764375
Energy: 0.34797865126230343
Energy: 0.3410144319372284
Energy: 0.38697910637620786
Energy: 0.34101443193671205
Energy: 0.38697910637620786
Energy: 0.34101443193619574
Energy: 0.3869791063767242
Energy: 0.4322200166007983
Energy: 0.3877949203923895
Energy: 0.4322200166007983
Energy: 0.3877949203923895
Energy: 0.4322200166007983
Energy: 0.3877949203929058
Energy: 0.3644274114376329
Energy: 0.33752211435085716
Energy: 0.36442741143660023
Energy: 0.33752211435085716
Energy: 0.3644274114376329
Energy: 0.33752211435085716
Energy: 0.3163572459493023
Energy: 0.38585934526872784
Energy: 0.31635724594826964
Energy: 0.38585934526872784
Energy: 0.3163572459493023
Energy: 0.38585934526872784

minimum gb energy = 0.31635724594826964 eV
minimum distance =  2.23934383860116 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.19296362745858364
Energy: 0.21100821065404043
Energy: 0.03167325798061582
Energy: 0.21100821065384637
Energy: 0.19296362745858364
Energy: 0.21100821065498898
Energy: 0.45516536921095435
Energy: 0.03242372819804419
Energy: 0.4551653692111269
Energy: 0.03242372819709561
Energy: 0.4551653692111269
Energy: 0.032423728197850166
Energy: 0.21097276118882735
Energy: 0.0324217079739787
Energy: 0.21097276118921537
Energy: 0.0324217079739787
Energy: 0.21097276118902136
Energy: 0.03242170797378467
Energy: 0.03167325798078829
Energy: 0.21100821065384637
Energy: 0.03167325798078829
Energy: 0.21100821065404043
Energy: 0.03167325798061582
Energy: 0.211008210654795
Energy: 0.4551653692107604
Energy: 0.03242372819672911
Energy: 0.4551653692117089
Energy: 0.03242372819728964
Energy: 0.45516536921095435
Energy: 0.03242372819709561
Energy: 0.21097276119035802
Energy: 0.03242170797359065
Energy: 0.21097276119053046
Energy: 0.03242170797359065
Energy: 0.21097276119053046
Energy: 0.03242170797453922
Energy: 0.19296362745916573
Energy: 0.21100821065537703
Energy: 0.03167325798078829
Energy: 0.21100821065554953
Energy: 0.19296362745916573
Energy: 0.21100821065613162
Energy: 0.45516536921056633
Energy: 0.03242372819804419
Energy: 0.45516536921151485
Energy: 0.032423728198626274
Energy: 0.4551653692107604
Energy: 0.032423728198626274
Energy: 0.21097276119186711
Energy: 0.03242170797208154
Energy: 0.21097276119016395
Energy: 0.03242170797208154
Energy: 0.21097276119130656
Energy: 0.032421707973030116
Energy: 0.03167325798078829
Energy: 0.21100821065537703
Energy: 0.03167325798078829
Energy: 0.21100821065518305
Energy: 0.03167325798061582
Energy: 0.21100821065593758

minimum gb energy = 0.03167325798061582 eV
minimum distance =  2.40276827541655 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.382262690203871
Energy: 0.3236858235205192
Energy: 0.3822626902033032
Energy: 0.3236858235205192
Energy: 0.3822626902044387
Energy: 0.3236858235205192
Energy: 0.3314029248283365
Energy: 0.33261071804845976
Energy: 0.33140292482890427
Energy: 0.33261071804789205
Energy: 0.33140292482890427
Energy: 0.33261071804789205
Energy: 0.33883436188403154
Energy: 0.33310672180644496
Energy: 0.33883436188459926
Energy: 0.3331067218070127
Energy: 0.33883436188403154
Energy: 0.33310672180644496
Energy: 0.3377674852570764
Energy: 0.3359874698671715
Energy: 0.3377674852565086
Energy: 0.3359874698671715
Energy: 0.3377674852565086
Energy: 0.3359874698671715
Energy: 0.2921443597915153
Energy: 0.34198202154006113
Energy: 0.2921443597915153
Energy: 0.34198202154006113
Energy: 0.2921443597915153
Energy: 0.34198202154006113
Energy: 0.3403303734923304
Energy: 0.34005103833993255
Energy: 0.3403303734923304
Energy: 0.34005103833993255
Energy: 0.3403303734923304
Energy: 0.34005103833993255
Energy: 0.3402210271324716
Energy: 0.3337283140923684
Energy: 0.3402210271324716
Energy: 0.3337283140923684
Energy: 0.3402210271324716
Energy: 0.33372831409293613
Energy: 0.292217291392973
Energy: 0.341086125360055
Energy: 0.292217291392973
Energy: 0.341086125360055
Energy: 0.292217291392973
Energy: 0.341086125360055
Energy: 0.3453674942607476
Energy: 0.3424725467375405
Energy: 0.3453674942601799
Energy: 0.3424725467375405
Energy: 0.3453674942613153
Energy: 0.34247254673697286
Energy: 0.3376521883831838
Energy: 0.31253313983461406
Energy: 0.3376521883831838
Energy: 0.31253313983631725
Energy: 0.3376521883837515
Energy: 0.3125331398351818
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Energy: 0.3348578024087149
Energy: 0.3105392428473998
Energy: 0.33485780240814716
Energy: 0.3105392428473998
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Energy: 0.3540418754944984
Energy: 0.3583736373162943
Energy: 0.3540418754939307
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Energy: 0.341477230997656
Energy: 0.2947507795017593
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Energy: 0.2947507795017593
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Energy: 0.322704544900693
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Energy: 0.3227045448995576
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Energy: 0.3384176338047882
Energy: 0.3484184226374037
Energy: 0.3384176338047882
Energy: 0.3484184226374037
Energy: 0.33841763380422046
Energy: 0.3484184226374037
Energy: 0.34182347152265175
Energy: 0.2904883217042892
Energy: 0.341823471522084
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Energy: 0.3369400201322885
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Energy: 0.3369400201322885
Energy: 0.3419341050306545
Energy: 0.325966136845231
Energy: 0.3419341050306545
Energy: 0.3259661368457987
Energy: 0.34193410503122224
Energy: 0.3259661368457987
Energy: 0.3325679371293555
Energy: 0.38503620965921653
Energy: 0.3325679371293555
Energy: 0.38503620965808105
Energy: 0.3325679371287878
Energy: 0.3850362096586488
Energy: 0.35936391435278614
Energy: 0.3331781767845818
Energy: 0.35936391435278614
Energy: 0.3331781767845818
Energy: 0.35936391435278614
Energy: 0.3331781767845818
Energy: 0.34493093759707955
Energy: 0.3283942717021411
Energy: 0.3449309375965118
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Energy: 0.33899346212839765
Energy: 0.3378882801041128
Energy: 0.33899346212782994
Energy: 0.3378882801041128
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Energy: 0.3434269825803022
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Energy: 0.3434269825797344
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Energy: 0.34254697263822037
Energy: 0.3407749784055887
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Energy: 0.34077497840502097
Energy: 0.34254697263822037
Energy: 0.3407749784055887
Energy: 0.33161793594282696
Energy: 0.34338310422961915
Energy: 0.3316179359433947
Energy: 0.34338310422961915
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Energy: 0.38125532994973366
Energy: 0.292809053704983
Energy: 0.38125532994916594
Energy: 0.2928090537055507
Energy: 0.38125532994916594
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Energy: 0.33906448481186424
Energy: 0.3477475833201845
Energy: 0.33906448481186424
Energy: 0.3477475833201845
Energy: 0.3390644848112965
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Energy: 0.3219686727030746
Energy: 0.3417460223353493
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Energy: 0.3417460223353493
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Energy: 0.382239524329245
Energy: 0.31198167372157204
Energy: 0.382239524329245
Energy: 0.31198167372213975
Energy: 0.38223952432981273
Energy: 0.31198167372157204
Energy: 0.34354709942456646
Energy: 0.3454889521535635
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Energy: 0.34354709942399875
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Energy: 0.3078638272364327
Energy: 0.33950003337017515
Energy: 0.30786382723700045
Energy: 0.33950003336960743
Energy: 0.30786382723700045
Energy: 0.33950003337017515
Energy: 0.34562386626040326
Energy: 0.3391417758266929
Energy: 0.34562386626097097
Energy: 0.3391417758261252
Energy: 0.34562386626040326
Energy: 0.3391417758266929

minimum gb energy = 0.2904883217042892 eV
minimum distance =  2.28879042819037 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.4562522652397674
Energy: 0.41720770251951866
Energy: 0.4562522652397674
Energy: 0.41720770251951866
Energy: 0.4562522652397674
Energy: 0.41720770251951866
Energy: 0.41376247992638254
Energy: 0.44868500928867927
Energy: 0.41376247992638254
Energy: 0.44868500928867927
Energy: 0.41376247992638254
Energy: 0.44868500928867927
Energy: 0.43414819024111345
Energy: 0.43080637796967386
Energy: 0.4341481902403045
Energy: 0.4308063779688649
Energy: 0.43414819024111345
Energy: 0.4308063779688649
Energy: 0.4402995080073802
Energy: 0.422235857460891
Energy: 0.4402995080081892
Energy: 0.422235857460891
Energy: 0.4402995080073802
Energy: 0.422235857460891
Energy: 0.3739441201879129
Energy: 0.4051263729883851
Energy: 0.3739441201879129
Energy: 0.405126372989194
Energy: 0.3739441201879129
Energy: 0.4051263729883851
Energy: 0.4334439832546837
Energy: 0.4269198535029316
Energy: 0.4334439832546837
Energy: 0.4269198535029316
Energy: 0.4334439832546837
Energy: 0.4269198535029316
Energy: 0.40801770423482925
Energy: 0.40455626796673894
Energy: 0.40801770423482925
Energy: 0.40455626796673894
Energy: 0.40801770423482925
Energy: 0.40455626796673894
Energy: 0.41089315001291477
Energy: 0.4049986116231192
Energy: 0.41089315001372373
Energy: 0.40499861162231016
Energy: 0.4108931500121058
Energy: 0.4049986116231192
Energy: 0.44571781450955533
Energy: 0.4513457019621299
Energy: 0.44571781450955533
Energy: 0.4513457019621299
Energy: 0.44571781451036435
Energy: 0.45134570196132096
Energy: 0.4222916924994834
Energy: 0.38149529697175805
Energy: 0.4222916924986745
Energy: 0.38149529697175805
Energy: 0.4222916924994834
Energy: 0.38149529697175805
Energy: 0.43603909357231696
Energy: 0.4317019604442786
Energy: 0.43603909357231696
Energy: 0.43170196044346965
Energy: 0.43603909357231696
Energy: 0.4317019604442786
Energy: 0.40969474005816564
Energy: 0.43010574503014193
Energy: 0.4096947400573567
Energy: 0.43010574503014193
Energy: 0.40969474005816564
Energy: 0.43010574503014193
Energy: 0.4214831300331003
Energy: 0.40903364811008724
Energy: 0.4214831300331003
Energy: 0.40903364811008724
Energy: 0.4214831300331003
Energy: 0.4090336481092783
Energy: 0.4124866601478072
Energy: 0.4358505836416897
Energy: 0.41248666014699825
Energy: 0.4358505836408808
Energy: 0.4124866601478072
Energy: 0.4358505836408808
Energy: 0.4154341822218606
Energy: 0.4116974239060356
Energy: 0.4154341822226696
Energy: 0.4116974239060356
Energy: 0.4154341822226696
Energy: 0.4116974239060356
Energy: 0.4379110238631784
Energy: 0.41824665172837866
Energy: 0.4379110238631784
Energy: 0.41824665172837866
Energy: 0.4379110238631784
Energy: 0.41824665172837866
Energy: 0.42691252693742293
Energy: 0.434038267612484
Energy: 0.42691252693742293
Energy: 0.434038267612484
Energy: 0.42691252693742293
Energy: 0.434038267612484
Energy: 0.42761705514769693
Energy: 0.40428606302448167
Energy: 0.42761705514769693
Energy: 0.40428606302529063
Energy: 0.4276170551485059
Energy: 0.40428606302529063
Energy: 0.4249977962967998
Energy: 0.4364096776702806
Energy: 0.4249977962959908
Energy: 0.4364096776702806
Energy: 0.42499779629518186
Energy: 0.4364096776702806
Energy: 0.37566538009463235
Energy: 0.431626882934011
Energy: 0.37566538009463235
Energy: 0.43162688293482
Energy: 0.37566538009463235
Energy: 0.43162688293482
Energy: 0.44700998411344367
Energy: 0.40703097899637003
Energy: 0.44700998411344367
Energy: 0.407030978997179
Energy: 0.44700998411344367
Energy: 0.40703097899637003
Energy: 0.44328012178169923
Energy: 0.4534772243264637
Energy: 0.44328012178089027
Energy: 0.4534772243264637
Energy: 0.44328012178089027
Energy: 0.45347722432727267
Energy: 0.37675255219921405
Energy: 0.43160534072992507
Energy: 0.37675255219921405
Energy: 0.43160534072992507
Energy: 0.37675255219921405
Energy: 0.4316053407291161

minimum gb energy = 0.3739441201879129 eV
minimum distance =  2.2982512343429 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.5047296062188443
Energy: 0.4607991649168466
Energy: 0.5047296062193574
Energy: 0.4607991649168466
Energy: 0.5047296062188443
Energy: 0.4607991649163334
Energy: 0.46231676650586906
Energy: 0.47711473283140055
Energy: 0.46231676650638226
Energy: 0.47711473283191386
Energy: 0.46231676650638226
Energy: 0.47711473283191386
Energy: 0.48979819220572274
Energy: 0.477067729596748
Energy: 0.4897981922052096
Energy: 0.477067729596748
Energy: 0.48979819220572274
Energy: 0.4770677295972611
Energy: 0.4887840733665548
Energy: 0.4736839281353807
Energy: 0.488784073367068
Energy: 0.4736839281353807
Energy: 0.4887840733665548
Energy: 0.4736839281353807
Energy: 0.46438346925840485
Energy: 0.47170464762401115
Energy: 0.46438346925789176
Energy: 0.4717046476234979
Energy: 0.46438346925737856
Energy: 0.4717046476234979
Energy: 0.5182753220219508
Energy: 0.5101652329522258
Energy: 0.5182753220219508
Energy: 0.5101652329522258
Energy: 0.5182753220224642
Energy: 0.5101652329522258
Energy: 0.4638311932389985
Energy: 0.4509286669447324
Energy: 0.4638311932384854
Energy: 0.4509286669447324
Energy: 0.46383119323694577
Energy: 0.4509286669447324
Energy: 0.4872664655396559
Energy: 0.4858527920933293
Energy: 0.4872664655391428
Energy: 0.4858527920933293
Energy: 0.4872664655401691
Energy: 0.4858527920928161
Energy: 0.4735960902479103
Energy: 0.49167162773437223
Energy: 0.4735960902489366
Energy: 0.49167162773385903
Energy: 0.4735960902484235
Energy: 0.49167162773437223
Energy: 0.5007754817619898
Energy: 0.47672074756178556
Energy: 0.5007754817614767
Energy: 0.45153384671784375
Energy: 0.5007754817604502
Energy: 0.47708158732338113
Energy: 0.4886991346255385
Energy: 0.48100299470106284
Energy: 0.48869913462451214
Energy: 0.48100299470106284
Energy: 0.4886991346255385
Energy: 0.48100299470106284
Energy: 0.46535746447751114
Energy: 0.4655915391553428
Energy: 0.46535746447802423
Energy: 0.4655915391553428
Energy: 0.46535746447853754
Energy: 0.4655915391553428
Energy: 0.5014062043003829
Energy: 0.46517372173098387
Energy: 0.5014062043003829
Energy: 0.46517372173098387
Energy: 0.501406204300896
Energy: 0.46517372173098387
Energy: 0.46585479239262356
Energy: 0.47905857410804237
Energy: 0.4658547923921104
Energy: 0.47905857410804237
Energy: 0.46585479239262356
Energy: 0.47905857410804237
Energy: 0.48116901802668177
Energy: 0.47113936841430615
Energy: 0.48116901802668177
Energy: 0.47113936841430615
Energy: 0.48116901802719503
Energy: 0.47113936841430615
Energy: 0.48822078668503166
Energy: 0.49049712352451463
Energy: 0.48822078668503166
Energy: 0.49049712352451463
Energy: 0.48822078668503166
Energy: 0.49049712352451463
Energy: 0.43443864994568476
Energy: 0.47768407938319773
Energy: 0.4344386499492771
Energy: 0.47768407938319773
Energy: 0.4344386499492771
Energy: 0.47768407938319773
Energy: 0.5028038797426617
Energy: 0.5080499940467794
Energy: 0.5028038797426617
Energy: 0.5080499940467794
Energy: 0.5028038797426617
Energy: 0.5080499940462662
Energy: 0.4638101255488816
Energy: 0.4942132433363155
Energy: 0.4638101255483684
Energy: 0.4942132433363155
Energy: 0.4638101255488816
Energy: 0.4942132433363155
Energy: 0.4654855400066928
Energy: 0.4784293499001363
Energy: 0.46548554000617953
Energy: 0.4784293499006494
Energy: 0.4654855400066928
Energy: 0.4784293499006494
Energy: 0.48687994165668325
Energy: 0.48957970776429627
Energy: 0.4868799416571964
Energy: 0.48957970776378307
Energy: 0.4868799416577096
Energy: 0.48957970776429627
Energy: 0.4764961456814773
Energy: 0.45712935233139373
Energy: 0.4764961456830169
Energy: 0.45712935233139373
Energy: 0.4764961456825037
Energy: 0.45712935233139373
Energy: 0.4833296852835168
Energy: 0.48093344432398016
Energy: 0.48332968528300346
Energy: 0.48093344432398016
Energy: 0.48332968528300346
Energy: 0.48093344432398016
Energy: 0.4992227929767546
Energy: 0.462940581388666
Energy: 0.49922279297624145
Energy: 0.462940581388666
Energy: 0.49922279297624145
Energy: 0.462940581388666
Energy: 0.46271732271960786
Energy: 0.4630733923665915
Energy: 0.46271732271960786
Energy: 0.4630733923665915
Energy: 0.46271732271909455
Energy: 0.4630733923665915
Energy: 0.4814907454907913
Energy: 0.48488482943902267
Energy: 0.48149074549027804
Energy: 0.48488482943902267
Energy: 0.4814907454892517
Energy: 0.48488482943902267
Energy: 0.46347158211271955
Energy: 0.45625615959278876
Energy: 0.4634715821132327
Energy: 0.45625615959278876
Energy: 0.46347158211118
Energy: 0.45625615959330196
Energy: 0.4893544794626579
Energy: 0.5152037967376446
Energy: 0.48935447946317107
Energy: 0.5152037967381577
Energy: 0.48935447946368427
Energy: 0.5395208377986768
Energy: 0.46180322074677604
Energy: 0.4777568664739626
Energy: 0.46180322074728924
Energy: 0.4777568664734494
Energy: 0.46180322074728924
Energy: 0.4777568664739626
Energy: 0.4594649820591599
Energy: 0.4540435182194268
Energy: 0.4594649820591599
Energy: 0.4540435182204065
Energy: 0.4594649820596731
Energy: 0.4540435182204065
Energy: 0.5165537675609103
Energy: 0.5077934991145918
Energy: 0.5165537675609103
Energy: 0.5077934991145918
Energy: 0.5165537675614236
Energy: 0.5077934991140787
Energy: 0.4428012117358228
Energy: 0.4778228054540057
Energy: 0.442801211730691
Energy: 0.4778228054540057
Energy: 0.44280121173377
Energy: 0.4778228054540057
Energy: 0.48982961481355053
Energy: 0.48874444478818696
Energy: 0.48982961481355053
Energy: 0.48874444478818696
Energy: 0.4898296148140637
Energy: 0.48874444478818696
Energy: 0.4787600924172179
Energy: 0.49280520250940374
Energy: 0.4787600924172179
Energy: 0.49280520250940374
Energy: 0.4787600924167047
Energy: 0.49280520250940374
Energy: 0.4627468478065025
Energy: 0.4775185971087655
Energy: 0.4627468478065025
Energy: 0.47751859710927863
Energy: 0.4627468478059893
Energy: 0.47751859710927863
Energy: 0.49905231710166104
Energy: 0.4626783576263544
Energy: 0.49905231710166104
Energy: 0.4626783576263544
Energy: 0.49905231710217424
Energy: 0.46267835762584125
Energy: 0.4641002547283386
Energy: 0.47185330443078377
Energy: 0.4641002547283386
Energy: 0.4718533044302705
Energy: 0.46410025472885175
Energy: 0.47185330443078377

minimum gb energy = 0.43443864994568476 eV
minimum distance =  2.27077242042006 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.5765340269641055
Energy: 0.5601821654550535
Energy: 0.5765340269627361
Energy: 0.5601821654550535
Energy: 0.5765340269641055
Energy: 0.5601821654550535
Energy: 0.5478804560582388
Energy: 0.5546667808757437
Energy: 0.5478804560582388
Energy: 0.5546667808757437
Energy: 0.5478804560582388
Energy: 0.5546667808757437
Energy: 0.6382365189913571
Energy: 0.5516548295084579
Energy: 0.6023821968517142
Energy: 0.5516548295084579
Energy: 0.6023821968517142
Energy: 0.5516548295084579
Energy: 0.5718000402887904
Energy: 0.5681999917500457
Energy: 0.5718000402887904
Energy: 0.5681999917500457
Energy: 0.5718000402887904
Energy: 0.5681999917500457
Energy: 0.5380087438446133
Energy: 0.567810154608937
Energy: 0.5380087438446133
Energy: 0.567810154608937
Energy: 0.5380087438460144
Energy: 0.567810154608937
Energy: 0.6192077863828599
Energy: 0.5933532379415837
Energy: 0.6192077863828599
Energy: 0.5933532379415837
Energy: 0.6192077863828599
Energy: 0.5933532379415837
Energy: 0.5701937373145067
Energy: 0.5290159086969137
Energy: 0.5701937373145067
Energy: 0.5290159086955126
Energy: 0.5701937373145067
Energy: 0.5290159086969137
Energy: 0.5770098898531322
Energy: 0.5552848384155391
Energy: 0.5770098898531322
Energy: 0.5552848384169402
Energy: 0.5770098898545334
Energy: 0.5552848384169402
Energy: 0.504850058559093
Energy: 0.5435858471693398
Energy: 0.504850058559093
Energy: 0.5435858471679386
Energy: 0.504850058559093
Energy: 0.5435858471693398
Energy: 0.5718728074804748
Energy: 0.5634159670694752
Energy: 0.5718728074804748
Energy: 0.5634159670694752
Energy: 0.5718728074804748
Energy: 0.5634159670694752
Energy: 0.5421728928788004
Energy: 0.5520617613251902
Energy: 0.5421728928773993
Energy: 0.5520617613251902
Energy: 0.5421728928773993
Energy: 0.5520617613251902
Energy: 0.5692350837881053
Energy: 0.5545135569613815
Energy: 0.5692350837881053
Energy: 0.5545135569627827
Energy: 0.5692350837881053
Energy: 0.5545135569613815
Energy: 0.5118066453392077
Energy: 0.5788259941847488
Energy: 0.5118066453392077
Energy: 0.57882599418615
Energy: 0.5118066453392077
Energy: 0.57882599418615
Energy: 0.5412462121096977
Energy: 0.5553699207343322
Energy: 0.5412462121096977
Energy: 0.5553699207343322
Energy: 0.5412462121096977
Energy: 0.5553699207343322

minimum gb energy = 0.504850058559093 eV
minimum distance =  2.25944869444145 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.6901763382360286
Energy: 0.659428530275292
Energy: 0.6901763382360286
Energy: 0.659428530275292
Energy: 0.6901763382360286
Energy: 0.659428530275292
Energy: 0.6057044872414872
Energy: 0.6270146921889124
Energy: 0.6057044872408717
Energy: 0.627014692188297
Energy: 0.6057044872408717
Energy: 0.627014692188297
Energy: 0.6453008632818297
Energy: 0.6318329755269539
Energy: 0.6453008632818297
Energy: 0.6318329755275695
Energy: 0.6453008632830608
Energy: 0.6318329755269539
Energy: 0.6349131782455978
Energy: 0.6054500098214286
Energy: 0.6349131782462133
Energy: 0.6054500098214286
Energy: 0.6349131782455978
Energy: 0.6054500098214286
Energy: 0.6460057635610531
Energy: 0.627193217016389
Energy: 0.6460057635616685
Energy: 0.627193217016389
Energy: 0.6460057635616685
Energy: 0.627193217016389
Energy: 0.6272914377446552
Energy: 0.6504091896287527
Energy: 0.6272914377452707
Energy: 0.6504091896293682
Energy: 0.6272914377446552
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Energy: 0.6328393266413949
Energy: 0.6226548114033269
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Energy: 0.6226548114039425
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Energy: 0.6226548114033269
Energy: 0.6282820584610703
Energy: 0.6398352678094208
Energy: 0.6282820584616858
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Energy: 0.6282820584610703
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Energy: 0.6391306192169174
Energy: 0.632095553341813
Energy: 0.6391306192169174
Energy: 0.632095553341813
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Energy: 0.6277957555933537
Energy: 0.6384741222919581
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Energy: 0.6277957555939692
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Energy: 0.611232381930555
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Energy: 0.611232381930555
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Energy: 0.6400575511091791
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Energy: 0.6275090685008687
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Energy: 0.622823006986289
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Energy: 0.6590262532201525
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Energy: 0.6318939090473296
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Energy: 0.6264984907374898
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Energy: 0.6518693414143367
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Energy: 0.6283393768762146
Energy: 0.6323496056697901
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Energy: 0.6323496056697901
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Energy: 0.6178288663066452
Energy: 0.626728127955471
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Energy: 0.6178288663060296
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Energy: 0.6219766023589276
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Energy: 0.6219766023589276
Energy: 0.6571852973208407
Energy: 0.6396242696249036
Energy: 0.6236765666717463
Energy: 0.6396242696255192
Energy: 0.6236765666717463
Energy: 0.6396242696249036
Energy: 0.6236765666717463
Energy: 0.6355997194992867
Energy: 0.6380984846307476
Energy: 0.6355997194999021
Energy: 0.6380984846307476
Energy: 0.6355997194992867
Energy: 0.6380984846307476
Energy: 0.6263375737385262
Energy: 0.6029356867787252
Energy: 0.6263375737391417
Energy: 0.6029356867787252
Energy: 0.6263375737385262
Energy: 0.6029356867787252
Energy: 0.6279222159931639
Energy: 0.6585564390182591
Energy: 0.6279222159931639
Energy: 0.6585564390182591
Energy: 0.6279222159925483
Energy: 0.6585564390182591

minimum gb energy = 0.6007445522822858 eV
minimum distance =  2.23666868617997 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 0.6186088964702334
Energy: 0.6193391274480895
Energy: 0.6186088964702334
Energy: 0.6193391274480895
Energy: 0.6186088964702334
Energy: 0.6193391274480895
Energy: 0.6179728859746998
Energy: 0.712926257805705
Energy: 0.6179728859746998
Energy: 0.712926257805705
Energy: 0.6179728859746998
Energy: 0.712926257805705
Energy: 0.657505278033607
Energy: 0.6336629007878318
Energy: 0.657505278033607
Energy: 0.6336629007878318
Energy: 0.657505278033607
Energy: 0.6336629007878318
Energy: 0.6224542914324512
Energy: 0.6534864514785631
Energy: 0.6224542914324512
Energy: 0.6534864514796584
Energy: 0.6224542914324512
Energy: 0.6534864514807537
Energy: 0.6574945347955089
Energy: 0.6337092782462427
Energy: 0.6574945347944385
Energy: 0.6337092782462427
Energy: 0.6574945347944385
Energy: 0.6337092782462427
Energy: 0.617924103675048
Energy: 0.6126854917290894
Energy: 0.617924103675048
Energy: 0.6126854917290894
Energy: 0.617924103675048
Energy: 0.6126854917290894
Energy: 0.6186088964713287
Energy: 0.6193391274491848
Energy: 0.6186088964713287
Energy: 0.6193391274491848
Energy: 0.6186088964713287
Energy: 0.6193391274480895
Energy: 0.6179728859746998
Energy: 0.712926257805705
Energy: 0.617972885975795
Energy: 0.712926257805705
Energy: 0.617972885975795
Energy: 0.712926257805705
Energy: 0.6575052780325116
Energy: 0.6336629007889271
Energy: 0.6575052780325116
Energy: 0.6336629007889271
Energy: 0.657505278033607
Energy: 0.6336629007889271
Energy: 0.6224542914357373
Energy: 0.5989849749473128
Energy: 0.6224542914357373
Energy: 0.652156448074165
Energy: 0.6224542914357373
Energy: 0.652156448074165
Energy: 0.6574945347933432
Energy: 0.6337092782484333
Energy: 0.6574945347933432
Energy: 0.6337092782473379
Energy: 0.6574945347933432
Energy: 0.6337092782484333
Energy: 0.6179241036739528
Energy: 0.6126854917290894
Energy: 0.6179241036739528
Energy: 0.6126854917290894
Energy: 0.6179241036739528
Energy: 0.6126854917290894
Energy: 0.6186088964702334
Energy: 0.6193391274480895
Energy: 0.6186088964702334
Energy: 0.6193391274480895
Energy: 0.6186088964702334
Energy: 0.6193391274480895
Energy: 0.6179728859746998
Energy: 0.712926257805705
Energy: 0.6179728859746998
Energy: 0.712926257805705
Energy: 0.6179728859746998
Energy: 0.712926257805705
Energy: 0.657505278033607
Energy: 0.6336629007878318
Energy: 0.657505278033607
Energy: 0.6336629007878318
Energy: 0.657505278033607
Energy: 0.6336629007878318
Energy: 0.6224542914324512
Energy: 0.5989849749473128
Energy: 0.6224542914324512
Energy: 0.6277201580728362
Energy: 0.6224542914324512
Energy: 0.6521564480730697
Energy: 0.6574945347944385
Energy: 0.6337092782462427
Energy: 0.6574945347944385
Energy: 0.6337092782462427
Energy: 0.6574945347944385
Energy: 0.6337092782462427

minimum gb energy = 0.5989849749473128 eV
minimum distance =  2.25138440716684 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.6802290680175954
Energy: 0.6381906747783546
Energy: 0.6802290680184897
Energy: 0.6381906747801431
Energy: 0.6802290680193841
Energy: 0.6381906747783546
Energy: 0.6601395447521174
Energy: 0.6376977045882151
Energy: 0.6601395447521174
Energy: 0.6376977045882151
Energy: 0.6601395447521174
Energy: 0.6376977045882151
Energy: 0.6842214225144221
Energy: 0.6517157904029934
Energy: 0.6678936802739083
Energy: 0.6517157904029934
Energy: 0.6678936802739083
Energy: 0.6517157904029934
Energy: 0.6435920960423189
Energy: 0.6868318317451362
Energy: 0.6435920960432132
Energy: 0.6868318317451362
Energy: 0.6435920960423189
Energy: 0.6868318317451362
Energy: 0.6599664384252213
Energy: 0.6559175709551994
Energy: 0.6599664384252213
Energy: 0.6559175709551994
Energy: 0.6599664384252213
Energy: 0.6559175709551994
Energy: 0.6625026104095519
Energy: 0.654155440001061
Energy: 0.6625026104095519
Energy: 0.654155440001061
Energy: 0.6625026104095519
Energy: 0.654155440001061
Energy: 0.6518017501640021
Energy: 0.6602448964578328
Energy: 0.6518017501640021
Energy: 0.6602448964578328
Energy: 0.6518017501640021
Energy: 0.6602448964578328
Energy: 0.6496388741764574
Energy: 0.6739064114792662
Energy: 0.649638874175563
Energy: 0.6739064114792662
Energy: 0.6496388741764574
Energy: 0.6739064114792662
Energy: 0.6967333085868858
Energy: 0.6623619534086083
Energy: 0.6967333085859914
Energy: 0.6623619534086083
Energy: 0.6967333085859914
Energy: 0.6623619534086083
Energy: 0.651353248309761
Energy: 0.6500549645153306
Energy: 0.651353248309761
Energy: 0.6500549645153306
Energy: 0.6513532483106554
Energy: 0.6500549645153306
Energy: 0.6530994497303809
Energy: 0.6626170414157685
Energy: 0.6530994497312753
Energy: 0.6626170414157685
Energy: 0.6530994497312753
Energy: 0.6626170414157685
Energy: 0.6721172602681513
Energy: 0.6622995802411727
Energy: 0.6721172602681513
Energy: 0.6622995802411727
Energy: 0.6721172602681513
Energy: 0.6622995802411727
Energy: 0.645265209322234
Energy: 0.6734550415555658
Energy: 0.645265209322234
Energy: 0.6734550415555658
Energy: 0.6452652093213397
Energy: 0.6734550415555658
Energy: 0.6505420868326787
Energy: 0.6511568856551906
Energy: 0.6505420868308901
Energy: 0.6511568856542962
Energy: 0.6505420868326787
Energy: 0.6511568856542962
Energy: 0.6868121272661797
Energy: 0.6597974567957391
Energy: 0.6868121272697569
Energy: 0.6597974567957391
Energy: 0.6616834303177006
Energy: 0.6597974567957391
Energy: 0.6734196938322935
Energy: 0.6644078747706702
Energy: 0.6734196938331879
Energy: 0.6644078747706702
Energy: 0.6734196938322935
Energy: 0.6644078747706702
Energy: 0.6668064803687208
Energy: 0.6584138772220918
Energy: 0.6668064803696151
Energy: 0.6584138772220918
Energy: 0.6668064803696151
Energy: 0.6584138772229862
Energy: 0.7156199987937524
Energy: 0.6538645428686031
Energy: 0.7156199987937524
Energy: 0.6538645428686031
Energy: 0.7156199987937524
Energy: 0.6538645428686031
Energy: 0.646103434484765
Energy: 0.6540576209709659
Energy: 0.646103434484765
Energy: 0.6540576209709659
Energy: 0.646103434484765
Energy: 0.6540576209709659
Energy: 0.6521936634259105
Energy: 0.6378868225690073
Energy: 0.6521936634259105
Energy: 0.6378868225699016
Energy: 0.6521936634259105
Energy: 0.6378868225699016
Energy: 0.6876782090912588
Energy: 0.6614380985747845
Energy: 0.6876782090912588
Energy: 0.6614380985729958
Energy: 0.687678209092153
Energy: 0.6614380985738902

minimum gb energy = 0.6376977045882151 eV
minimum distance =  2.23282337156877 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.6927893095645997
Energy: 0.6242563600001316
Energy: 0.6927893095645997
Energy: 0.6242563599993778
Energy: 0.6927893095645997
Energy: 0.6242563599986239
Energy: 0.6710392944793659
Energy: 0.6303395653341745
Energy: 0.6710392944793659
Energy: 0.6303395653341745
Energy: 0.6710392944793659
Energy: 0.6303395653334207
Energy: 0.6357659790494975
Energy: 0.6336445226284024
Energy: 0.6357659790494975
Energy: 0.6336445226284024
Energy: 0.6357659790494975
Energy: 0.6336445226284024
Energy: 0.6317875499854773
Energy: 0.6289170134815996
Energy: 0.6317875499854773
Energy: 0.6289170134815996
Energy: 0.6317875499854773
Energy: 0.6289170134815996
Energy: 0.6312362921522319
Energy: 0.6390504322883446
Energy: 0.631236292151478
Energy: 0.6390504322883446
Energy: 0.631236292151478
Energy: 0.6390504322883446
Energy: 0.6351835545600082
Energy: 0.6785450701141933
Energy: 0.6351835545600082
Energy: 0.6785450701141933
Energy: 0.6351835545600082
Energy: 0.6785450701141933
Energy: 0.629450919176088
Energy: 0.6475406088449549
Energy: 0.629450919175334
Energy: 0.6475406088434473
Energy: 0.6294509191768418
Energy: 0.6475406088434473
Energy: 0.6447750938657371
Energy: 0.6314908741429358
Energy: 0.644775093866491
Energy: 0.6314908741429358
Energy: 0.644775093866491
Energy: 0.6314908741429358
Energy: 0.6295217043669998
Energy: 0.6457368180303209
Energy: 0.6295217043669998
Energy: 0.6457368180303209
Energy: 0.6295217043669998
Energy: 0.6457368180310747
Energy: 0.6827610761071627
Energy: 0.6281472398511254
Energy: 0.6827610761071627
Energy: 0.6281472398511254
Energy: 0.6827610761079166
Energy: 0.6281472398511254
Energy: 0.6781702507233693
Energy: 0.6475298642987352
Energy: 0.6781702507233693
Energy: 0.6475298642987352
Energy: 0.6781702507233693
Energy: 0.6475298642987352
Energy: 0.6510150365912268
Energy: 0.6332570289134385
Energy: 0.6510150365912268
Energy: 0.6332570289126846
Energy: 0.6510150365912268
Energy: 0.6332570289134385
Energy: 0.6562804326044535
Energy: 0.6438311980730541
Energy: 0.6562804326044535
Energy: 0.6438311980730541
Energy: 0.6562804326052073
Energy: 0.6438311980730541
Energy: 0.6412415953890089
Energy: 0.6306616196905281
Energy: 0.6412415953890089
Energy: 0.6306616196905281
Energy: 0.6412415953897627
Energy: 0.6306616196905281
Energy: 0.6304011244555797
Energy: 0.6887332951252804
Energy: 0.6304011244563337
Energy: 0.6887332951252804
Energy: 0.6304011244555797
Energy: 0.6887332951245266
Energy: 0.6393067266468444
Energy: 0.6494004079512521
Energy: 0.6393067266468444
Energy: 0.6494004079527256
Energy: 0.6393067266460906
Energy: 0.6494004079519717
Energy: 0.6306276055505875
Energy: 0.6337358109353588
Energy: 0.6306276055498337
Energy: 0.6337358109353588
Energy: 0.6306276055498337
Energy: 0.6337358109353588
Energy: 0.6294752281830337
Energy: 0.6420221628748057
Energy: 0.6294752281830337
Energy: 0.6420221628748057
Energy: 0.6294752281822799
Energy: 0.6420221628748057
Energy: 0.6027308680813681
Energy: 0.6310517430696188
Energy: 0.6027308680813681
Energy: 0.6310517430696188
Energy: 0.6027308680813681
Energy: 0.6310517430688649
Energy: 0.6927893095638458
Energy: 0.6242563599978701
Energy: 0.6927893095638458
Energy: 0.6242563599971163
Energy: 0.6927893095638458
Energy: 0.6242563599971163
Energy: 0.6710392944816275
Energy: 0.6303395653341745
Energy: 0.6710392944823813
Energy: 0.6303395653341745
Energy: 0.6710392944816275
Energy: 0.6303395653341745
Energy: 0.6357659790479898
Energy: 0.633644522630664
Energy: 0.6357659790479898
Energy: 0.633644522630664
Energy: 0.6357659790487437
Energy: 0.633644522630664
Energy: 0.6317875499862311
Energy: 0.6289170134778302
Energy: 0.6317875499869849
Energy: 0.6289170134778302
Energy: 0.6317875499869849
Energy: 0.6289170134778302
Energy: 0.631236292156755
Energy: 0.6390504322890984
Energy: 0.631236292156755
Energy: 0.6390504322883446
Energy: 0.631236292156755
Energy: 0.6390504322883446
Energy: 0.6351835545555192
Energy: 0.6785450701141933
Energy: 0.6351835545547654
Energy: 0.6785450701141933
Energy: 0.6351835545547654
Energy: 0.6785450701141933

minimum gb energy = 0.6027308680813681 eV
minimum distance =  2.22483073299296 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 0.633043633495746
Energy: 0.6374595442034525
Energy: 0.633043633495746
Energy: 0.6374595442034525
Energy: 0.633043633495746
Energy: 0.6374595442034525
Energy: 0.6286351876126475
Energy: 0.6171572801187302
Energy: 0.6286351876132983
Energy: 0.6171572801187302
Energy: 0.6286351876126475
Energy: 0.6171572801187302
Energy: 0.6328358637475046
Energy: 0.6027825799358224
Energy: 0.6328358637475046
Energy: 0.6027825799358224
Energy: 0.6328358637468539
Energy: 0.6027825799358224
Energy: 0.6097251655649865
Energy: 0.6302099842010103
Energy: 0.6097251655643358
Energy: 0.630209984201661
Energy: 0.6097251655643358
Energy: 0.630209984201661
Energy: 0.6214264362189561
Energy: 0.6285078905649212
Energy: 0.6214264362189561
Energy: 0.6285078905649212
Energy: 0.6214264362189561
Energy: 0.6285078905649212
Energy: 0.6265403064793611
Energy: 0.6158359373884094
Energy: 0.6265403064793611
Energy: 0.6158359373884094
Energy: 0.6265403064787104
Energy: 0.6158359373884094
Energy: 0.5982474211041325
Energy: 0.6413948231731018
Energy: 0.5982474211034817
Energy: 0.6413948231724511
Energy: 0.5982474211034817
Energy: 0.6413948231724511
Energy: 0.6164234395186494
Energy: 0.6456843351419369
Energy: 0.6164234395179986
Energy: 0.6456843351419369
Energy: 0.6164234395186494
Energy: 0.6456843351419369
Energy: 0.6626683627731522
Energy: 0.6022259626549056
Energy: 0.6626683627731522
Energy: 0.6022259626555562
Energy: 0.6626683627731522
Energy: 0.6022259626555562
Energy: 0.6335134092476487
Energy: 0.6268894313576037
Energy: 0.6335134092482995
Energy: 0.6268894313576037
Energy: 0.6335134092482995
Energy: 0.6268894313576037
Energy: 0.6084952844029808
Energy: 0.6424718321045494
Energy: 0.6084952844029808
Energy: 0.6424718321038986
Energy: 0.6084952844029808
Energy: 0.6424718321038986
Energy: 0.634138013061839
Energy: 0.6016685293097911
Energy: 0.6341380130611883
Energy: 0.6016685293097911
Energy: 0.634138013061839
Energy: 0.6016685293097911
Energy: 0.6251068068862132
Energy: 0.6213734008590467
Energy: 0.6251068068855624
Energy: 0.6213734008590467
Energy: 0.6251068068855624
Energy: 0.6213734008590467
Energy: 0.6138589113986535
Energy: 0.6267466998934148
Energy: 0.6138589113986535
Energy: 0.6267466998934148
Energy: 0.6138589113986535
Energy: 0.6267466998940656
Energy: 0.6448836140465374
Energy: 0.6067222836847026
Energy: 0.6448836140465374
Energy: 0.6067222836847026
Energy: 0.6448836140465374
Energy: 0.6067222836847026
Energy: 0.6339038985850334
Energy: 0.5990245701309288
Energy: 0.6339038985850334
Energy: 0.5990245701309288
Energy: 0.6339038985850334
Energy: 0.5990245701309288
Energy: 0.6087430867915496
Energy: 0.6298351212143005
Energy: 0.6087430867922005
Energy: 0.6298351212149512
Energy: 0.6087430867922005
Energy: 0.6298351212143005
Energy: 0.634262598881114
Energy: 0.6341795362752972
Energy: 0.634262598881114
Energy: 0.6341795362746464
Energy: 0.634262598881114
Energy: 0.6341795362752972
Energy: 0.6276750243527066
Energy: 0.6181819132336859
Energy: 0.6276750243520559
Energy: 0.6181819132343366
Energy: 0.6276750243527066
Energy: 0.6181819132343366
Energy: 0.6142910679666697
Energy: 0.6348432477446803
Energy: 0.6142910679666697
Energy: 0.6348432477453311
Energy: 0.6142910679666697
Energy: 0.6348432477446803
Energy: 0.596357556484586
Energy: 0.6417576060389092
Energy: 0.5963575564839353
Energy: 0.6417576060382585
Energy: 0.5963575564839353
Energy: 0.6417576060382585
Energy: 0.6645355659364608
Energy: 0.6029501900043995
Energy: 0.6645355659364608
Energy: 0.6029501900043995
Energy: 0.6645355659358101
Energy: 0.6029501900043995
Energy: 0.6603055638752237
Energy: 0.6217855080167722
Energy: 0.660305563874573
Energy: 0.6217855080167722
Energy: 0.6603055638752237
Energy: 0.6217855080167722
Energy: 0.63082141556739
Energy: 0.6391306876909799
Energy: 0.6308214155680406
Energy: 0.6391306876916306
Energy: 0.63082141556739
Energy: 0.6391306876916306
Energy: 0.6267793900441233
Energy: 0.6021955783715466
Energy: 0.6267793900441233
Energy: 0.6021955783715466
Energy: 0.6267793900447741
Energy: 0.6021955783708959
Energy: 0.6372288046152935
Energy: 0.6200790570792409
Energy: 0.6372288046159442
Energy: 0.6200790570798916
Energy: 0.6372288046152935
Energy: 0.6200790570798916
Energy: 0.6051765178167041
Energy: 0.6274063284244089
Energy: 0.6051765178167041
Energy: 0.6274063284244089
Energy: 0.6051765178167041
Energy: 0.6274063284237583
Energy: 0.6417001671461188
Energy: 0.6190454072840225
Energy: 0.6417001671461188
Energy: 0.6190454072846732
Energy: 0.6417001671454681
Energy: 0.6190454072846732
Energy: 0.6305027546059443
Energy: 0.613201559559759
Energy: 0.6305027546052936
Energy: 0.613201559559759
Energy: 0.6305027546052936
Energy: 0.613201559559759

minimum gb energy = 0.5963575564839353 eV
minimum distance =  2.23094929478706 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 0.5937176440923442
Energy: 0.6296307949711544
Energy: 0.5937176440923442
Energy: 0.6296307949717265
Energy: 0.5937176440923442
Energy: 0.6296307949717265
Energy: 0.613774503816514
Energy: 0.5877267825530162
Energy: 0.613774503816514
Energy: 0.5877267825530162
Energy: 0.613774503817086
Energy: 0.5877267825530162
Energy: 0.6178332779288177
Energy: 0.5744767899458341
Energy: 0.6178332779288177
Energy: 0.5744767899458341
Energy: 0.6178332779288177
Energy: 0.5744767899458341
Energy: 0.568860147223657
Energy: 0.6398392087979256
Energy: 0.568860147223657
Energy: 0.6245189236592797
Energy: 0.5688601472230849
Energy: 0.6245189236592797
Energy: 0.5961038927503439
Energy: 0.5976635582823394
Energy: 0.5961038927497719
Energy: 0.5976635582823394
Energy: 0.596103892750916
Energy: 0.5976635582823394
Energy: 0.6187418015450107
Energy: 0.574084016985106
Energy: 0.6187418015444387
Energy: 0.574084016985106
Energy: 0.6187418015450107
Energy: 0.574084016985106
Energy: 0.587390731134603
Energy: 0.6029940847747932
Energy: 0.587390731134603
Energy: 0.6029940847753653
Energy: 0.587390731134603
Energy: 0.6029940847753653
Energy: 0.5672950110976615
Energy: 0.618149115038463
Energy: 0.5672950110970894
Energy: 0.6181491150378909
Energy: 0.5672950110976615
Energy: 0.618149115038463
Energy: 0.6171999590807956
Energy: 0.576710874779313
Energy: 0.6171999590807956
Energy: 0.576710874779313
Energy: 0.6171999590802236
Energy: 0.576710874779313
Energy: 0.5962629211968649
Energy: 0.6114822238317283
Energy: 0.5962629211968649
Energy: 0.6171510551509262
Energy: 0.5962629211968649
Energy: 0.6171510551514983
Energy: 0.5663591307660736
Energy: 0.683252167508403
Energy: 0.5663591307660736
Energy: 0.683252167508403
Energy: 0.5663591307660736
Energy: 0.683252167508403
Energy: 0.6441854026271115
Energy: 0.5874644630155529
Energy: 0.6441854026271115
Energy: 0.5874644630155529
Energy: 0.6441854026276836
Energy: 0.5874644630155529
Energy: 0.6088859193683474
Energy: 0.5742228121425093
Energy: 0.6088859193683474
Energy: 0.5742228121425093
Energy: 0.6088859193683474
Energy: 0.5742228121425093
Energy: 0.5965001812138793
Energy: 0.6442621772128093
Energy: 0.5965001812133073
Energy: 0.6280755390517132
Energy: 0.5965001812138793
Energy: 0.6280755390511411
Energy: 0.6238313005770454
Energy: 0.5993861610447181
Energy: 0.6238313005770454
Energy: 0.5993861610447181
Energy: 0.6238313005770454
Energy: 0.5993861610452641
Energy: 0.6136020474330508
Energy: 0.5737185371474169
Energy: 0.6136020474336227
Energy: 0.5737185371474169
Energy: 0.6136020474330508
Energy: 0.5737185371474169
Energy: 0.5651963577305587
Energy: 0.6235482359226622
Energy: 0.5651963577317026
Energy: 0.6235482359226622
Energy: 0.5651963577305587
Energy: 0.6235482359226622
Energy: 0.5663032701064075
Energy: 0.6191996749515619
Energy: 0.5663032701069796
Energy: 0.6191996749515619
Energy: 0.5663032701069796
Energy: 0.6191996749515619
Energy: 0.6189148592509287
Energy: 0.5769180707095745
Energy: 0.6189148592509287
Energy: 0.5769180707101466
Energy: 0.6189148592509287
Energy: 0.5769180707095745
Energy: 0.5793746733858127
Energy: 0.6108357829117368
Energy: 0.5793746733858127
Energy: 0.6108357829117368
Energy: 0.5793746733858127
Energy: 0.6108357829117368
Energy: 0.5656606061754682
Energy: 0.6780585686505014
Energy: 0.5656606061754682
Energy: 0.6780585686516455
Energy: 0.5656606061754682
Energy: 0.6780585686510735
Energy: 0.6335986737593666
Energy: 0.5722117982674138
Energy: 0.6335986737593666
Energy: 0.5722117982674138
Energy: 0.6335986737587945
Energy: 0.5722117982674138
Energy: 0.6327787783137387
Energy: 0.5715681851517451
Energy: 0.6327787783137387
Energy: 0.5715681851517451
Energy: 0.6327787783137387
Energy: 0.5715681851517451
Energy: 0.5688240331682543
Energy: 0.6259839991304832
Energy: 0.5688240331682543
Energy: 0.6259839991304832
Energy: 0.5688240331676823
Energy: 0.6259839991304832
Energy: 0.6315005508030478
Energy: 0.597706002543531
Energy: 0.6315005508030478
Energy: 0.597706002543531
Energy: 0.6315005508030478
Energy: 0.597706002543531
Energy: 0.6103460810786966
Energy: 0.5735686845130077
Energy: 0.6103460810786966
Energy: 0.5735686845130077
Energy: 0.6103460810781245
Energy: 0.5735686845130077
Energy: 0.5934868935310804
Energy: 0.619136567425002
Energy: 0.5934868935310804
Energy: 0.61913656742443
Energy: 0.5934868935305084
Energy: 0.619136567425002
Energy: 0.606019044229899
Energy: 0.6197076374649483
Energy: 0.6060190442293271
Energy: 0.6197076374649483
Energy: 0.606019044229899
Energy: 0.6197076374655203
Energy: 0.6261712349685159
Energy: 0.5800219258836407
Energy: 0.6261712349679438
Energy: 0.5800219258836407
Energy: 0.6261712349690878
Energy: 0.5800219258836407
Energy: 0.5661975183348861
Energy: 0.6093629868312104
Energy: 0.5661975183348861
Energy: 0.6093629868312104
Energy: 0.5661975183348861
Energy: 0.6093629868306384
Energy: 0.5652722496409226
Energy: 0.6083789328795449
Energy: 0.5652722496409226
Energy: 0.6083789328795449
Energy: 0.5652722496403506
Energy: 0.6083789328795449
Energy: 0.6336935430851591
Energy: 0.5722401144730025
Energy: 0.6336935430851591
Energy: 0.5722401144730025
Energy: 0.6336935430851591
Energy: 0.5722401144730025
Energy: 0.6282779414335997
Energy: 0.5727591495574786
Energy: 0.6282779414335997
Energy: 0.5727591495569065
Energy: 0.6282779414330277
Energy: 0.5727591495569065

minimum gb energy = 0.5651963577305587 eV
minimum distance =  2.24307723958039 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.015356015357149295
Energy: 0.44549621914274495
Energy: 0.015356015357149295
Energy: 0.44549621914274495
Energy: 0.015356015357149295
Energy: 0.4454962191422961
Energy: 0.015892636131321504
Energy: 0.16563470344890455
Energy: 0.015892636131321504
Energy: 0.16563470344890455
Energy: 0.015892636131321504
Energy: 0.16563470344890455
Energy: 0.4457031655456689
Energy: 0.1665287713680008
Energy: 0.445703165438364
Energy: 0.16652877136707664
Energy: 0.44570316543788874
Energy: 0.16652877136707664
Energy: 0.01589263613039737
Energy: 0.1656347034498551
Energy: 0.015892636130846235
Energy: 0.1656347034498551
Energy: 0.01589263613039737
Energy: 0.1656347034498551

minimum gb energy = 0.015356015357149295 eV
minimum distance =  2.45487917072987 Angstroms
sigma value = 1