Model name: model_name=MEAM_LAMMPS_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391749382019
cohesive_energy=4.450349977833563
mass=58.6934
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: 0.0 eV

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

Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 1.220911026047009
Energy: 1.4668546766901478
Energy: 1.220911026047009
Energy: 1.4668546766901478
Energy: 1.220911026047009
Energy: 1.4668546766908088
Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 1.220911026047009
Energy: 1.4668546766917636
Energy: 1.220911026047009
Energy: 1.4668546766911394
Energy: 1.220911026047009
Energy: 1.4668546766908088
Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 0.018146766635021003
Energy: 1.2209110260473397
Energy: 0.018146766635021003
Energy: 1.220911026047009
Energy: 1.220911026047009
Energy: 1.4668546766914332
Energy: 1.220911026047009
Energy: 1.4668546766898174
Energy: 1.220911026047009
Energy: 1.4668546766917636

minimum gb energy = 0.018146766635021003 eV
minimum distance =  2.36838722630922 Angstroms
sigma value = 1


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

Energy: 1.5748693694340268
Energy: 1.508938071598515
Energy: 1.5748693694348224
Energy: 1.508938071598515
Energy: 1.5748693694340268
Energy: 1.508938071598515
Energy: 1.744438503654111
Energy: 1.4074959763463273
Energy: 1.7444385036533152
Energy: 1.4074959763455317
Energy: 1.744438503654111
Energy: 1.4074959763463273
Energy: 1.5543972258930734
Energy: 1.5820067955133583
Energy: 1.5543972258914822
Energy: 1.5820067955133583
Energy: 1.5543972258906866
Energy: 1.5820067955133583
Energy: 1.6507304520121804
Energy: 1.485871831313907
Energy: 1.6507304520129762
Energy: 1.485871831313907
Energy: 1.6507304520129762
Energy: 1.485871831313907
Energy: 1.5051829218225605
Energy: 1.6531338235067645
Energy: 1.5051829218225605
Energy: 1.6531338235067645
Energy: 1.5051829218225605
Energy: 1.6531338235067645
Energy: 1.623600083950366
Energy: 1.4412773335621976
Energy: 1.623600083950366
Energy: 1.441277333562993
Energy: 1.6236000839495706
Energy: 1.441277333562993
Energy: 1.4535543808428983
Energy: 1.5467402579644765
Energy: 1.4535543808428983
Energy: 1.5467402579644765
Energy: 1.4535543808428983
Energy: 1.5467402579651996
Energy: 1.4538043124512008
Energy: 1.6776796045573044
Energy: 1.4538043124512008
Energy: 1.6776796045573044
Energy: 1.4538043124519966
Energy: 1.6776796045573044
Energy: 1.6106130569436052
Energy: 1.5461134111920782
Energy: 1.6106130569436052
Energy: 1.5461134111912826
Energy: 1.6106130569436052
Energy: 1.5461134111912826
Energy: 1.3886941188206368
Energy: 1.6561001652470455
Energy: 1.3886941188214323
Energy: 1.6561001652486365
Energy: 1.3886941188214323
Energy: 1.6561001652470455
Energy: 1.5875276894490895
Energy: 1.4391439875059617
Energy: 1.587527689449885
Energy: 1.4391439875059617
Energy: 1.5875276894490895
Energy: 1.4391439875059617
Energy: 1.3677391980978577
Energy: 1.8966946000365448
Energy: 1.3677391980970621
Energy: 1.8966946000365448
Energy: 1.3677391980970621
Energy: 1.8966946000365448
Energy: 1.6952929844440865
Energy: 1.3535398300295745
Energy: 1.6952929844448823
Energy: 1.3535398300303698
Energy: 1.6952929844440865
Energy: 1.3535398300311654
Energy: 1.460874463987674
Energy: 1.4891925165310183
Energy: 1.460874463987674
Energy: 1.4891925165310183
Energy: 1.4608744639868787
Energy: 1.4891925165318138
Energy: 1.7711582417816156
Energy: 1.401253542914478
Energy: 1.7711582417832066
Energy: 1.401253542914478
Energy: 1.7711582417824112
Energy: 1.401253542914478
Energy: 1.7652795352967827
Energy: 1.5997806370803633
Energy: 1.7652795352975783
Energy: 1.5997806370803633
Energy: 1.7652795352967827
Energy: 1.5997806370811591
Energy: 1.5319949956494174
Energy: 1.545567935494604
Energy: 1.5319949956494174
Energy: 1.545567935494604
Energy: 1.5319949956494174
Energy: 1.545567935494604
Energy: 1.5349402117012663
Energy: 1.471847320716304
Energy: 1.5349402117020619
Energy: 1.471847320716304
Energy: 1.5349402117012663
Energy: 1.471847320716304
Energy: 1.5325170854626955
Energy: 1.4815159146717582
Energy: 1.532517085463491
Energy: 1.4815159146717582
Energy: 1.5325170854626955
Energy: 1.4815159146717582
Energy: 1.6017149532952677
Energy: 1.4401903308012673
Energy: 1.6017149532968589
Energy: 1.4401903308012673
Energy: 1.6017149532960633
Energy: 1.4401903308020632
Energy: 1.4201837055585578
Energy: 1.910258795019761
Energy: 1.4201837055569664
Energy: 1.910258795019761
Energy: 1.4201837055585578
Energy: 1.910258795019761
Energy: 1.5967765905093945
Energy: 1.549444045587005
Energy: 1.5967765905093945
Energy: 1.549444045587005
Energy: 1.59677659051019
Energy: 1.5494440455862095
Energy: 1.3900272260535018
Energy: 1.6950970407755401
Energy: 1.3900272260535018
Energy: 1.6950970407763355
Energy: 1.3900272260535018
Energy: 1.6950970407755401

minimum gb energy = 1.3535398300295745 eV
minimum distance =  2.25204330106938 Angstroms
sigma value = 33


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

Energy: 1.6639711825471961
Energy: 1.6754447656138656
Energy: 1.5593876330277614
Energy: 1.6754447656152234
Energy: 1.663971182546291
Energy: 1.6754447656147708
Energy: 1.6705848459588655
Energy: 1.4950946913514602
Energy: 1.6705848459566033
Energy: 1.4950946913514602
Energy: 1.6705848459588655
Energy: 1.4950946913514602
Energy: 1.4553869035493485
Energy: 1.4849124725061573
Energy: 1.4553869035516112
Energy: 1.4849124725066098
Energy: 1.4553869035493485
Energy: 1.4849124725057048
Energy: 1.722162636000351
Energy: 1.6626608325217382
Energy: 1.722162636000351
Energy: 1.6626608325217382
Energy: 1.7221626360008038
Energy: 1.6626608325217382
Energy: 1.5567594947428893
Energy: 1.5691883740197454
Energy: 1.5567594947433416
Energy: 1.569188374018388
Energy: 1.5567594947428893
Energy: 1.569188374016578
Energy: 1.5211919412155885
Energy: 1.4402856538673139
Energy: 1.521191941214231
Energy: 1.4402856538677662
Energy: 1.5211919412146835
Energy: 1.4402856538668614
Energy: 1.687484840635365
Energy: 1.56031781239217
Energy: 1.68748484063446
Energy: 1.5603178123912647
Energy: 1.687484840635365
Energy: 1.56031781239217
Energy: 1.3554199768861421
Energy: 1.6644923854517137
Energy: 1.3554199768847845
Energy: 1.6644923854517137
Energy: 1.3554199768865944
Energy: 1.6644923854521663
Energy: 1.4173109321154176
Energy: 1.4385609173690777
Energy: 1.4173109321149653
Energy: 1.4385609173695302
Energy: 1.4173109321145128
Energy: 1.4385609173690777
Energy: 1.4224632039871368
Energy: 1.7128076032451127
Energy: 1.4225063653075651
Energy: 1.7128076032464699
Energy: 1.4224632039866842
Energy: 1.7128076032460176
Energy: 1.8187284080712773
Energy: 1.4398239209286234
Energy: 1.81872840807173
Energy: 1.4398239209286234
Energy: 1.8187284080712773
Energy: 1.4398239209286234
Energy: 1.4389349367680508
Energy: 1.5498501115588426
Energy: 1.4389371469492982
Energy: 1.549850111559295
Energy: 1.4389349367680508
Energy: 1.5498501115583905
Energy: 1.5598691631766648
Energy: 1.4398230045737892
Energy: 1.6647191265985257
Energy: 1.4398230045742415
Energy: 1.5598691631771173
Energy: 1.4398230045733365
Energy: 1.5595098416269826
Energy: 1.679503100787486
Energy: 1.6641204578627733
Energy: 1.6795031007870336
Energy: 1.5595098416269826
Energy: 1.6795031007883912
Energy: 1.5663661730709073
Energy: 1.4855945268778052
Energy: 1.5663661730704548
Energy: 1.485594526878258
Energy: 1.5663661730709073
Energy: 1.4855945268778052
Energy: 1.4379445275753138
Energy: 1.4940848698608722
Energy: 1.4379445275748612
Energy: 1.4940848698604197
Energy: 1.4379445275753138
Energy: 1.4940848698622298
Energy: 1.7659537814431787
Energy: 1.5910654971198739
Energy: 1.7659537814409163
Energy: 1.5910654971194216
Energy: 1.765953781443631
Energy: 1.5910654971198739
Energy: 1.5563037675535774
Energy: 1.438059304974471
Energy: 1.55630376755403
Energy: 1.438059304974471
Energy: 1.556303767553125
Energy: 1.4380593049735662
Energy: 1.5237861844388385
Energy: 1.4956351799256218
Energy: 1.523786184438386
Energy: 1.4956351799256218
Energy: 1.523786184438386
Energy: 1.4956351799256218
Energy: 1.68018745940897
Energy: 1.5640340829741597
Energy: 1.6801874594112327
Energy: 1.564034082973707
Energy: 1.6801874594094226
Energy: 1.5640340829741597
Energy: 1.3734833478775061
Energy: 1.6652255890265992
Energy: 1.3734833478788637
Energy: 1.6652255890265992
Energy: 1.3734833478779584
Energy: 1.6652255890270515
Energy: 1.4831851966538734
Energy: 1.4570911592146383
Energy: 1.4831851966520633
Energy: 1.4570911592150908
Energy: 1.4831851966529686
Energy: 1.4570911592150908
Energy: 1.4221223298922137
Energy: 1.7147071248601435
Energy: 1.4221338339552232
Energy: 1.714707124862406
Energy: 1.4221223298917611
Energy: 1.7147071248596912
Energy: 1.7297027913685312
Energy: 1.5577247671266914
Energy: 1.729702791347263
Energy: 1.5577247671266914
Energy: 1.7297027913680787
Energy: 1.5577247671266914
Energy: 1.4555693669661915
Energy: 1.5206347121555883
Energy: 1.4552626173024137
Energy: 1.5206347121524206
Energy: 1.4555693669661915
Energy: 1.5206347121555883
Energy: 1.6645993822289449
Energy: 1.6381128710856814
Energy: 1.5600738941415784
Energy: 1.638112871079799
Energy: 1.6645993822289449
Energy: 1.638112871079799
Energy: 1.6646910748718795
Energy: 1.5958013416294172
Energy: 1.5617887039680016
Energy: 1.5958013416294172
Energy: 1.6646910748723318
Energy: 1.5958013416298698
Energy: 1.4377991235867387
Energy: 1.4837129842445766
Energy: 1.437799123585381
Energy: 1.4837129842477443
Energy: 1.4377991235862864
Energy: 1.483712984246387
Energy: 1.7119401972180075
Energy: 1.4704258012654001
Energy: 1.7119401972189126
Energy: 1.4704258012654001
Energy: 1.71194019721846
Energy: 1.4704258012649478
Energy: 1.4338844411191471
Energy: 1.8379582390154612
Energy: 1.4338844411173373
Energy: 1.837958239015914
Energy: 1.4338844411191471
Energy: 1.8379582390154612
Energy: 1.5563005793054712
Energy: 1.4389409595988643
Energy: 1.5563005793050184
Energy: 1.4389409595988643
Energy: 1.5563005793059235
Energy: 1.4389409595988643
Energy: 1.460412243404657
Energy: 1.5616250926473232
Energy: 1.460412243405562
Energy: 1.5616250926477757
Energy: 1.4604122434042044
Energy: 1.5616250926473232
Energy: 1.675453171671201
Energy: 1.563813561827032
Energy: 1.6754531716698435
Energy: 1.5638135618274844
Energy: 1.6754531716716534
Energy: 1.563813561827032
Energy: 1.496543779021116
Energy: 1.5648764415619891
Energy: 1.496543779021116
Energy: 1.5648764415624419
Energy: 1.4965437790206635
Energy: 1.5648764415624419
Energy: 1.4923419967932563
Energy: 1.4400718888025266
Energy: 1.4923419967946139
Energy: 1.4400718888025266
Energy: 1.4923419967932563
Energy: 1.4400718888020745
Energy: 1.6640563028980517
Energy: 1.718048657679864
Energy: 1.6640563028962416
Energy: 1.718048657679864
Energy: 1.6640563028975992
Energy: 1.718048657679864
Energy: 1.4392108682907814
Energy: 1.556511313108093
Energy: 1.4392860290964913
Energy: 1.5565113131085457
Energy: 1.4392108682907814
Energy: 1.556511313108093
Energy: 1.4956613604137678
Energy: 1.5212745718510223
Energy: 1.4903313913161218
Energy: 1.5212745718510223
Energy: 1.4956613604142204
Energy: 1.5212745718514746
Energy: 1.5593844844559346
Energy: 1.6814832342794077
Energy: 1.6644552265773243
Energy: 1.6814832342794077
Energy: 1.5593844844563867
Energy: 1.6814832342794077
Energy: 1.6643385010218292
Energy: 1.3532298193387722
Energy: 1.6643385010200193
Energy: 1.3532298193392245
Energy: 1.6643385010227345
Energy: 1.3532298193392245
Energy: 1.4392234617951607
Energy: 1.4162967596007556
Energy: 1.4392234617933504
Energy: 1.4162967595998504
Energy: 1.4392234617951607
Energy: 1.4162967595998504

minimum gb energy = 1.3532298193387722 eV
minimum distance =  2.34157351628615 Angstroms
sigma value = 51


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

Energy: 1.5495078493746808
Energy: 1.5768008350109077
Energy: 1.5495078493746808
Energy: 1.5768008350119564
Energy: 1.5495078493746808
Energy: 1.5768008350119564
Energy: 1.6678397251147346
Energy: 1.5164555330794134
Energy: 1.6678397251147346
Energy: 1.5164555330794134
Energy: 1.6678397251147346
Energy: 1.5164555330794134
Energy: 1.4828988860049737
Energy: 1.5559866705729632
Energy: 1.4828988860049737
Energy: 1.5559866705740115
Energy: 1.4828988860049737
Energy: 1.5559866705729632
Energy: 1.5393336666359065
Energy: 1.403082130409702
Energy: 1.5393336666359065
Energy: 1.403082130409702
Energy: 1.539333666636955
Energy: 1.403082130409702
Energy: 1.603600920857811
Energy: 1.5000211418526763
Energy: 1.603600920857811
Energy: 1.5000211418526763
Energy: 1.6036009208567628
Energy: 1.5000211418526763
Energy: 1.602313665020503
Energy: 1.5001128196584834
Energy: 1.602313665020503
Energy: 1.5001128196584834
Energy: 1.602313665020503
Energy: 1.5001128196584834
Energy: 1.549038358845024
Energy: 1.499433187446208
Energy: 1.5490383588439756
Energy: 1.499433187446208
Energy: 1.5490383588439756
Energy: 1.499433187446208
Energy: 1.4420129259459262
Energy: 1.5005023432228646
Energy: 1.4420129259448775
Energy: 1.5005023432228646
Energy: 1.4420129259459262
Energy: 1.5005023432228646
Energy: 1.7763791690451214
Energy: 1.402891986759379
Energy: 1.7763791690451214
Energy: 1.402891986759379
Energy: 1.7763791690451214
Energy: 1.402891986759379
Energy: 1.4318879572017444
Energy: 1.7664272011950433
Energy: 1.4318879572017444
Energy: 1.7664272011950433
Energy: 1.431887957200696
Energy: 1.7664272011960922
Energy: 1.661970128001078
Energy: 1.4010924454839597
Energy: 1.661970128001078
Energy: 1.4010924454839597
Energy: 1.661970128001078
Energy: 1.4010924454839597
Energy: 1.54685353770322
Energy: 1.5797549567419378
Energy: 1.54685353770322
Energy: 1.5797549567419378
Energy: 1.54685353770322
Energy: 1.5797549567429863
Energy: 1.670670033489874
Energy: 1.5134522557647434
Energy: 1.670670033489874
Energy: 1.5134522557636951
Energy: 1.6706700334909226
Energy: 1.5134522557647434
Energy: 1.4832609597973707
Energy: 1.4709057530291487
Energy: 1.4832609597973707
Energy: 1.4709057530281002
Energy: 1.4832609597973707
Energy: 1.4709057530281002
Energy: 1.5782683624617233
Energy: 1.5488411131288973
Energy: 1.5782683624617233
Energy: 1.5488411131278486
Energy: 1.5782683624617233
Energy: 1.5488411131278486
Energy: 1.5877088652809217
Energy: 1.499883296144679
Energy: 1.5877088652809217
Energy: 1.4998832961436304
Energy: 1.58770886528197
Energy: 1.4998832961436304
Energy: 1.6021627971705206
Energy: 1.6194113806050248
Energy: 1.6021627971705206
Energy: 1.6194113806039763
Energy: 1.6021627971705206
Energy: 1.6194113806039763
Energy: 1.5475074584454818
Energy: 1.4995555890637602
Energy: 1.5475074584454818
Energy: 1.4995555890637602
Energy: 1.5475074584454818
Energy: 1.4995555890637602

minimum gb energy = 1.4010924454839597 eV
minimum distance =  2.25585414385786 Angstroms
sigma value = 19


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

Energy: 1.3654313565441871
Energy: 1.4081670710459218
Energy: 1.3093713562039382
Energy: 1.4081670710459218
Energy: 1.3654313565441871
Energy: 1.4081670710459218
Energy: 1.5548417246290738
Energy: 1.5786358563615044
Energy: 1.5548417246296955
Energy: 1.5786358563615044
Energy: 1.5548417246284518
Energy: 1.5786358563615044
Energy: 1.3112759541408325
Energy: 1.564568694239668
Energy: 1.3112759541408325
Energy: 1.564568694239668
Energy: 1.3112759541402108
Energy: 1.5645686942409114
Energy: 1.4535108638680363
Energy: 1.3111126215362499
Energy: 1.4535108638674143
Energy: 1.3111126215362499
Energy: 1.4535108638686582
Energy: 1.311112621534384
Energy: 1.3582496595200877
Energy: 1.3066938597026097
Energy: 1.3582496595207099
Energy: 1.3066938597019877
Energy: 1.3582496595207099
Energy: 1.3066938597013658
Energy: 1.2889691818071358
Energy: 1.306781079480499
Energy: 1.2889691818077578
Energy: 1.3067810794798773
Energy: 1.2889691818071358
Energy: 1.3067810794798773
Energy: 1.387070661353866
Energy: 1.3112226654769001
Energy: 1.387070661353866
Energy: 1.3112226654769001
Energy: 1.387070661353866
Energy: 1.3112226654781438
Energy: 1.311195475214392
Energy: 1.6498203520142236
Energy: 1.311194271215206
Energy: 1.6498203520142236
Energy: 1.31119547521377
Energy: 1.6498203520148456
Energy: 1.4973375632615322
Energy: 1.5977678151860495
Energy: 1.497337563260288
Energy: 1.5977678151860495
Energy: 1.4973375632615322
Energy: 1.5977678151866717
Energy: 1.3093713562033162
Energy: 1.4081670710459218
Energy: 1.30937135620456
Energy: 1.4081670710459218
Energy: 1.3093713562033162
Energy: 1.4081670710459218
Energy: 1.5548417246290738
Energy: 1.5786358563608824
Energy: 1.5548417246296955
Energy: 1.5786358563608824
Energy: 1.5548417246284518
Energy: 1.578635856362126
Energy: 1.3112759541408325
Energy: 1.5645686942402897
Energy: 1.3112759541414547
Energy: 1.564568694239668
Energy: 1.3112759541414547
Energy: 1.5645686942409114
Energy: 1.4535108638680363
Energy: 1.3111088286170618
Energy: 1.4535108638674143
Energy: 1.3111088286170618
Energy: 1.4535108638680363
Energy: 1.3111088286170618
Energy: 1.3582496595213318
Energy: 1.3066938597019877
Energy: 1.3582496595213318
Energy: 1.3066938597013658
Energy: 1.3582496595213318
Energy: 1.3066938597013658
Energy: 1.2889691818071358
Energy: 1.3067810794798773
Energy: 1.2889691818077578
Energy: 1.3067810794798773
Energy: 1.2889691818071358
Energy: 1.306781079481121
Energy: 1.3870706613544879
Energy: 1.3112226654769001
Energy: 1.3870706613551094
Energy: 1.3112226654769001
Energy: 1.3870706613551094
Energy: 1.311222665477522
Energy: 1.3112356519582153
Energy: 1.6498203520148456
Energy: 1.311212568595378
Energy: 1.6498203520142236
Energy: 1.3112356519582153
Energy: 1.6498203520148456
Energy: 1.5016564974717679
Energy: 1.5977678151879153
Energy: 1.49733756326091
Energy: 1.5977678151879153
Energy: 1.5016564974717679
Energy: 1.5977678151885373
Energy: 1.3654313565435652
Energy: 1.4081670710465435
Energy: 1.3093713562039382
Energy: 1.4081670710465435
Energy: 1.3654313565435652
Energy: 1.4081670710459218
Energy: 1.5548417246284518
Energy: 1.5786358563615044
Energy: 1.5548417246290738
Energy: 1.5786358563608824
Energy: 1.5548417246290738
Energy: 1.578635856362126
Energy: 1.3112759541408325
Energy: 1.5645686942402897
Energy: 1.3112759541408325
Energy: 1.564568694239668
Energy: 1.3112759541402108
Energy: 1.5645686942415336
Energy: 1.4535108638680363
Energy: 1.3111126215362499
Energy: 1.4535108638667924
Energy: 1.3111126215362499
Energy: 1.4535108638680363
Energy: 1.311112621535006
Energy: 1.3582496595213318
Energy: 1.3066938597019877
Energy: 1.3582496595213318
Energy: 1.3066938597026097
Energy: 1.3582496595213318
Energy: 1.3066938597019877
Energy: 1.2889691818071358
Energy: 1.3067810794792554
Energy: 1.2889691818071358
Energy: 1.3067810794792554
Energy: 1.2889691818071358
Energy: 1.3067810794798773
Energy: 1.387070661353866
Energy: 1.3112226654769001
Energy: 1.387070661353866
Energy: 1.3112226654769001
Energy: 1.387070661353866
Energy: 1.3112226654781438
Energy: 1.311195475214392
Energy: 1.6498203520142236
Energy: 1.311194271215206
Energy: 1.6498203520142236
Energy: 1.311195475214392
Energy: 1.6498203520148456
Energy: 1.4973375632615322
Energy: 1.5977678151879153
Energy: 1.49733756326091
Energy: 1.5977678151879153
Energy: 1.4973375632615322
Energy: 1.5977678151879153
Energy: 1.3093713562033162
Energy: 1.4081670710452998
Energy: 1.3093713562039382
Energy: 1.4081670710452998
Energy: 1.3093713562033162
Energy: 1.4081670710452998
Energy: 1.5548417246284518
Energy: 1.5786358563615044
Energy: 1.5548417246296955
Energy: 1.5786358563615044
Energy: 1.5548417246284518
Energy: 1.578635856362126
Energy: 1.3112759541408325
Energy: 1.564568694239668
Energy: 1.3112759541408325
Energy: 1.5645686942402897
Energy: 1.3112759541408325
Energy: 1.5645686942415336

minimum gb energy = 1.2889691818071358 eV
minimum distance =  2.26365408454131 Angstroms
sigma value = 27


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

Energy: 1.2812463975934503
Energy: 1.2424518651706669
Energy: 1.2812463975919268
Energy: 1.2424518651706669
Energy: 1.2812463975919268
Energy: 1.2424518651706669
Energy: 1.654552295362991
Energy: 1.286179951180743
Energy: 1.6545522953614675
Energy: 1.286179951180743
Energy: 1.654552295362991
Energy: 1.286179951180743
Energy: 1.3557312172031386
Energy: 1.433682042379368
Energy: 1.2056024506112875
Energy: 1.433682042379368
Energy: 1.3557312172031386
Energy: 1.433682042379368
Energy: 1.402981595874067
Energy: 1.2062024863083574
Energy: 1.4029815958725436
Energy: 1.2062024863083574
Energy: 1.402981595874067
Energy: 1.2062024863083574
Energy: 1.6451066588375762
Energy: 1.2066170783131882
Energy: 1.6451066588375762
Energy: 1.2066170783131882
Energy: 1.6451066588375762
Energy: 1.2066170783131882
Energy: 1.4408088887275987
Energy: 1.4977698475309156
Energy: 1.4408088887275987
Energy: 1.4977698475309156
Energy: 1.4408088887275987
Energy: 1.4977698475309156
Energy: 1.2076077012402733
Energy: 1.2884572761643147
Energy: 1.2076077012402733
Energy: 1.2884572761658382
Energy: 1.207607701241762
Energy: 1.2884572761643147
Energy: 1.2770706758649897
Energy: 1.248715472076419
Energy: 1.2770706758649897
Energy: 1.248715472076419
Energy: 1.2770706758649897
Energy: 1.248715472076419
Energy: 1.6196170319795125
Energy: 1.3263701713790563
Energy: 1.6196170319795125
Energy: 1.326370173708829
Energy: 1.6196170319795125
Energy: 1.3263701770587837
Energy: 1.3840896738554849
Energy: 1.4435641396074141
Energy: 1.3840896738554849
Energy: 1.4435641396074141
Energy: 1.3840896738539614
Energy: 1.4435641396074141
Energy: 1.3410481457488916
Energy: 1.2068511689805508
Energy: 1.341048145750415
Energy: 1.2068511689805508
Energy: 1.341048145750415
Energy: 1.2068511689805508
Energy: 1.4963496391987
Energy: 1.3663460497234934
Energy: 1.4963496391987
Energy: 1.3663460497234934
Energy: 1.4963496391987
Energy: 1.3663460497234934

minimum gb energy = 1.2056024506112875 eV
minimum distance =  2.24682132554867 Angstroms
sigma value = 9


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

Energy: 1.2423672965678152
Energy: 1.265918461391548
Energy: 1.2423672965669592
Energy: 1.26591846139112
Energy: 1.2423672965682433
Energy: 1.26591846139112
Energy: 1.2987379375261534
Energy: 1.1412618793462792
Energy: 1.2987379375265813
Energy: 1.2034478262679633
Energy: 1.2987379375244412
Energy: 1.2034478262671071
Energy: 1.1342949869404364
Energy: 1.348308027079815
Energy: 1.1342949869412928
Energy: 1.348308027080243
Energy: 1.1342949869404364
Energy: 1.3483080270793868
Energy: 1.1251214978096962
Energy: 1.0949358668941687
Energy: 1.1251214978101243
Energy: 1.094935866895453
Energy: 1.1251214978101243
Energy: 1.0949358668950246
Energy: 1.2230622388709653
Energy: 1.1708831178700256
Energy: 1.2230622388718213
Energy: 1.170883117869598
Energy: 1.2230622388713934
Energy: 1.1708831178700256
Energy: 1.2190450127172545
Energy: 1.2509001955759385
Energy: 1.2190450127189665
Energy: 1.2260976849019614
Energy: 1.2190450127185386
Energy: 1.2260976849023897
Energy: 1.1515287562082226
Energy: 1.2731959902651735
Energy: 1.1515287562086507
Energy: 1.2731959902656012
Energy: 1.1515287562069385
Energy: 1.2731959902647452
Energy: 1.0672375029903676
Energy: 1.3149145598183476
Energy: 1.0672375029912236
Energy: 1.3149145598183476
Energy: 1.0672375029912236
Energy: 1.3149145598179193
Energy: 1.2450773902395789
Energy: 1.1709938050963924
Energy: 1.2450773902370107
Energy: 1.1709938051002449
Energy: 1.2450773902382948
Energy: 1.1709938051006727
Energy: 1.2265851861910373
Energy: 1.5657880508629392
Energy: 1.2265851861918935
Energy: 1.565788050863367
Energy: 1.226585186190181
Energy: 1.5657880508629392
Energy: 1.1288535010678364
Energy: 1.1000232459644603
Energy: 1.1288535010678364
Energy: 1.1000232459640322
Energy: 1.1288535010669805
Energy: 1.1000232459644603
Energy: 1.1612450689895386
Energy: 1.3028139322028998
Energy: 1.1612450689891107
Energy: 1.3028139322003316
Energy: 1.1612450689895386
Energy: 1.3028139322020436
Energy: 1.1903236646300592
Energy: 1.2084490547820408
Energy: 1.1903236646309152
Energy: 1.2084490547820408
Energy: 1.1903236646304873
Energy: 1.2084490547820408
Energy: 1.238836340558872
Energy: 1.595144731680604
Energy: 1.238836340558016
Energy: 1.595144731679748
Energy: 1.238836340558872
Energy: 1.595144731679748
Energy: 1.1123490682351673
Energy: 1.2333132479704108
Energy: 1.1123490682351673
Energy: 1.2333132479708389
Energy: 1.1123490682360233
Energy: 1.2333132479695548
Energy: 1.1360739758178708
Energy: 1.1526094488922634
Energy: 1.1360739758182992
Energy: 1.1526094488918353
Energy: 1.1360739758174432
Energy: 1.1526094488918353
Energy: 1.451019341211854
Energy: 1.0945956230911058
Energy: 1.451019341211854
Energy: 1.0945956230911058
Energy: 1.451019341211854
Energy: 1.0945956230911058
Energy: 1.1241517598999164
Energy: 1.1721073905751507
Energy: 1.1241517599015896
Energy: 1.1721073905755786
Energy: 1.1241517599003445
Energy: 1.1721073905742947
Energy: 1.0633647845854675
Energy: 1.518715903377534
Energy: 1.0633647845850391
Energy: 1.518715903376678
Energy: 1.0633647845850391
Energy: 1.5187159033771058
Energy: 1.5630964894503967
Energy: 1.3472296210431347
Energy: 1.5630964894499684
Energy: 1.3771616333789967
Energy: 1.5630964894503967
Energy: 1.3771616333802807
Energy: 1.0633340119221846
Energy: 1.5265949244600063
Energy: 1.0633340119230408
Energy: 1.5265949244604342
Energy: 1.0633340119234687
Energy: 1.5265949244604342
Energy: 1.1243399936345315
Energy: 1.172280880165595
Energy: 1.1243399936349594
Energy: 1.1722808801647389
Energy: 1.1243399936323915
Energy: 1.172280880166023
Energy: 1.450753996306016
Energy: 1.0945066243037276
Energy: 1.450753996306872
Energy: 1.0945066243032997
Energy: 1.450753996306444
Energy: 1.0945066243041557
Energy: 1.1360493057626597
Energy: 1.2150241855119475
Energy: 1.1360493057622314
Energy: 1.2150241855115194
Energy: 1.1360493057635155
Energy: 1.2150241855115194
Energy: 1.1122969123831354
Energy: 1.2333371757736171
Energy: 1.1122969123831354
Energy: 1.2333371757731892
Energy: 1.1122969123827073
Energy: 1.233337175772761
Energy: 1.239156003342607
Energy: 1.3503508844251015
Energy: 1.239156003342179
Energy: 1.3503508844255294
Energy: 1.2391560033417508
Energy: 1.3503508844255294
Energy: 1.188793891844845
Energy: 1.2079909022799948
Energy: 1.188793891844417
Energy: 1.2079909022799948
Energy: 1.188793891844845
Energy: 1.207990902279567
Energy: 1.1613211970083008
Energy: 1.1786467229398854
Energy: 1.161321197008729
Energy: 1.1786467229398854
Energy: 1.1613211970078725
Energy: 1.1786467229403135
Energy: 1.1288307070976724
Energy: 1.0999401231952295
Energy: 1.1288307070976724
Energy: 1.0999401231948014
Energy: 1.1288307070981007
Energy: 1.0999401231952295
Energy: 1.2257378117069921
Energy: 1.3210198763088572
Energy: 1.2257378117065643
Energy: 1.3210198763092853
Energy: 1.2257378117065643
Energy: 1.3210198763092853
Energy: 1.245296394480731
Energy: 1.1715564960100573
Energy: 1.245296394479019
Energy: 1.1715564960109133
Energy: 1.245296394479019
Energy: 1.1715564960109133
Energy: 1.0673946372878977
Energy: 1.3149868418686612
Energy: 1.0673946372883256
Energy: 1.3149868418690889
Energy: 1.0673946372874699
Energy: 1.3149868418695172
Energy: 1.15172322955978
Energy: 1.2724616413092733
Energy: 1.151723229560208
Energy: 1.2724616413097012
Energy: 1.151723229560208
Energy: 1.2724616413101293
Energy: 1.2191844072108742
Energy: 1.219711886848265
Energy: 1.2191844072100184
Energy: 1.219711886848265
Energy: 1.2191844072117304
Energy: 1.219711886848265
Energy: 1.2230377266682753
Energy: 1.1712507949833153
Energy: 1.2230377266695593
Energy: 1.1712507949833153
Energy: 1.2230377266682753
Energy: 1.1712507949837436
Energy: 1.1251780096917856
Energy: 1.0947479764460046
Energy: 1.1251780096913575
Energy: 1.0947479764460046
Energy: 1.1251780096913575
Energy: 1.0947479764455765
Energy: 1.1343599052323456
Energy: 1.3482613854052652
Energy: 1.134359905232774
Energy: 1.3482613854061212
Energy: 1.1343599052314897
Energy: 1.3482613854069772
Energy: 1.2990176123694919
Energy: 1.1851374375352373
Energy: 1.2990176123686359
Energy: 1.1851374375339532
Energy: 1.2990176123699197
Energy: 1.1851374375352373
Energy: 1.242367296566531
Energy: 1.265918461391976
Energy: 1.242367296566531
Energy: 1.265918461391548
Energy: 1.242367296566103
Energy: 1.265918461391976
Energy: 1.2987379375231571
Energy: 1.2034478262671071
Energy: 1.2987379375252972
Energy: 1.2034478262671071
Energy: 1.2987379375261534
Energy: 1.2034478262671071
Energy: 1.1342949869408645
Energy: 1.3483080270913719
Energy: 1.134294986942577
Energy: 1.348308027080243
Energy: 1.1342949869421486
Energy: 1.3483080270772467
Energy: 1.1251214978118362
Energy: 1.0949358668967368
Energy: 1.1251214978105522
Energy: 1.094935866896309
Energy: 1.1251214978114086
Energy: 1.094935866896309
Energy: 1.2230622388709653
Energy: 1.1708831178691697
Energy: 1.2230622388713934
Energy: 1.1708831178700256
Energy: 1.2230622388705374
Energy: 1.1708831178687418

minimum gb energy = 1.0633340119221846 eV
minimum distance =  2.31332260944962 Angstroms
sigma value = 57


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

Energy: 0.683996647788897
Energy: 0.6733158490130267
Energy: 0.5358191613403178
Energy: 0.6733158490130267
Energy: 0.683996647788897
Energy: 0.6733158490110779
Energy: 0.8229071027191607
Energy: 0.6803688759224957
Energy: 0.822907102720135
Energy: 0.6803688759224957
Energy: 0.8229071027191607
Energy: 0.6803688759215213
Energy: 0.7298796476855438
Energy: 1.327087239329595
Energy: 0.7298796476855438
Energy: 1.3270872393286206
Energy: 0.7298796476855438
Energy: 1.3270872393286206
Energy: 0.6747417497754027
Energy: 0.5355039180341264
Energy: 0.6747417497773514
Energy: 0.5355039180341264
Energy: 0.6747417497754027
Energy: 0.5355039180351008
Energy: 0.6942116395066459
Energy: 0.8279428984591747
Energy: 0.6942116395066459
Energy: 0.8279428984611235
Energy: 0.6942116395076203
Energy: 0.8279428984611235
Energy: 0.5356698830862447
Energy: 0.7302565149650695
Energy: 0.5356698830862447
Energy: 0.7302565149650695
Energy: 0.5356698830852704
Energy: 0.7302565149650695
Energy: 0.5356808666073252
Energy: 0.6045861754411259
Energy: 0.5356808666073252
Energy: 0.6045861754411259
Energy: 0.5356808666082995
Energy: 0.6045861754430746
Energy: 0.8232860934092465
Energy: 0.7004566634546138
Energy: 0.8232860934072977
Energy: 0.7004566634546138
Energy: 0.8232860934092465
Energy: 0.7004566634555881
Energy: 0.674942637248587
Energy: 0.535502689260989
Energy: 0.674942637248587
Energy: 0.535502689260989
Energy: 0.6749426372476127
Energy: 0.5355026892619633
Energy: 0.6043860407236767
Energy: 0.8220009244638837
Energy: 0.6043860407227023
Energy: 0.8220009244638837
Energy: 0.6043860407227023
Energy: 0.8220009244638837
Energy: 0.6940490195237194
Energy: 0.8727749102823436
Energy: 0.6940490195227451
Energy: 0.8727749102803947
Energy: 0.6940490195237194
Energy: 0.8727749102813691
Energy: 0.683996647788897
Energy: 0.6733158490120522
Energy: 0.5358191613403178
Energy: 0.6733158490120522
Energy: 0.683996647788897
Energy: 0.6733158490110779
Energy: 0.8229071027181862
Energy: 0.6803688759224957
Energy: 0.8229071027191607
Energy: 0.6803688759224957
Energy: 0.8229071027191607
Energy: 0.6803688759215213
Energy: 0.7298796476865183
Energy: 1.3270872393286206
Energy: 0.7298796476865183
Energy: 1.3270872393276463
Energy: 0.7298796476865183
Energy: 1.3270872393286206
Energy: 0.6747417497754027
Energy: 0.5355039180331521
Energy: 0.674741749776377
Energy: 0.5355039180331521
Energy: 0.6747417497754027
Energy: 0.5355039180341264
Energy: 0.6942116395066459
Energy: 0.8279428984591747
Energy: 0.6942116395066459
Energy: 0.827942898460149
Energy: 0.6942116395076203
Energy: 0.8279428984611235
Energy: 0.5356698830862447
Energy: 0.7302565149650695
Energy: 0.5356698830872191
Energy: 0.7302565149650695
Energy: 0.5356698830862447
Energy: 0.7302565149640952
Energy: 0.5356808666073252
Energy: 0.6045861754411259
Energy: 0.5356808666073252
Energy: 0.6045861754411259
Energy: 0.5356808666073252
Energy: 0.6045861754411259
Energy: 0.8232860934092465
Energy: 0.7004566634555881
Energy: 0.8232860934072977
Energy: 0.7004566634555881
Energy: 0.8232860934092465
Energy: 0.7004566634555881

minimum gb energy = 0.535502689260989 eV
minimum distance =  2.40705823857883 Angstroms
sigma value = 11


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

Energy: 1.1103203183755113
Energy: 1.1657788715835877
Energy: 1.1103203183748624
Energy: 1.1657788715849502
Energy: 1.1103203183762254
Energy: 1.1657788715842365
Energy: 1.2645752509839554
Energy: 1.1553579983134568
Energy: 1.2645752509839554
Energy: 1.1553579983134568
Energy: 1.2645752509839554
Energy: 1.1553579983134568
Energy: 1.3225581710909038
Energy: 1.6244359708153684
Energy: 1.3791175648800313
Energy: 1.6244359708146545
Energy: 1.3426154336381309
Energy: 1.6244359708146545
Energy: 1.363521964048227
Energy: 0.9938105253607727
Energy: 1.3635219640489409
Energy: 0.9938105253600591
Energy: 1.363521964048227
Energy: 0.9938105253607727
Energy: 1.133518751570936
Energy: 0.936768761000766
Energy: 1.133518751570936
Energy: 0.936768761000766
Energy: 1.133518751570936
Energy: 0.936768761000766
Energy: 1.1233938753143318
Energy: 1.066351562034786
Energy: 1.1233938753150456
Energy: 1.066351562034786
Energy: 1.1233938753150456
Energy: 1.0663515620355002
Energy: 0.9658588885993554
Energy: 1.3350416892509285
Energy: 0.9658588885986416
Energy: 1.3350416892530694
Energy: 0.9658588886014966
Energy: 1.3350416892523558
Energy: 1.173512756535942
Energy: 0.9046754926410306
Energy: 1.173512756535942
Energy: 0.904675492640317
Energy: 1.173512756535942
Energy: 0.904675492640317
Energy: 1.1700452488700601
Energy: 0.9207122465272165
Energy: 1.1700452488700601
Energy: 0.9207122465272165
Energy: 1.1700452488700601
Energy: 0.9207122465279303
Energy: 0.9245509474802843
Energy: 1.442364287481747
Energy: 0.9245509474795707
Energy: 1.442364287481747
Energy: 0.9245509474802843
Energy: 1.442364287481747
Energy: 1.146704232298777
Energy: 1.4271228499144701
Energy: 1.1467042322994905
Energy: 1.4271228499144701
Energy: 1.1467042322994905
Energy: 1.4271228499144701
Energy: 1.1353859614340303
Energy: 0.9369313355328224
Energy: 1.1353859614333166
Energy: 0.9369313355328224
Energy: 1.1353859614340303
Energy: 0.9369313355328224
Energy: 1.2021762125497486
Energy: 0.9995364201429404
Energy: 1.2021762125497486
Energy: 0.9995364201422268
Energy: 1.2021762125497486
Energy: 0.9995364201436542
Energy: 1.2739958491524699
Energy: 1.5921216442976163
Energy: 1.2739958491517562
Energy: 1.59212164429833
Energy: 1.2739958491503287
Energy: 1.59212164429833
Energy: 1.2412738005636372
Energy: 1.154639595047983
Energy: 1.2412738005629236
Energy: 1.1546395950472692
Energy: 1.2412738005629236
Energy: 1.154639595047983
Energy: 1.021898317984709
Energy: 1.1659814383883773
Energy: 1.021898317985423
Energy: 1.1659814383883773
Energy: 1.021898317984709
Energy: 1.1659814383876637
Energy: 1.047585445093775
Energy: 1.1340577634059394
Energy: 1.0475854450944886
Energy: 1.1340577634059394
Energy: 1.0475854450944886
Energy: 1.1340577634059394
Energy: 1.4557410268486195
Energy: 1.5527342179254757
Energy: 1.4557410268486195
Energy: 1.5527342179254757
Energy: 1.4557410268486195
Energy: 1.552734217926903
Energy: 1.3588618696818542
Energy: 0.9894038667604148
Energy: 1.3588618696825676
Energy: 0.9894038667604148
Energy: 1.3588618696825676
Energy: 0.9894038667604148
Energy: 1.1349077275259079
Energy: 1.068411984803521
Energy: 1.1349077275266215
Energy: 1.0684119848042348
Energy: 1.1349077275266215
Energy: 1.068411984803521
Energy: 0.9261767423877653
Energy: 1.0677249894509568
Energy: 0.9261767423870514
Energy: 1.0677249894502432
Energy: 0.9261767423870514
Energy: 1.0677249894509568
Energy: 1.2213163669485845
Energy: 1.3354586366134986
Energy: 1.2213163669485845
Energy: 1.3354586366127847
Energy: 1.2213163669485845
Energy: 1.3354586366127847
Energy: 1.1967414023635392
Energy: 1.0929096457442573
Energy: 1.1967414023635392
Energy: 1.0929096457442573
Energy: 1.1967414023635392
Energy: 1.0929096457442573
Energy: 1.1706493223886174
Energy: 1.0342103364512096
Energy: 1.1706493223879035
Energy: 1.0342103364512096
Energy: 1.1706493223886174
Energy: 1.0342103364504958
Energy: 0.9260231905092517
Energy: 1.402505360055455
Energy: 0.9260231905099653
Energy: 1.402505360055455
Energy: 0.9260231905092517
Energy: 1.4025053600561683
Energy: 1.640251081726373
Energy: 1.429410897792669
Energy: 1.6402510817270868
Energy: 1.429410897792669
Energy: 1.640251081726373
Energy: 1.4294108977919555

minimum gb energy = 0.904675492640317 eV
minimum distance =  2.30017351810041 Angstroms
sigma value = 41


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

Energy: 1.2608392259205345
Energy: 1.0945718571396954
Energy: 1.2608392259216596
Energy: 1.0945718571396954
Energy: 1.2608392259210972
Energy: 1.0945718571402578
Energy: 1.3201179271572863
Energy: 1.3516587221544973
Energy: 1.3201179271572863
Energy: 1.3516587221539347
Energy: 1.3201179271567238
Energy: 1.3516587221544973
Energy: 1.6096942071596412
Energy: 1.845366086452195
Energy: 1.6096942071596412
Energy: 1.845366086452195
Energy: 1.6096942071602038
Energy: 1.845366086452195
Energy: 1.2771035757911127
Energy: 1.043492867605844
Energy: 1.2771035757899878
Energy: 1.0434928676064066
Energy: 1.27710357579055
Energy: 1.043492867605844
Energy: 1.0112211673218017
Energy: 1.0938356761825607
Energy: 1.0112211673218017
Energy: 1.093835676181998
Energy: 1.0112211673218017
Energy: 1.0938356761825607
Energy: 1.2930280447479265
Energy: 1.2763449754951175
Energy: 1.2930280447484892
Energy: 1.2763449754951175
Energy: 1.2930280447473639
Energy: 1.2763449754945548
Energy: 1.0516685517460627
Energy: 1.4399460651924394
Energy: 1.0516685517455
Energy: 1.4399460651924394
Energy: 1.0516685517455
Energy: 1.439946065191877
Energy: 1.0302579276776278
Energy: 1.0437865388009149
Energy: 1.0302579276765027
Energy: 1.0437865388009149
Energy: 1.0302579276776278
Energy: 1.0437865388014775
Energy: 1.0228079390578073
Energy: 1.0699077277914009
Energy: 1.0228079390578073
Energy: 1.0699077277914009
Energy: 1.02280793905837
Energy: 1.0699077277914009
Energy: 1.1313849889242948
Energy: 1.5633881625874746
Energy: 1.1313849889237322
Energy: 1.5633881625880368
Energy: 1.131384988922607
Energy: 1.5633881625880368
Energy: 1.1342233864803508
Energy: 1.558272703943169
Energy: 1.1342233864809135
Energy: 1.558272703943169
Energy: 1.134223386481476
Energy: 1.5582727039426063
Energy: 1.0329129878238617
Energy: 1.2167306636151203
Energy: 1.0329129878238617
Energy: 1.2167306636156827
Energy: 1.032912987824424
Energy: 1.2167306636151203
Energy: 1.0213724672494608
Energy: 1.0659610933146064
Energy: 1.0213724672500235
Energy: 1.0659610933146064
Energy: 1.0213724672494608
Energy: 1.0659610933140438
Energy: 0.9795514710554736
Energy: 1.4507941670003133
Energy: 0.979551471054911
Energy: 1.4507941670014386
Energy: 0.979551471054911
Energy: 1.4507941669997508
Energy: 1.2882970502057633
Energy: 1.2759606610455132
Energy: 1.2882970502057633
Energy: 1.2759606610460759
Energy: 1.2882970502063258
Energy: 1.2759606610455132
Energy: 1.0197454154581578
Energy: 1.2145676127827192
Energy: 1.0197454154575951
Energy: 1.2145676127821565
Energy: 1.0197454154581578
Energy: 1.2145676127821565
Energy: 1.0432805331899424
Energy: 1.066244503550112
Energy: 1.0432805331899424
Energy: 1.0662445035506747
Energy: 1.0432805331905048
Energy: 1.0662445035506747
Energy: 1.3717735512073712
Energy: 1.8446749294690918
Energy: 1.3717735512073712
Energy: 1.8446749294696545
Energy: 1.3717735512073712
Energy: 1.8446749294690918
Energy: 1.3547629947696538
Energy: 1.3472481147587971
Energy: 1.3547629947696538
Energy: 1.3472481147593596
Energy: 1.3547629947690913
Energy: 1.3472481147593596
Energy: 1.13151967953879
Energy: 1.3880051843675683
Energy: 1.13151967953879
Energy: 1.3880051843675683
Energy: 1.1315196795371023
Energy: 1.3880051843681307
Energy: 1.0236792097949767
Energy: 1.3534466290205418
Energy: 1.023679209794414
Energy: 1.3534466290211045
Energy: 1.0236792097949767
Energy: 1.3534466290211045
Energy: 1.6086427273894248
Energy: 1.675598894792197
Energy: 1.6086427273888622
Energy: 1.67559889479951
Energy: 1.6086427273888622
Energy: 1.6755988947989477
Energy: 1.2210710434922378
Energy: 1.0406925644195606
Energy: 1.2210710434916752
Energy: 1.0406925644195606
Energy: 1.2210710434928003
Energy: 1.040692564420123
Energy: 1.0196261664708115
Energy: 1.3819019037264988
Energy: 1.0196261664713742
Energy: 1.3819019037264988
Energy: 1.0196261664708115
Energy: 1.3819019037259361
Energy: 0.9797289887693005
Energy: 1.4262630000813141
Energy: 0.979728988769863
Energy: 1.4262630000813141
Energy: 0.9797289887693005
Energy: 1.4262630000813141
Energy: 1.0516966497624483
Energy: 1.0516462481685056
Energy: 1.0516966497613232
Energy: 1.0516462481685056
Energy: 1.0516966497613232
Energy: 1.0516462481685056
Energy: 1.0213283869135785
Energy: 1.041118905019888
Energy: 1.0213283869135785
Energy: 1.0411189050193252
Energy: 1.0213283869130163
Energy: 1.041118905019888
Energy: 1.0226020877780746
Energy: 1.3529741061427496
Energy: 1.022602087778637
Energy: 1.3529741061421872
Energy: 1.0226020877791995
Energy: 1.3529741061427496
Energy: 1.1315436425483263
Energy: 1.3860948908038337
Energy: 1.131543642548889
Energy: 1.386094890803271
Energy: 1.131543642548889
Energy: 1.3860948908038337
Energy: 1.242429713945817
Energy: 0.9786521815655556
Energy: 1.242429713945817
Energy: 0.9786521815655556
Energy: 1.2424297139469418
Energy: 0.9786521815655556
Energy: 1.0070346089007058
Energy: 1.2122531500845954
Energy: 1.0070346089007058
Energy: 1.212253150084033
Energy: 1.0070346089007058
Energy: 1.2122531500845954
Energy: 1.054772354763667
Energy: 1.0651529466664922
Energy: 1.0547723547631043
Energy: 1.0651529466664922
Energy: 1.0547723547631043
Energy: 1.0651529466664922
Energy: 0.9880609531002709
Energy: 1.2413181963826851
Energy: 0.9880609531002709
Energy: 1.2413181963821225
Energy: 0.9880609531002709
Energy: 1.2413181963826851

minimum gb energy = 0.9786521815655556 eV
minimum distance =  2.34074864665651 Angstroms
sigma value = 33


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

Energy: 1.1953400362864888
Energy: 1.1190347409590686
Energy: 1.1953400362869195
Energy: 1.1190347409587096
Energy: 1.1953400362872784
Energy: 1.1190347409590686
Energy: 1.2336118172721235
Energy: 1.0588737801912884
Energy: 1.2336118172725545
Energy: 1.0588737801912884
Energy: 1.233611817274923
Energy: 1.0588737801917194
Energy: 1.4657726398435864
Energy: 1.2979683575489576
Energy: 1.4657726398439455
Energy: 1.2979683575493883
Energy: 1.4657726398435864
Energy: 1.2979683575465888
Energy: 1.145256000919343
Energy: 1.0755212613226042
Energy: 1.145256000915395
Energy: 1.0755212613222451
Energy: 1.1452560009232908
Energy: 1.0755212613226042
Energy: 1.1079017565021878
Energy: 1.074765025794989
Energy: 1.107901756503767
Energy: 1.0747650257981474
Energy: 1.1079017565029774
Energy: 1.0747650257961376
Energy: 1.45591166584256
Energy: 1.1079562426804097
Energy: 1.4559116658429905
Energy: 1.1079562426811993
Energy: 1.455911665842201
Energy: 1.1079562426808405
Energy: 1.126595956168208
Energy: 1.2483897580757444
Energy: 1.126595956168567
Energy: 1.2483897580757444
Energy: 1.126595956168567
Energy: 1.2483897580741652
Energy: 1.1804168824869352
Energy: 1.2146626723177072
Energy: 1.1804168824881551
Energy: 1.2146626723169174
Energy: 1.1804168824869352
Energy: 1.2146626723172762
Energy: 1.1378022772617318
Energy: 1.1221153823261452
Energy: 1.1378022772593628
Energy: 1.1221153823261452
Energy: 1.1378022772601524
Energy: 1.1221153823261452
Energy: 1.5098367532126915
Energy: 1.097775422955328
Energy: 1.50983675321384
Energy: 1.097775422955328
Energy: 1.5098367532130503
Energy: 1.097775422955328
Energy: 1.1791412388602533
Energy: 1.180187535119815
Energy: 1.1791412388618328
Energy: 1.1801875351206046
Energy: 1.1791412388614737
Energy: 1.180187535119815
Energy: 1.6969509055717666
Energy: 1.0751924855992436
Energy: 1.6969509055717666
Energy: 1.0751924855988846
Energy: 1.6969509055725562
Energy: 1.0751924855988846
Energy: 1.128356242883041
Energy: 1.1405379808634217
Energy: 1.128356242882682
Energy: 1.1405379808685185
Energy: 1.128356242882682
Energy: 1.140537980865432
Energy: 1.2250565839918808
Energy: 1.1822274587941706
Energy: 1.225056583991522
Energy: 1.1822274587941706
Energy: 1.225056583991522
Energy: 1.1822274587941706
Energy: 1.2140461496816919
Energy: 1.1271113711575105
Energy: 1.2140461496828403
Energy: 1.1271113711575105
Energy: 1.2140461496820507
Energy: 1.1271113711579408
Energy: 1.1325730440968227
Energy: 1.4579872287892777
Energy: 1.1325730440980428
Energy: 1.4579872287892777
Energy: 1.1325730440972535
Energy: 1.4579872287889188
Energy: 1.4029992140670062
Energy: 1.103365140027329
Energy: 1.402999214051645
Energy: 1.103365140027329
Energy: 1.402999214059541
Energy: 1.1033651400276878
Energy: 1.0711182068020653
Energy: 1.1491795963901976
Energy: 1.0711182068036444
Energy: 1.1491795963901976
Energy: 1.0711182068016345
Energy: 1.1491795963897669
Energy: 1.5074351112783952
Energy: 1.4614737803070832
Energy: 1.507435111278826
Energy: 1.4614737803066529
Energy: 1.5074351112780364
Energy: 1.4614737803070832
Energy: 1.6794417970681077
Energy: 1.1261071687030615
Energy: 1.679441797066528
Energy: 1.1261071687027027
Energy: 1.6794417970673179
Energy: 1.126107168702272
Energy: 1.1151633033886033
Energy: 1.1958725970006188
Energy: 1.1151633033882444
Energy: 1.1958725970014084
Energy: 1.1151633033874548
Energy: 1.1958725970018391
Energy: 1.0559610476387036
Energy: 1.2391121261632874
Energy: 1.0559610476390624
Energy: 1.2391121261640772
Energy: 1.055961047639852
Energy: 1.2391121261632874
Energy: 1.214719048338867
Energy: 1.390465335443822
Energy: 1.214719048338867
Energy: 1.3904653354442527
Energy: 1.2147190483352777
Energy: 1.3904653354442527
Energy: 1.1044611240094055
Energy: 1.4376285342051542
Energy: 1.1044611240097642
Energy: 1.4376285342055133
Energy: 1.104461124010554
Energy: 1.4376285342055133
Energy: 1.0811759957547722
Energy: 1.1035922201221782
Energy: 1.0811759957378317
Energy: 1.103592220122537
Energy: 1.081175995748886
Energy: 1.1035922201217472
Energy: 1.1065291468657268
Energy: 1.455227871748898
Energy: 1.1065291468701055
Energy: 1.455227871748898
Energy: 1.1065291468724745
Energy: 1.455227871748898
Energy: 1.2349689595650388
Energy: 1.1295712025567701
Energy: 1.2349689595654696
Energy: 1.1295712025567701
Energy: 1.2349689595654696
Energy: 1.1295712025567701
Energy: 1.1906199094157737
Energy: 1.0820756900338284
Energy: 1.1906199094157737
Energy: 1.0820756900346178
Energy: 1.1906199094169942
Energy: 1.0820756900346178
Energy: 1.1237040626069317
Energy: 1.139291362827102
Energy: 1.1237040626077213
Energy: 1.1392913628267431
Energy: 1.1237040626085106
Energy: 1.1392913628299015
Energy: 1.0908433088230187
Energy: 1.507790160968249
Energy: 1.0908433088238083
Energy: 1.507790160967818
Energy: 1.0908433088233778
Energy: 1.507790160968249
Energy: 1.1465378780318567
Energy: 1.0705458612084497
Energy: 1.1465378780314974
Energy: 1.070545861208091
Energy: 1.146537878032646
Energy: 1.070545861208091
Energy: 1.104328774939884
Energy: 1.6989981796526517
Energy: 1.1043287749403146
Energy: 1.6989981796526517
Energy: 1.1043287749403146
Energy: 1.6989981796530105
Energy: 1.6804904411848245
Energy: 1.1307335187562086
Energy: 1.6804904411840351
Energy: 1.1307335187558496
Energy: 1.6804904411840351
Energy: 1.1307335187558496
Energy: 1.1786667615460422
Energy: 1.21661348042671
Energy: 1.178666761546473
Energy: 1.216613480426351
Energy: 1.1786667615460422
Energy: 1.21661348042671
Energy: 1.1784585711711957
Energy: 1.2166624724512525
Energy: 1.1784585711719853
Energy: 1.2166624724512525
Energy: 1.1784585711719853
Energy: 1.2166624724516832
Energy: 1.6801021308201074
Energy: 1.1307201894435708
Energy: 1.6801021308197488
Energy: 1.1307201894431402
Energy: 1.6801021308197488
Energy: 1.1307201894431402
Energy: 1.1044343562057573
Energy: 1.6989181152115798
Energy: 1.1044343562041783
Energy: 1.6989181152107906
Energy: 1.1044343562037475
Energy: 1.6989181152107906
Energy: 1.14698069380332
Energy: 1.070810590558726
Energy: 1.1469806938029612
Energy: 1.070810590558726
Energy: 1.14698069380332
Energy: 1.070810590558726
Energy: 1.0907819824157992
Energy: 1.5081433371557562
Energy: 1.0907819824150096
Energy: 1.5081433371557562
Energy: 1.090781982416158
Energy: 1.508143337152167
Energy: 1.1237738132030681
Energy: 1.1397460505530799
Energy: 1.1237738132030681
Energy: 1.1397460505522903
Energy: 1.1237738132030681
Energy: 1.1397460505562382
Energy: 1.1906378085644171
Energy: 1.0727306730371668
Energy: 1.1906378085659963
Energy: 1.0727306730371668
Energy: 1.1906378085652067
Energy: 1.0727306730368076
Energy: 1.2345935574479387
Energy: 1.1294849614101257
Energy: 1.2345935574479387
Energy: 1.1294849614097668
Energy: 1.2345935574482978
Energy: 1.129484961409336
Energy: 1.106400400001653
Energy: 1.4551173421568924
Energy: 1.1064004000012944
Energy: 1.455117342157323
Energy: 1.1064004000012944
Energy: 1.4551173421568924
Energy: 1.0743717027667457
Energy: 1.1035390352087313
Energy: 1.0743717027691146
Energy: 1.1035390352091619
Energy: 1.074371702767894
Energy: 1.1035390352099517
Energy: 1.1045152417438902
Energy: 1.4377276308359321
Energy: 1.104515241744249
Energy: 1.4377276308359321
Energy: 1.1045152417450386
Energy: 1.4377276308359321
Energy: 1.2150562219332168
Energy: 1.3901835717324929
Energy: 1.2150562219324272
Energy: 1.3901835717321342
Energy: 1.2150562219340064
Energy: 1.3901835717321342
Energy: 1.0562496246466488
Energy: 1.2384478552256388
Energy: 1.056249624646218
Energy: 1.2384478552264284
Energy: 1.0562496246470077
Energy: 1.2384478552264284

minimum gb energy = 1.0559610476387036 eV
minimum distance =  2.32304652196974 Angstroms
sigma value = 67


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

Energy: 1.18413302524111
Energy: 1.1175784911623616
Energy: 1.1841330252384716
Energy: 1.117578491159723
Energy: 1.18413302524111
Energy: 1.1175784911623616
Energy: 1.1047578110304048
Energy: 1.0850240258633297
Energy: 1.1047578110304048
Energy: 1.0850240258633297
Energy: 1.1047578110304048
Energy: 1.0850240258633297
Energy: 1.684108728126129
Energy: 1.4351986141201627
Energy: 1.684108728126129
Energy: 1.4351986141201627
Energy: 1.684108728126129
Energy: 1.4351986141201627
Energy: 1.1047965613088966
Energy: 1.085028848238978
Energy: 1.1047965613088966
Energy: 1.085028848238978
Energy: 1.1047965613088966
Energy: 1.085028848238978
Energy: 1.1841330252384716
Energy: 1.1175784911623616
Energy: 1.1841330252384716
Energy: 1.1175784911623616
Energy: 1.1841330252384716
Energy: 1.1175784911623616
Energy: 1.1047578110304048
Energy: 1.0850240258633297
Energy: 1.1047578110304048
Energy: 1.0850240258633297
Energy: 1.1047578110304048
Energy: 1.0850240258633297
Energy: 1.0598924273517483
Energy: 1.4351986141201627
Energy: 1.0598924273517483
Energy: 1.4351986141201627
Energy: 1.0598924273517483
Energy: 1.4351986141201627

minimum gb energy = 1.0598924273517483 eV
minimum distance =  2.34067812013278 Angstroms
sigma value = 3


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

Energy: 1.682344458989183
Energy: 1.2684345509039525
Energy: 1.682344458989183
Energy: 1.2684345509039525
Energy: 1.682344458989183
Energy: 1.2684345509039525
Energy: 1.3901412840575877
Energy: 1.2371428526216897
Energy: 1.3901412840575877
Energy: 1.237142852618099
Energy: 1.3901412840575877
Energy: 1.2371428526216897
Energy: 1.276675258777381
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Energy: 1.5562314057882574
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Energy: 1.6361700895849827
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Energy: 1.6361700895849827
Energy: 1.3604500780112612
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Energy: 1.2638153363176103
Energy: 1.4004348292435687
Energy: 1.2638153363176103
Energy: 1.4004348292435687
Energy: 1.2638153363212008
Energy: 1.4004348292435687
Energy: 1.711563640844487
Energy: 1.1899928492344563
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Energy: 1.1899928492344563
Energy: 1.244360317574472
Energy: 1.6688117406477982
Energy: 1.244360317574472
Energy: 1.6688117406477982
Energy: 1.244360317574472
Energy: 1.6688117406477982
Energy: 1.505463892795486
Energy: 1.2356627493216066
Energy: 1.505463892795486
Energy: 1.2356627493216066
Energy: 1.505463892795486
Energy: 1.2356627493216066
Energy: 1.6255546806738903
Energy: 1.318605596657063
Energy: 1.625554680677481
Energy: 1.318605596657063
Energy: 1.625554680677481
Energy: 1.318605596657063
Energy: 1.6341324348783886
Energy: 1.2654573701575693
Energy: 1.6341324348783886
Energy: 1.2654573701575693
Energy: 1.6341324348783886
Energy: 1.2654573701575693
Energy: 1.3284065087248977
Energy: 1.3954117507096369
Energy: 1.3284065087248977
Energy: 1.3954117507096369
Energy: 1.3284065087248977
Energy: 1.3954117507096369
Energy: 1.321881410268771
Energy: 1.2443114429256985
Energy: 1.3218814102651804
Energy: 1.2443114429256985
Energy: 1.3218814102651804
Energy: 1.2443114429256985
Energy: 1.2638857214665498
Energy: 1.4297884777073704
Energy: 1.2638857214701404
Energy: 1.4297884777073704
Energy: 1.2638857214665498
Energy: 1.4297884777073704
Energy: 1.470516488104194
Energy: 1.401643413247407
Energy: 1.470516488104194
Energy: 1.4016434132509974
Energy: 1.470516488104194
Energy: 1.401643413247407
Energy: 1.3611511518318724
Energy: 1.4628166541385506
Energy: 1.3611511518318724
Energy: 1.4628166541349596
Energy: 1.3611511518318724
Energy: 1.4628166541385506

minimum gb energy = 1.1833352181083834 eV
minimum distance =  2.27457473995229 Angstroms
sigma value = 81


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

Energy: 1.3885091462342634
Energy: 1.3288224457802642
Energy: 1.3212047838931333
Energy: 1.3288224457827285
Energy: 1.3885091462327848
Energy: 1.3288224457827285
Energy: 1.260770784230618
Energy: 1.4279302986823987
Energy: 1.2607707842291398
Energy: 1.4279302986823987
Energy: 1.2607707842291398
Energy: 1.4279302986823987
Energy: 1.611565271078782
Energy: 1.5549984628652789
Energy: 1.520028225367804
Energy: 1.5549984628647862
Energy: 1.6115652710807533
Energy: 1.5549984628638005
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Energy: 1.4554409833733115
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Energy: 1.4554409833738042
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Energy: 1.198502528585816
Energy: 1.3178378980966245
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Energy: 1.198502528583352
Energy: 1.2438295073709624
Energy: 1.1924314863522314
Energy: 1.2438295073689913
Energy: 1.1924314863546952
Energy: 1.243829507369977
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Energy: 1.2446630490282717
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Energy: 1.2151215174192496
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Energy: 1.1963871880005013
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Energy: 1.319253793891643
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Energy: 1.3419707962719487
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Energy: 1.3419707962734273
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Energy: 1.4695727619158716
Energy: 1.1962839408932682
Energy: 1.320978304042286
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Energy: 1.3209783040427787
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Energy: 1.2354082829403417
Energy: 1.1918394233781173
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Energy: 1.2584164690231323
Energy: 1.1712150655257652
Energy: 1.1916971973034125
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Energy: 1.258416469024118
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Energy: 1.333523455300796
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Energy: 1.333523455301289
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Energy: 1.4024460330151485
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Energy: 1.4024460330156412
Energy: 1.524619055912321
Energy: 1.1943245937963107
Energy: 1.6157615423300598
Energy: 1.1943245937968037
Energy: 1.6157615423285814
Energy: 1.1943245937968037
Energy: 1.6157615423285814
Energy: 1.231688875860964
Energy: 1.2740011496451757
Energy: 1.2316888758619498
Energy: 1.27400114964419
Energy: 1.2316888758619498
Energy: 1.2740011496471468
Energy: 1.3356266457711818
Energy: 1.1921146503127915
Energy: 1.3356266457721673
Energy: 1.1921146503137772
Energy: 1.3356266457736459
Energy: 1.1921146503137772
Energy: 1.3184443785418827
Energy: 1.2609281933968468
Energy: 1.3184886090354986
Energy: 1.2609281933988181
Energy: 1.318444378540897
Energy: 1.260928193399311
Energy: 1.5559540167171027
Energy: 1.214353774341954
Energy: 1.5559540167175954
Energy: 1.2143537743434323
Energy: 1.5559540167171027
Energy: 1.2143537743434323
Energy: 1.4556313300343033
Energy: 1.5967291625962818
Energy: 1.455631330034796
Energy: 1.5967291625977604
Energy: 1.4556313300343033
Energy: 1.5967291625987459
Energy: 1.195068632014073
Energy: 1.3324271634283438
Energy: 1.1950686320130874
Energy: 1.332427163427851
Energy: 1.1950686320130874
Energy: 1.332427163427851
Energy: 1.1922571419592607
Energy: 1.2444428322611418
Energy: 1.1922571419602461
Energy: 1.2444428322601562
Energy: 1.1922571419587678
Energy: 1.2444428322601562
Energy: 1.1948380558500649
Energy: 1.1698705930969129
Energy: 1.1948380558490792
Energy: 1.1698705930969129
Energy: 1.1948380558515432
Energy: 1.1698705930978985
Energy: 1.430449519177862
Energy: 1.7506463791741855
Energy: 1.4304447573036125
Energy: 1.7506463791736926
Energy: 1.4304495191768762
Energy: 1.7506463791741855
Energy: 1.4661028045641686
Energy: 1.4539096469513113
Energy: 1.4661028045621973
Energy: 1.4539096469488473
Energy: 1.466102804563183
Energy: 1.4539096469483546
Energy: 1.3184385667727379
Energy: 1.1953493450748112
Energy: 1.3184385667727379
Energy: 1.1953493450999444
Energy: 1.3184385667737235
Energy: 1.195349345061998
Energy: 1.2360961632716345
Energy: 1.1924491040845502
Energy: 1.2360961632716345
Energy: 1.1924491040865215
Energy: 1.2360961632721272
Energy: 1.1924491040870142

minimum gb energy = 1.1698705930969129 eV
minimum distance =  2.37058474207523 Angstroms
sigma value = 43


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

Energy: 1.5389347130912794
Energy: 1.2915879373169612
Energy: 1.5389347130918847
Energy: 1.2915879373169612
Energy: 1.5389347130918847
Energy: 1.291587937316356
Energy: 1.4275332929006697
Energy: 1.2248320966214485
Energy: 1.4275332929000641
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Energy: 1.4275332929000641
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Energy: 1.3717356702301906
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Energy: 1.3326070988667167
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Energy: 1.3788744763625604
Energy: 1.3203643391519353
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Energy: 1.4726276408928676
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Energy: 1.375871992404933
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Energy: 1.3758719924061436
Energy: 1.3886430611370095
Energy: 1.2261914067600808
Energy: 1.3886430611370095
Energy: 1.2261914067594755
Energy: 1.388643061136404
Energy: 1.2261914067594755
Energy: 1.503793405509763
Energy: 1.2962423243289958
Energy: 1.503793405509763
Energy: 1.2962423243302064
Energy: 1.503793405509763
Energy: 1.2962423243289958
Energy: 1.4569439797194164
Energy: 1.409813053689948
Energy: 1.4569439797194164
Energy: 1.409813053689948
Energy: 1.4569439797194164
Energy: 1.409813053689948
Energy: 1.3886155999754433
Energy: 1.4244616396617595
Energy: 1.3886155999748377
Energy: 1.4244616396617595
Energy: 1.3886155999748377
Energy: 1.4244616396617595
Energy: 1.2964981019895985
Energy: 1.4214295058587911
Energy: 1.2964981019889932
Energy: 1.4214295058587911
Energy: 1.2964981019895985
Energy: 1.4214295058593964
Energy: 1.463648465928132
Energy: 1.3522425221731607
Energy: 1.4636484659287372
Energy: 1.3522425221731607
Energy: 1.4636484659287372
Energy: 1.3522425221731607
Energy: 1.2032415215636525
Energy: 1.4522750685531898
Energy: 1.2032415215636525
Energy: 1.452275068553795
Energy: 1.2032415215636525
Energy: 1.4522750685525845
Energy: 1.3797336850232629
Energy: 1.486569445496454
Energy: 1.3797336850232629
Energy: 1.486569445496454
Energy: 1.3797336850238682
Energy: 1.486569445496454
Energy: 1.269261350889975
Energy: 1.272137685028015
Energy: 1.269261350889975
Energy: 1.272137685028015
Energy: 1.2692613508905803
Energy: 1.2721376850274098
Energy: 1.5446058908081721
Energy: 1.3688250494413523
Energy: 1.5446058908093825
Energy: 1.3688250494413523
Energy: 1.5446058908087772
Energy: 1.3688250494413523
Energy: 1.3257545505286878
Energy: 1.4301074609053785
Energy: 1.3257545505280826
Energy: 1.4301074609053785
Energy: 1.3257545505280826
Energy: 1.4301074609059838
Energy: 1.4352442814918107
Energy: 1.3204748803938913
Energy: 1.4352442814912054
Energy: 1.3204748803944966
Energy: 1.4352442814918107
Energy: 1.3204748803938913
Energy: 1.269012153052201
Energy: 1.3729470895601534
Energy: 1.269012153052201
Energy: 1.3729470895601534
Energy: 1.269012153052201
Energy: 1.3729470895601534
Energy: 1.3577244655945266
Energy: 1.389775648820292
Energy: 1.3577244655939213
Energy: 1.3897756488208974
Energy: 1.3577244655933158
Energy: 1.3897756488208974
Energy: 1.4001202458167492
Energy: 1.312722888008777
Energy: 1.4001202458167492
Energy: 1.312722888008777
Energy: 1.400120245816144
Energy: 1.3127228880081716

minimum gb energy = 1.2027042934624073 eV
minimum distance =  2.3210083825585 Angstroms
sigma value = 57


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

Energy: 1.4624179203970615
Energy: 1.2920601665241274
Energy: 1.3789019298512868
Energy: 1.2920601665233438
Energy: 1.4624179203986292
Energy: 1.2920601665233438
Energy: 1.4067351992736967
Energy: 1.2359980706394977
Energy: 1.4067351992736967
Energy: 1.2359980706402813
Energy: 1.4067351992744803
Energy: 1.2359980706402813
Energy: 1.493908093432813
Energy: 1.4566747386956012
Energy: 1.4351721850421488
Energy: 1.456674738696385
Energy: 1.493908093432813
Energy: 1.456674738696385
Energy: 1.680156794658293
Energy: 1.4083008246112698
Energy: 1.680156794658293
Energy: 1.4083008246104862
Energy: 1.6801567946590767
Energy: 1.4083008246097022
Energy: 1.7046143431307088
Energy: 1.3263615907620698
Energy: 1.7046143431314926
Energy: 1.326361590764421
Energy: 1.7046143431314926
Energy: 1.326361590764421
Energy: 1.4846890815098654
Energy: 1.3955594142950398
Energy: 1.4846890815090816
Energy: 1.3031406284315585
Energy: 1.4846890815098654
Energy: 1.3955594142966075
Energy: 1.450674364267078
Energy: 1.4946485329751693
Energy: 1.450674364267078
Energy: 1.4946485329751693
Energy: 1.450674364266294
Energy: 1.4946485329759533
Energy: 1.3797563278111367
Energy: 1.29337608048839
Energy: 1.3797563278126688
Energy: 1.2933760804891739
Energy: 1.379756327811885
Energy: 1.2933760804891739
Energy: 1.4571024565599169
Energy: 1.238720082384919
Energy: 1.457102456559133
Energy: 1.2387200823833513
Energy: 1.457102456559133
Energy: 1.2387200823833513
Energy: 1.2280818713205994
Energy: 1.3007849008063
Energy: 1.2280825300160776
Energy: 1.3007849008063
Energy: 1.2280818713198156
Energy: 1.3007849008063
Energy: 1.3547462103774253
Energy: 1.409656181589504
Energy: 1.3547462103774253
Energy: 1.409656181589504
Energy: 1.3547462103789931
Energy: 1.409656181589504
Energy: 1.5902469319120542
Energy: 1.5157517663820042
Energy: 1.5902469319104866
Energy: 1.5157517663835716
Energy: 1.5902469319112704
Energy: 1.5157517663835716
Energy: 1.4077776358656537
Energy: 1.2386573620461188
Energy: 1.4077776358648701
Energy: 1.2386573620461188
Energy: 1.4077776358656537
Energy: 1.2386573620469024
Energy: 1.447531433305935
Energy: 1.2446685934095305
Energy: 1.4598340566613806
Energy: 1.244668593411882
Energy: 1.4475314333067189
Energy: 1.2446685934110984
Energy: 1.449650462586018
Energy: 1.4008258277342325
Energy: 1.3428946386146239
Energy: 1.4008258277357999
Energy: 1.449650462585234
Energy: 1.4008258277357999
Energy: 1.4278971795049624
Energy: 1.3485512366174877
Energy: 1.4278971795041786
Energy: 1.34855123661592
Energy: 1.4278971795057465
Energy: 1.3485512366174877
Energy: 1.2276284852266908
Energy: 1.3019485619588982
Energy: 1.227688078626567
Energy: 1.3019485619604658
Energy: 1.2276284852282582
Energy: 1.3019485619612496
Energy: 1.352011763018994
Energy: 1.4272699838758993
Energy: 1.3520117630174262
Energy: 1.259472545644195
Energy: 1.3520117630174262
Energy: 1.4272699838751155
Energy: 1.2275872085273536
Energy: 1.3020043140439403
Energy: 1.2275872085273536
Energy: 1.3020043140431565
Energy: 1.2275872085273536
Energy: 1.3020043140439403
Energy: 1.4935626151206
Energy: 1.3484386448698351
Energy: 1.4935626151213837
Energy: 1.3484386448690513
Energy: 1.4935626151213837
Energy: 1.3484386448690513
Energy: 1.3424723048615057
Energy: 1.242008489352459
Energy: 1.3424723048607219
Energy: 1.242008489352459
Energy: 1.342472304859938
Energy: 1.242008489352459
Energy: 1.4596075035112301
Energy: 1.3583546951145884
Energy: 1.4596075035104463
Energy: 1.3583546951122372
Energy: 1.4596075035104463
Energy: 1.3583546951122372
Energy: 1.4919218102027008
Energy: 1.2353846924709329
Energy: 1.4922412485052157
Energy: 1.2353846924725005
Energy: 1.491921810201917
Energy: 1.2353846924725005
Energy: 1.5703622336382757
Energy: 1.465623636767516
Energy: 1.570409631879015
Energy: 1.465623636767516
Energy: 1.5703622336367085
Energy: 1.465623636767516

minimum gb energy = 1.2275872085273536 eV
minimum distance =  2.27138706616601 Angstroms
sigma value = 17


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

Energy: 1.6471130877062192
Energy: 1.1809196753452187
Energy: 1.6471130877062192
Energy: 1.1809196753452187
Energy: 1.6471130877062192
Energy: 1.1809196753441102
Energy: 1.320729838674365
Energy: 1.2746946828775385
Energy: 1.320729838674365
Energy: 1.27469468287643
Energy: 1.320729838674365
Energy: 1.2746946828775385
Energy: 1.2770626159822678
Energy: 1.3212476390413506
Energy: 1.2770626159822678
Energy: 1.3212476390413506
Energy: 1.2770626159822678
Energy: 1.3212476390413506
Energy: 1.316479381812718
Energy: 1.2838432334160461
Energy: 1.316479381812718
Energy: 1.2838432334160461
Energy: 1.316479381812718
Energy: 1.2838432334171546
Energy: 1.2984499436633041
Energy: 1.4715566762292385
Energy: 1.2984499436633041
Energy: 1.4715566762281298
Energy: 1.2984499436621957
Energy: 1.4715566762292385
Energy: 1.2079856029126146
Energy: 1.2825355421515174
Energy: 1.2079856029126146
Energy: 1.2825355421515174
Energy: 1.2079856029126146
Energy: 1.2825355421515174
Energy: 1.2774126744289458
Energy: 1.3301903663074952
Energy: 1.2774126744289458
Energy: 1.3301903663063868
Energy: 1.2774126744278376
Energy: 1.3301903663063868
Energy: 1.3165202358736716
Energy: 1.3047000814653948
Energy: 1.31652023587478
Energy: 1.3047000814653948
Energy: 1.31652023587478
Energy: 1.3047000814665033
Energy: 1.2447799476115797
Energy: 1.1255156226037586
Energy: 1.244779947612688
Energy: 1.1255156226026504
Energy: 1.244779947612688
Energy: 1.1255156226026504
Energy: 1.182446487522907
Energy: 1.2582787586405257
Energy: 1.182446487525124
Energy: 1.2582787586405257
Energy: 1.182446487522907
Energy: 1.2582787586394175
Energy: 1.2018159106297726
Energy: 1.2934267900610903
Energy: 1.201815910630881
Energy: 1.2934267900610903
Energy: 1.2018159106297726
Energy: 1.2934267900610903
Energy: 1.2623367951803837
Energy: 1.2557419476844132
Energy: 1.262336795181492
Energy: 1.2557419476833045
Energy: 1.262336795181492
Energy: 1.2557419476844132
Energy: 1.069349249095919
Energy: 1.2825900759438396
Energy: 1.069349249095919
Energy: 1.2825900759438396
Energy: 1.069349249095919
Energy: 1.2825900759438396
Energy: 1.2024249401703528
Energy: 1.2827732462680115
Energy: 1.2024249401703528
Energy: 1.2827732462680115
Energy: 1.2024249401703528
Energy: 1.2827732462680115
Energy: 1.207650436369934
Energy: 1.452677935687144
Energy: 1.2076504363688254
Energy: 1.452677935687144
Energy: 1.207650436369934
Energy: 1.452677935687144
Energy: 1.206983476323108
Energy: 1.4992536892512651
Energy: 1.2069834763220497
Energy: 1.4992536892656745
Energy: 1.206983476323108
Energy: 1.4992536892479902
Energy: 1.1996265781608781
Energy: 1.2826696099828383
Energy: 1.1996265781608781
Energy: 1.2826696099828383
Energy: 1.1996265781608781
Energy: 1.2826696099828383

minimum gb energy = 1.069349249095919 eV
minimum distance =  2.31537485837743 Angstroms
sigma value = 17


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

Energy: 1.1959301498383506
Energy: 1.068992070014369
Energy: 1.1959301498379225
Energy: 1.068992070014369
Energy: 1.1959301498392065
Energy: 1.068992070014369
Energy: 1.278441856352598
Energy: 1.1932881771672883
Energy: 1.278441856353454
Energy: 1.086765399009113
Energy: 1.2784418563538824
Energy: 1.1932881771698176
Energy: 1.186299087350194
Energy: 1.2130301904198035
Energy: 1.186299087350622
Energy: 1.2130301904189473
Energy: 1.186299087350194
Energy: 1.2130301904189473
Energy: 1.1138302438525378
Energy: 1.1831986997543518
Energy: 1.1138302438529657
Energy: 1.1831986997539237
Energy: 1.1138302438525378
Energy: 1.1831986997539237
Energy: 1.488873845430843
Energy: 1.196804480707444
Energy: 1.488873845430843
Energy: 1.196804480707016
Energy: 1.488873845430843
Energy: 1.1968044807078722
Energy: 1.1431797023252537
Energy: 1.120462173267217
Energy: 1.1431797023243975
Energy: 1.083475173136809
Energy: 1.1431797023252537
Energy: 1.1204621732659332
Energy: 1.0806768638862807
Energy: 1.0855039158566067
Energy: 1.0806768638875648
Energy: 1.0855039158544664
Energy: 1.0806768638931292
Energy: 1.0855039158578907
Energy: 1.3792089405422265
Energy: 1.3476616418495784
Energy: 1.3792089405430827
Energy: 1.3476616418495784
Energy: 1.3792089405417984
Energy: 1.3476616418491503
Energy: 1.1217320513831806
Energy: 1.1351393196572142
Energy: 1.1217320513827524
Energy: 1.135139319652506
Energy: 1.1217320513831806
Energy: 1.1351393196580704
Energy: 1.0821791548673347
Energy: 0.9831981754415084
Energy: 1.0821791548673347
Energy: 0.9831981754415084
Energy: 1.0821791548677626
Energy: 0.9831981754419367
Energy: 1.0012205977344881
Energy: 1.3187921046627973
Energy: 1.001220597733632
Energy: 1.3187921046636537
Energy: 1.001220597734916
Energy: 1.3187921046632254
Energy: 1.180969660041633
Energy: 1.2665565177241769
Energy: 1.1809696600429171
Energy: 1.2665565177241769
Energy: 1.1809696600420612
Energy: 1.2665565177241769
Energy: 1.265681654725219
Energy: 1.2404211077565197
Energy: 1.265681654725219
Energy: 1.2404211077560918
Energy: 1.2656816547247909
Energy: 1.2404211077565197
Energy: 1.2662190351456148
Energy: 1.196740751559766
Energy: 1.2662190351460427
Energy: 1.196740751559766
Energy: 1.2662190351460427
Energy: 1.196740751559766
Energy: 1.1652833191205894
Energy: 1.1658764517886946
Energy: 1.1652833191205894
Energy: 1.165876451790407
Energy: 1.1652833191210172
Energy: 1.1658764517886946
Energy: 1.2087841963739239
Energy: 1.2529845556761054
Energy: 1.2087841963726398
Energy: 1.2529845556761054
Energy: 1.208784196373068
Energy: 1.2529845556756776
Energy: 1.1009590843024366
Energy: 1.1300692330038777
Energy: 1.1009590843024366
Energy: 1.1300692330038777
Energy: 1.1009590843028647
Energy: 1.1300692330038777
Energy: 1.1438291223116421
Energy: 1.3716216544233273
Energy: 1.1438291223112143
Energy: 1.3716216544233273
Energy: 1.1438291223112143
Energy: 1.3716216544233273
Energy: 1.1066999897894376
Energy: 1.4911358223047995
Energy: 1.1066999897898655
Energy: 1.4911358223043714
Energy: 1.1066999897894376
Energy: 1.4911358223043714
Energy: 1.1000810464426434
Energy: 0.9842283992182128
Energy: 1.1000810464434994
Energy: 0.9842283992173567
Energy: 1.1000810464426434
Energy: 0.9842283992173567
Energy: 1.106814859413641
Energy: 1.4907934307650013
Energy: 1.106814859413641
Energy: 1.4907934307654294
Energy: 1.106814859413641
Energy: 1.4907934307658577
Energy: 1.1440035346519744
Energy: 1.3716384139884028
Energy: 1.1440035346519744
Energy: 1.3716384139884028
Energy: 1.1440035346519744
Energy: 1.3716384139884028
Energy: 1.1009655765983517
Energy: 1.130055633652827
Energy: 1.1009655765987798
Energy: 1.130055633652399
Energy: 1.1009655765983517
Energy: 1.130055633652827
Energy: 1.208774216216137
Energy: 1.2062793156217115
Energy: 1.208774216216993
Energy: 1.2062793156225677
Energy: 1.208774216215281
Energy: 1.2062793156221396
Energy: 1.165253591999195
Energy: 1.1737348975960527
Energy: 1.165253592000051
Energy: 1.173734897595197
Energy: 1.1652535920004792
Energy: 1.173734897596481
Energy: 1.2662383886803237
Energy: 1.2020374441535722
Energy: 1.2662383886798956
Energy: 1.2020374441535722
Energy: 1.2662383886803237
Energy: 1.2020374441535722
Energy: 1.2674189173601988
Energy: 1.2402552127376187
Energy: 1.2674189173597707
Energy: 1.2402552127371909
Energy: 1.2674189173597707
Energy: 1.2402552127376187
Energy: 1.1903180751748963
Energy: 1.2666862812335986
Energy: 1.1903180751761804
Energy: 1.2666862812327426
Energy: 1.190318075175324
Energy: 1.2666862812323147
Energy: 1.0012261156354358
Energy: 1.3189578438751006
Energy: 1.0012261156401443
Energy: 1.3189578438755287
Energy: 1.0012261156380042
Energy: 1.3189578438755287
Energy: 1.081790475027922
Energy: 0.9833093070529904
Energy: 1.08179047502835
Energy: 0.9833093070521343
Energy: 1.0817904750287781
Energy: 0.9833093070521343
Energy: 1.1222438962743408
Energy: 1.1354474317872012
Energy: 1.122243896275625
Energy: 1.135447431788057
Energy: 1.1222438962751968
Energy: 1.1354474317893413
Energy: 1.379312473463274
Energy: 1.3476178569613817
Energy: 1.379312473463274
Energy: 1.3476178569613817
Energy: 1.379312473463702
Energy: 1.3476178569613817
Energy: 1.0804264647109043
Energy: 1.0852920965959325
Energy: 1.0804264647087645
Energy: 1.0852920965959325
Energy: 1.0804264647096202
Energy: 1.0852920965950765
Energy: 1.1432060508337873
Energy: 1.0478187810135737
Energy: 1.1432060508346433
Energy: 1.0478187810140018
Energy: 1.1432060508346433
Energy: 1.0478187810144297
Energy: 1.4890890262000305
Energy: 1.1968309281030691
Energy: 1.4890890262000305
Energy: 1.1968309281030691
Energy: 1.4890890261996024
Energy: 1.1968309281030691
Energy: 1.1140176150477281
Energy: 1.1489587847996772
Energy: 1.1140176150494405
Energy: 1.148958784797537
Energy: 1.1140176150490124
Energy: 1.1489587847971092
Energy: 1.1864395328621227
Energy: 1.2131249691663348
Energy: 1.1864395328629789
Energy: 1.2131249691727553
Energy: 1.1864395328625505
Energy: 1.2131249691667627
Energy: 1.2786476776390743
Energy: 1.047802495878045
Energy: 1.2786476776390743
Energy: 1.0478024958767609
Energy: 1.2786476776390743
Energy: 1.0478024958763328
Energy: 1.1959301498374946
Energy: 1.068992070014797
Energy: 1.1959301498366384
Energy: 1.0689920700152251
Energy: 1.1959301498374946
Energy: 1.068992070014797
Energy: 1.278441856353454
Energy: 1.2501999023111763
Energy: 1.2784418563547384
Energy: 1.2501999023107482
Energy: 1.2784418563547384
Energy: 1.2501999023111763
Energy: 1.1862990873489099
Energy: 1.2130301904180916
Energy: 1.1862990873484818
Energy: 1.2130301904180916
Energy: 1.186299087349338
Energy: 1.2130301904185194
Energy: 1.113830243855962
Energy: 1.1299339372192383
Energy: 1.1138302438563898
Energy: 1.1299339372192383
Energy: 1.1138302438568182
Energy: 1.1299339372192383
Energy: 1.488873845431271
Energy: 1.1968044807087281
Energy: 1.488873845431271
Energy: 1.1968044807087281
Energy: 1.488873845431271
Energy: 1.1968044807095843

minimum gb energy = 0.9831981754415084 eV
minimum distance =  2.27574401229352 Angstroms
sigma value = 57


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

Energy: 1.0984394696729687
Energy: 0.9885238577690654
Energy: 1.0984394696722717
Energy: 0.9885238577690654
Energy: 1.0984394696743627
Energy: 0.9885238577697621
Energy: 1.1345665478012064
Energy: 1.1310489994390005
Energy: 1.1345665478005096
Energy: 1.1310489994390005
Energy: 1.1345665477998124
Energy: 1.1310489994390005
Energy: 1.1443348718590367
Energy: 1.1309498861452751
Energy: 1.1443348718618245
Energy: 1.1309498861445784
Energy: 1.1443348718625215
Energy: 1.1309498861445784
Energy: 1.1425802091709645
Energy: 1.074310708519652
Energy: 1.1425802091674795
Energy: 1.074310708520349
Energy: 1.1425802091709645
Energy: 1.0743107085182582
Energy: 1.3295907900301132
Energy: 1.1011805764443758
Energy: 1.3295907900301132
Energy: 1.1011805764436788
Energy: 1.3295907900301132
Energy: 1.1011805764450728
Energy: 1.0718400844347362
Energy: 0.974547730442459
Energy: 1.0718400844354334
Energy: 0.9745477304417621
Energy: 1.0718400844340394
Energy: 0.9745477304417621
Energy: 1.2720750780538022
Energy: 1.0437633985032597
Energy: 1.2720750780538022
Energy: 1.0437633985032597
Energy: 1.2720750780531052
Energy: 1.0437633985032597
Energy: 1.2572462708586958
Energy: 1.2609391596958806
Energy: 1.2572462708600898
Energy: 1.2609391596958806
Energy: 1.2572462708600898
Energy: 1.2609391596951838
Energy: 0.9912090102298118
Energy: 0.9763579049115388
Energy: 0.9912090102291147
Energy: 0.976357904910842
Energy: 0.9912090102291147
Energy: 0.976357904912236
Energy: 1.1225230670737552
Energy: 1.0069815243570126
Energy: 1.1225230670730582
Energy: 1.0069815243577096
Energy: 1.1225230670730582
Energy: 1.0069815243570126
Energy: 1.275067270559014
Energy: 1.2729833439773046
Energy: 1.2750672705583168
Energy: 1.2729833439766074
Energy: 1.27506727055762
Energy: 1.2729833439766074
Energy: 1.0295290677633862
Energy: 1.2671403535145402
Energy: 1.0295290677619922
Energy: 1.2671403535145402
Energy: 1.0295290677626892
Energy: 1.2671403535145402
Energy: 1.1223897622672272
Energy: 1.137770631830404
Energy: 1.1223897622672272
Energy: 1.137770631830404
Energy: 1.1223897622672272
Energy: 1.137770631830404
Energy: 1.267618925228683
Energy: 1.1494118337483137
Energy: 1.267618925228683
Energy: 1.1494118337462227
Energy: 1.267618925227986
Energy: 1.14941183374692
Energy: 1.100200995466314
Energy: 1.1825656179564428
Energy: 1.100200995465617
Energy: 1.182565617955746
Energy: 1.100200995465617
Energy: 1.182565617955746
Energy: 1.1571501861597657
Energy: 1.15015695432028
Energy: 1.1571501861597657
Energy: 1.150156954319583
Energy: 1.1571501861604625
Energy: 1.15015695432028
Energy: 1.1747364327432284
Energy: 1.1282063932708921
Energy: 1.1747364327425316
Energy: 1.1282063932708921
Energy: 1.1747364327418346
Energy: 1.1282063932708921
Energy: 1.1892307290135251
Energy: 1.1853733843550067
Energy: 1.189230729014222
Energy: 1.1853733843550067
Energy: 1.189230729014222
Energy: 1.1853733843550067
Energy: 1.1279088070142187
Energy: 1.1765160344938734
Energy: 1.1279088070142187
Energy: 1.1765160344938734
Energy: 1.1279088070142187
Energy: 1.1765160344938734
Energy: 1.129721805478163
Energy: 1.0756139108313023
Energy: 1.1297218054788598
Energy: 1.0756139108313023
Energy: 1.129721805478163
Energy: 1.0756139108313023
Energy: 1.0797687069502995
Energy: 1.2674096454060182
Energy: 1.0797687069502995
Energy: 1.2674096454060182
Energy: 1.0797687069516932
Energy: 1.2674096454067152
Energy: 0.9284604302892897
Energy: 1.3644847622467116
Energy: 0.9284604302913805
Energy: 1.3644847622460146
Energy: 0.9284604302892897
Energy: 1.3644847622460146
Energy: 1.0173606448640224
Energy: 1.0288204937675833
Energy: 1.0173606448633254
Energy: 1.0288204937682803
Energy: 1.0173606448647194
Energy: 1.0288204937675833
Energy: 1.0170045473711593
Energy: 1.3843072468923456
Energy: 1.0170045473697655
Energy: 1.3843072468923456
Energy: 1.0170045473697655
Energy: 1.3843072468916486
Energy: 1.2118705918400376
Energy: 1.2744965056208606
Energy: 1.2118705918400376
Energy: 1.2744965056208606
Energy: 1.2118705918407346
Energy: 1.2744965056201636
Energy: 0.9905901057113362
Energy: 1.0281216496850911
Energy: 0.9905901057127299
Energy: 1.0281216496850911
Energy: 0.990590105712033
Energy: 1.0281216496850911
Energy: 0.9281207105820843
Energy: 1.1764299795601423
Energy: 0.9281207105813873
Energy: 1.176429979561536
Energy: 0.9281207105827812
Energy: 1.1764299795594453

minimum gb energy = 0.9281207105813873 eV
minimum distance =  2.28416199191738 Angstroms
sigma value = 43


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

Energy: 1.2068137681450273
Energy: 0.8942641586954505
Energy: 1.2068137681445195
Energy: 0.8942641586954505
Energy: 1.2068137681445195
Energy: 0.8942641586959583
Energy: 0.9806729528158784
Energy: 1.026698624187753
Energy: 0.9806729528158784
Energy: 1.0266986241872451
Energy: 0.9806729528168942
Energy: 1.026698624187753
Energy: 0.9672184038289608
Energy: 1.0267402065326796
Energy: 0.9672184038289608
Energy: 1.0267402065321718
Energy: 0.9672184038294686
Energy: 1.0267402065326796
Energy: 1.1486540963934244
Energy: 0.9415280996828898
Energy: 1.14865409639444
Energy: 0.9415280996828898
Energy: 1.1486540963939322
Energy: 0.9415280996823818
Energy: 1.1234304559029193
Energy: 0.9819107653262066
Energy: 1.1234304559034272
Energy: 0.9819107653267145
Energy: 1.1234304559029193
Energy: 0.9819107653272222
Energy: 0.9304725747948198
Energy: 0.9792779783752872
Energy: 0.9304725747948198
Energy: 0.979277978375795
Energy: 0.9304725747943121
Energy: 0.9792779783752872
Energy: 1.111156132218547
Energy: 1.0219144246662328
Energy: 1.111156132218547
Energy: 1.0219144246662328
Energy: 1.111156132218547
Energy: 1.0219144246657248
Energy: 1.1685613045738052
Energy: 1.0755035957303507
Energy: 1.1685613045732974
Energy: 1.0755035957308585
Energy: 1.1685613045727894
Energy: 1.0755035957303507
Energy: 0.8806055662291743
Energy: 0.968525692685381
Energy: 0.880605566229682
Energy: 0.968525692685381
Energy: 0.880605566229682
Energy: 0.968525692685381
Energy: 0.9864099124773791
Energy: 0.8673565309503346
Energy: 0.9864099124773791
Energy: 0.8673565309513501
Energy: 0.9864099124778868
Energy: 0.8673565309503346
Energy: 1.1007929412313424
Energy: 1.0670588734524655
Energy: 1.1007929412313424
Energy: 1.0670588734529733
Energy: 1.1007929412308344
Energy: 1.0670588734529733
Energy: 0.8426822673259592
Energy: 0.9670370972753197
Energy: 0.8426822673264671
Energy: 0.967037097274812
Energy: 0.8426822673269748
Energy: 0.9670370972753197
Energy: 0.9859955543014973
Energy: 0.8317821503212796
Energy: 0.9859955543009896
Energy: 0.8317821503212796
Energy: 0.9859955543014973
Energy: 0.8317821503212796
Energy: 1.0715450575894525
Energy: 1.0689898715066037
Energy: 1.07154505758996
Energy: 1.0689898715066037
Energy: 1.0715450575894525
Energy: 1.068989871506096
Energy: 0.8626896204521558
Energy: 0.9669061832402989
Energy: 0.8626896204511401
Energy: 0.9669061832397912
Energy: 0.8626896204496167
Energy: 0.9669061832408066
Energy: 1.008589686761132
Energy: 0.9202933157709037
Energy: 1.0085896867601163
Energy: 0.9202933157709037
Energy: 1.008589686761132
Energy: 0.9202933157709037
Energy: 1.1075136370366467
Energy: 1.1193179844321437
Energy: 1.1075136370366467
Energy: 1.1193179844326515
Energy: 1.107513637036139
Energy: 1.1193179844321437
Energy: 0.8937569110085227
Energy: 1.0963823778742097
Energy: 0.8937569110090304
Energy: 1.0963823778742097
Energy: 0.893756911008015
Energy: 1.0963823778742097
Energy: 0.9775530541442208
Energy: 0.9656255962759164
Energy: 0.9775530541447286
Energy: 0.9656255962759164
Energy: 0.9775530541442208
Energy: 0.9656255962759164
Energy: 1.1398751891921373
Energy: 1.1107184393723977
Energy: 1.1398751891921373
Energy: 1.1107184393713823
Energy: 1.1398751891921373
Energy: 1.1107184393718899
Energy: 0.9594485154758503
Energy: 1.159037857690491
Energy: 0.9594485154768658
Energy: 1.1590378576899831
Energy: 0.9594485154758503
Energy: 1.159037857690491
Energy: 1.0377055976719023
Energy: 1.01664813592119
Energy: 1.0377055976719023
Energy: 1.0166481359216977
Energy: 1.0377055976719023
Energy: 1.01664813592119
Energy: 1.1668623444713455
Energy: 0.9738210169706648
Energy: 1.1668623444713455
Energy: 0.9738210169706648
Energy: 1.1668623444713455
Energy: 0.9738210169706648
Energy: 1.0236500398842343
Energy: 1.1595228960323951
Energy: 1.0236500398857575
Energy: 1.1595228960323951
Energy: 1.023650039884742
Energy: 1.159522896031887
Energy: 0.980991684736157
Energy: 1.0252803388120852
Energy: 0.980991684736157
Energy: 1.0252803388115774
Energy: 0.980991684736157
Energy: 1.0252803388120852
Energy: 0.9807375952569943
Energy: 0.9429924678812783
Energy: 0.9807375952569943
Energy: 0.9429924678812783
Energy: 0.9807375952569943
Energy: 0.9429924678812783
Energy: 0.9447327779746507
Energy: 1.1099257142242505
Energy: 0.9282609613977307
Energy: 1.1099257142242505
Energy: 0.9282609613977307
Energy: 1.1099257142242505
Energy: 0.9489148150839004
Energy: 0.9512287167943068
Energy: 0.9489148150844083
Energy: 0.951228716793799
Energy: 0.9489148150839004
Energy: 0.951228716793799
Energy: 0.8599328606568941
Energy: 0.8844156963628002
Energy: 0.8599328606563864
Energy: 0.8844156963628002
Energy: 0.8599328606574018
Energy: 0.8844156963628002
Energy: 0.8627198743536681
Energy: 1.0820066542664069
Energy: 0.862719874354176
Energy: 1.082006654265899
Energy: 0.8627198743526527
Energy: 1.0820066542669147
Energy: 0.9373919213740542
Energy: 1.1673930749761963
Energy: 0.93739192137507
Energy: 1.1673930749761963
Energy: 0.937391921374562
Energy: 1.1673930749761963
Energy: 0.9598324599114274
Energy: 0.8570821663025262
Energy: 0.9598324599109197
Energy: 0.8570821663025262
Energy: 0.9598324599104119
Energy: 0.8570821663025262
Energy: 0.8391902665047297
Energy: 1.1981900764132758
Energy: 0.8391902665047297
Energy: 1.1981900764132758
Energy: 0.8391902665042218
Energy: 1.1981900764132758
Energy: 1.0786196236488295
Energy: 1.0687836810431395
Energy: 1.0786196236493373
Energy: 1.0687836810436473
Energy: 1.0786196236493373
Energy: 1.0687836810436473
Energy: 0.9587405730061141
Energy: 0.9517630893597513
Energy: 0.9587405730066222
Energy: 0.9517630893592436
Energy: 0.9587405730061141
Energy: 0.9517630893592436
Energy: 0.7756117379214786
Energy: 0.9562038574779245
Energy: 0.7756117379214786
Energy: 0.9562038574784323
Energy: 0.7756117379230021
Energy: 0.9562038574784323

minimum gb energy = 0.7756117379214786 eV
minimum distance =  2.28606598587845 Angstroms
sigma value = 81


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

Energy: 0.3451360582076758
Energy: 0.40141339725249514
Energy: 0.08155698886088807
Energy: 0.40141339725249514
Energy: 0.3451360582076758
Energy: 0.40141339725249514
Energy: 0.958153674431011
Energy: 0.08318964527505028
Energy: 0.958153674431011
Energy: 0.08318964525079545
Energy: 0.958153674431011
Energy: 0.08318964527691602
Energy: 0.894543683521563
Energy: 0.0821981417419303
Energy: 0.894543683521563
Energy: 0.0821981417419303
Energy: 0.894543683521563
Energy: 0.0821981417419303
Energy: 0.08155698886275381
Energy: 0.40141339725249514
Energy: 0.08155698886275381
Energy: 0.40141339725249514
Energy: 0.08155698886275381
Energy: 0.40141339725249514
Energy: 0.958153674431011
Energy: 0.08318964426241117
Energy: 0.958153674431011
Energy: 0.08318964419710971
Energy: 0.958153674431011
Energy: 0.08318964412438763
Energy: 0.8945436835234287
Energy: 0.0821981417419303
Energy: 0.894543683521563
Energy: 0.0821981417419303
Energy: 0.8945436835234287
Energy: 0.08219814174006454
Energy: 0.3451360582076758
Energy: 0.40141339725249514
Energy: 0.08155698886088807
Energy: 0.40141339725249514
Energy: 0.3451360582076758
Energy: 0.40141339725249514
Energy: 0.958153674431011
Energy: 0.08318964379245265
Energy: 0.958153674431011
Energy: 0.0831896436637579
Energy: 0.958153674431011
Energy: 0.08318964382226236
Energy: 0.894543683521563
Energy: 0.0821981417419303
Energy: 0.894543683521563
Energy: 0.0821981417419303
Energy: 0.894543683521563
Energy: 0.08219814174006454
Energy: 0.08155698886088807
Energy: 0.40141339725249514
Energy: 0.08155698886088807
Energy: 0.40141339725249514
Energy: 0.08155698886088807
Energy: 0.4014133972543609

minimum gb energy = 0.08155698886088807 eV
minimum distance =  2.45873632585677 Angstroms
sigma value = 3


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

Energy: 1.0664306383937276
Energy: 0.8845347475950056
Energy: 1.0664306383937276
Energy: 0.8845347475950056
Energy: 1.0664306383942859
Energy: 0.8845347475944473
Energy: 0.8868783109182007
Energy: 1.0229934932283256
Energy: 0.8868783109187591
Energy: 1.0229934932283256
Energy: 0.8868783109182007
Energy: 1.022993493228884
Energy: 0.9751513861813471
Energy: 0.9950244072127948
Energy: 0.975151386180789
Energy: 0.9950244072122365
Energy: 0.9751513861813471
Energy: 0.9950244072127948
Energy: 0.9983648093567633
Energy: 0.9360873390115579
Energy: 0.9983648093573215
Energy: 0.9360873390121164
Energy: 0.9983648093573215
Energy: 0.9360873390121164
Energy: 0.7760994093263264
Energy: 1.0051500036191394
Energy: 0.776099409325768
Energy: 1.0051500036191394
Energy: 0.776099409327443
Energy: 1.0051500036196976
Energy: 0.9249882459963514
Energy: 0.9693833022779383
Energy: 0.9249882459969099
Energy: 0.9693833022779383
Energy: 0.9249882459963514
Energy: 0.9693833022779383
Energy: 0.9545311630721114
Energy: 0.9927707064801996
Energy: 0.9545311630715531
Energy: 0.9927707064801996
Energy: 0.9545311630715531
Energy: 0.9927707064796413
Energy: 0.7695803812480356
Energy: 0.9096737863141446
Energy: 0.7695803812485937
Energy: 0.9096737863119114
Energy: 0.7695803812480356
Energy: 0.9096737863113531
Energy: 0.9534455738621195
Energy: 0.9669952135285574
Energy: 0.9534455738621195
Energy: 0.9669952135291155
Energy: 0.9534455738621195
Energy: 0.9669952135291155
Energy: 0.9709956249166272
Energy: 0.9444924177641421
Energy: 0.9709956249171854
Energy: 0.9444924177641421
Energy: 0.9709956249171854
Energy: 0.9444924177641421
Energy: 0.843733618553942
Energy: 0.906500206836322
Energy: 0.8437336185533836
Energy: 0.9065002068357637
Energy: 0.8437336185528252
Energy: 0.906500206836322
Energy: 0.9805900664256336
Energy: 0.9762435135315801
Energy: 0.980590066426192
Energy: 0.9762435135315801
Energy: 0.980590066426192
Energy: 0.9762435135315801
Energy: 0.9614234117061503
Energy: 0.7728441932472171
Energy: 0.9614234117067086
Energy: 0.7728441932477754
Energy: 0.9614234117067086
Energy: 0.7728441932466589
Energy: 0.876800552210401
Energy: 0.9560583682148848
Energy: 0.876800552210401
Energy: 0.9560583682148848
Energy: 0.8768005522098428
Energy: 0.9560583682154431
Energy: 0.9590916995974302
Energy: 0.9439095160036998
Energy: 0.9590916995974302
Energy: 0.943909516002583
Energy: 0.9590916995974302
Energy: 0.9439095160020248
Energy: 0.9750298616101305
Energy: 0.7736175030532729
Energy: 0.9750298616095722
Energy: 0.7736175030527146
Energy: 0.9750298616095722
Energy: 0.7736175030532729
Energy: 0.9736933465785023
Energy: 0.9859542056866422
Energy: 0.9736933465785023
Energy: 0.9859542056866422
Energy: 0.973693346577944
Energy: 0.9859542056866422
Energy: 0.9870940504639519
Energy: 0.9167272318117425
Energy: 0.9870940504639519
Energy: 0.9167272318117425
Energy: 0.9870940504639519
Energy: 0.9167272318117425
Energy: 0.987095301522175
Energy: 0.8747070078594466
Energy: 0.987095301522175
Energy: 0.874707007860563
Energy: 0.987095301522175
Energy: 0.8747070078600048
Energy: 0.9035346553095337
Energy: 1.04392419055794
Energy: 0.9035346553095337
Energy: 1.043924190558498
Energy: 0.9035346553095337
Energy: 1.043924190558498
Energy: 0.9779108443236602
Energy: 0.8942184355303898
Energy: 0.9779108443236602
Energy: 0.8942184355303898
Energy: 0.9779108443236602
Energy: 0.8942184355303898
Energy: 1.0410522236227753
Energy: 0.8893496503005169
Energy: 1.0410522236227753
Energy: 0.8893496502994002
Energy: 1.0410522236227753
Energy: 0.8893496502999586
Energy: 0.9560152797996366
Energy: 1.0415399654027624
Energy: 0.9560152797996366
Energy: 1.041539965402204
Energy: 0.9560152797996366
Energy: 1.041539965402204
Energy: 1.0442354021733253
Energy: 0.8722685773168002
Energy: 1.0442354021727671
Energy: 0.8722685773168002
Energy: 1.0442354021733253
Energy: 0.8722685773168002
Energy: 0.9859453292707652
Energy: 0.9247078058989477
Energy: 0.9859453292707652
Energy: 0.9247078058989477
Energy: 0.9859453292707652
Energy: 0.9247078058983894
Energy: 0.893461076129222
Energy: 0.9671054053365734
Energy: 0.8934610761281052
Energy: 0.9671054053360151
Energy: 0.8934610761286637
Energy: 0.9671054053365734
Energy: 1.0382812700445854
Energy: 0.8196870852778069
Energy: 1.0382812700445854
Energy: 0.8196870852783653
Energy: 1.0382812700445854
Energy: 0.8196870852783653
Energy: 0.9413127542698595
Energy: 0.9556374321062305
Energy: 0.9413127542698595
Energy: 0.9556374321062305
Energy: 0.9413127542693012
Energy: 0.9556374321062305
Energy: 0.8345652602305803
Energy: 1.0054248169997118
Energy: 0.8345652602305803
Energy: 1.0054248169997118
Energy: 0.8345652602305803
Energy: 1.0054248169997118
Energy: 1.0586267302386092
Energy: 0.8808111367911386
Energy: 1.0586267302386092
Energy: 0.8808111367911386
Energy: 1.0586267302386092
Energy: 0.8808111367911386
Energy: 0.9474711412139102
Energy: 0.952975274084017
Energy: 0.9474711412139102
Energy: 0.952975274084017
Energy: 0.9474711412139102
Energy: 0.952975274084017
Energy: 0.8105717711000884
Energy: 0.949661730032225
Energy: 0.8105717711012049
Energy: 0.949661730032225
Energy: 0.8105717711012049
Energy: 0.949661730032225
Energy: 0.944167280845805
Energy: 0.9883896229070013
Energy: 0.9441672808452468
Energy: 0.9883896229070013
Energy: 0.944167280845805
Energy: 0.9883896229070013

minimum gb energy = 0.7695803812480356 eV
minimum distance =  2.34520070184708 Angstroms
sigma value = 67


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

Energy: 1.2237785648085082
Energy: 1.1079165282680339
Energy: 1.2237785648077129
Energy: 1.1079165282680339
Energy: 1.2237785648085082
Energy: 1.1079165282680339
Energy: 1.0773302470256103
Energy: 1.1992332338148144
Energy: 1.0773302470256103
Energy: 1.199233233814019
Energy: 1.0773302470248147
Energy: 1.1992332338148144
Energy: 1.1468527776141577
Energy: 1.1666947499163927
Energy: 1.1468527776149535
Energy: 1.1666947499163927
Energy: 1.1468527776141577
Energy: 1.1666947499163927
Energy: 1.1671245963732602
Energy: 1.0935974935915722
Energy: 1.1671245963724644
Energy: 1.0935974935915722
Energy: 1.1671245963724644
Energy: 1.0935974935907766
Energy: 0.962155754330398
Energy: 1.0600617690698044
Energy: 0.962155754330398
Energy: 1.0600617690698044
Energy: 0.9621557543296025
Energy: 1.0600617690698044
Energy: 1.1494166591576307
Energy: 1.1483470794770698
Energy: 1.1494166591576307
Energy: 1.1483470794770698
Energy: 1.1494166591568349
Energy: 1.1483470794770698
Energy: 1.0811011627612297
Energy: 1.1899020697589426
Energy: 1.0811011627612297
Energy: 1.1899020697589426
Energy: 1.0811011627612297
Energy: 1.1899020697589426
Energy: 1.0813573159641643
Energy: 1.0522665892068206
Energy: 1.0813573159649599
Energy: 1.0522665892068206
Energy: 1.0813573159641643
Energy: 1.0522665892076162
Energy: 1.1823754386436687
Energy: 1.1992993687184823
Energy: 1.1823754386428733
Energy: 1.1992993687184823
Energy: 1.1823754386436687
Energy: 1.1992993687192781
Energy: 1.1643517218677097
Energy: 0.9930999420248885
Energy: 1.1643517218677097
Energy: 0.9930999420248885
Energy: 1.1643517218677097
Energy: 0.9930999420248885
Energy: 1.150849174950506
Energy: 1.143346163315393
Energy: 1.1508491749513015
Energy: 1.143346163315393
Energy: 1.150849174950506
Energy: 1.143346163315393
Energy: 1.1661834118445167
Energy: 1.1335845935809445
Energy: 1.166183411843721
Energy: 1.1335845935809445
Energy: 1.1661834118429255
Energy: 1.1335845935809445
Energy: 1.1399361180651735
Energy: 1.221471301841247
Energy: 1.1399361180651735
Energy: 1.221471301841247
Energy: 1.1399361180651735
Energy: 1.221471301841247
Energy: 1.1829187248400919
Energy: 1.1782438535754176
Energy: 1.1829187248400919
Energy: 1.1782438535762132
Energy: 1.1829187248400919
Energy: 1.1782438535762132
Energy: 1.1090479110975193
Energy: 1.0775960760206986
Energy: 1.1090479110967237
Energy: 1.0775960760199033
Energy: 1.1090479110975193
Energy: 1.0775960760199033
Energy: 1.1898876468993032
Energy: 1.1158435663800819
Energy: 1.1898876468985076
Energy: 1.1158435663800819
Energy: 1.1898876468993032
Energy: 1.1158435663800819
Energy: 1.0976496135888525
Energy: 1.1870061215171341
Energy: 1.097649613589648
Energy: 1.1870061215163386
Energy: 1.097649613589648
Energy: 1.1870061215171341
Energy: 1.1210385152582516
Energy: 1.058132388097383
Energy: 1.1210385152598428
Energy: 1.0581323880965874
Energy: 1.1210385152582516
Energy: 1.0581323880965874
Energy: 1.151703912863927
Energy: 1.2058873236610055
Energy: 1.1517039128631315
Energy: 1.2058873236602101
Energy: 1.1517039128631315
Energy: 1.2058873236610055
Energy: 1.220986945938728
Energy: 1.1965357141438266
Energy: 1.2209869459379323
Energy: 1.1965357141438266
Energy: 1.2209869459379323
Energy: 1.1965357141438266
Energy: 1.2261625040113573
Energy: 1.0786359831980439
Energy: 1.2261625040121529
Energy: 1.0786359831980439
Energy: 1.2261625040105617
Energy: 1.0786359831980439
Energy: 1.167911722110096
Energy: 1.2001359039192723
Energy: 1.1679117221093005
Energy: 1.2001359039192723
Energy: 1.1679117221093005
Energy: 1.2001359039192723
Energy: 1.022309094235821
Energy: 1.1656482238242272
Energy: 1.0223090942374122
Energy: 1.1656482238234316
Energy: 1.0223090942366169
Energy: 1.1656482238242272

minimum gb energy = 0.9621557543296025 eV
minimum distance =  2.32830229430511 Angstroms
sigma value = 33


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

Energy: 1.344300332442564
Energy: 1.1810896118341496
Energy: 1.3443003324420593
Energy: 1.1810896118346543
Energy: 1.344300332442564
Energy: 1.1810896118346543
Energy: 1.2012563719698686
Energy: 1.297472087383975
Energy: 1.2012563719703733
Energy: 1.297472087383975
Energy: 1.2012563719698686
Energy: 1.297472087383975
Energy: 1.313628478296887
Energy: 1.298744861051729
Energy: 1.313628478296887
Energy: 1.2987448610522336
Energy: 1.313628478296887
Energy: 1.298744861051729
Energy: 1.2860744138457587
Energy: 1.1916048738265004
Energy: 1.286074413845254
Energy: 1.1916048738265004
Energy: 1.286074413845254
Energy: 1.1916048738265004
Energy: 1.2101119878830782
Energy: 1.3131447350851593
Energy: 1.2101119878830782
Energy: 1.3131447350846548
Energy: 1.2101119878835829
Energy: 1.3131447350846548
Energy: 1.4293936330142742
Energy: 1.3136064757099266
Energy: 1.4293936330147792
Energy: 1.3136064757099266
Energy: 1.4293936330147792
Energy: 1.3136064757099266
Energy: 1.1991294564923118
Energy: 1.1508021684795582
Energy: 1.1991294564928165
Energy: 1.150802168478549
Energy: 1.1991294564928165
Energy: 1.1508021684795582
Energy: 1.2953246587737461
Energy: 1.2796009199509812
Energy: 1.2953246587737461
Energy: 1.2796009199504765
Energy: 1.2953246587742508
Energy: 1.2796009199504765
Energy: 1.2762989910396945
Energy: 1.286311795716362
Energy: 1.2762989910396945
Energy: 1.2863117957158572
Energy: 1.2762989910396945
Energy: 1.286311795716362
Energy: 1.4061449330074476
Energy: 1.307340610748219
Energy: 1.4061449330074476
Energy: 1.2174005564274968
Energy: 1.406144933008457
Energy: 1.2174005564294696
Energy: 1.31017845539326
Energy: 1.2945125071294183
Energy: 1.31017845539326
Energy: 1.2945125071294183
Energy: 1.3101784553937648
Energy: 1.2945125071294183
Energy: 1.2041101927420097
Energy: 1.2038037345387742
Energy: 1.2041101927420097
Energy: 1.2038037345387742
Energy: 1.2041101927420097
Energy: 1.2038037345387742
Energy: 1.327790678099575
Energy: 1.2441007620390916
Energy: 1.327790678099575
Energy: 1.2441007620390916
Energy: 1.327790678099575
Energy: 1.2441007620385867
Energy: 1.2614964788388086
Energy: 1.275994544649767
Energy: 1.2614964788388086
Energy: 1.275994544649767
Energy: 1.2614964788388086
Energy: 1.275994544649767
Energy: 1.2403655166635574
Energy: 1.2313996845977402
Energy: 1.2403655166630527
Energy: 1.2313996845972353
Energy: 1.2403655166635574
Energy: 1.2313996845972353
Energy: 1.2858634290197022
Energy: 1.3163515675645407
Energy: 1.2858634290207114
Energy: 1.3163515675650455
Energy: 1.2858634290202067
Energy: 1.3163515675650455
Energy: 1.1923211550528199
Energy: 1.324753328396163
Energy: 1.192321155053829
Energy: 1.324753328396163
Energy: 1.1923211550548387
Energy: 1.324753328396163
Energy: 1.3171004094655199
Energy: 1.3647789419525334
Energy: 1.3171004094655199
Energy: 1.3647789419525334
Energy: 1.3171004094650152
Energy: 1.3647789419525334
Energy: 1.1954680868935983
Energy: 1.3667550313457475
Energy: 1.195468086894103
Energy: 1.3667550313457475
Energy: 1.1954680868925889
Energy: 1.3667550313457475
Energy: 1.3392772595095683
Energy: 1.3008681471193073
Energy: 1.3392772595100733
Energy: 1.3008681471193073
Energy: 1.3392772595100733
Energy: 1.3008681471193073
Energy: 1.358656102585152
Energy: 1.315445932594579
Energy: 1.3586561025841426
Energy: 1.315445932594579
Energy: 1.358656102585152
Energy: 1.315445932594579
Energy: 1.2386364355678896
Energy: 1.1824116177979223
Energy: 1.2386364355683943
Energy: 1.1824116177979223
Energy: 1.2386364355673851
Energy: 1.182411617798427
Energy: 1.2047694153252575
Energy: 1.2946454363289626
Energy: 1.2047694153257622
Energy: 1.2946454363289626
Energy: 1.2047694153252575
Energy: 1.2946454363289626
Energy: 1.3686592586242614
Energy: 1.2079547059409053
Energy: 1.3686592586242614
Energy: 1.20795470594141
Energy: 1.3686592586242614
Energy: 1.2079547059404006
Energy: 1.2161871043135581
Energy: 1.2117997529645208
Energy: 1.2161871043130534
Energy: 1.2117997529645208
Energy: 1.2161871043130534
Energy: 1.2117997529645208
Energy: 1.2435376714787225
Energy: 1.2899416028470345
Energy: 1.2435376714787225
Energy: 1.2899416028470345
Energy: 1.2435376714787225
Energy: 1.2899416028470345
Energy: 1.1991461949422975
Energy: 1.1820796954777566
Energy: 1.199146194943261
Energy: 1.1820796954777566
Energy: 1.1991461949472986
Energy: 1.182079695477252
Energy: 1.3595342833794803
Energy: 1.3397041889908843
Energy: 1.359534283379985
Energy: 1.3397041889903796
Energy: 1.359534283379985
Energy: 1.3397041889908843
Energy: 1.3364931562061824
Energy: 1.3112788701446625
Energy: 1.336493156205173
Energy: 1.3112788701441578
Energy: 1.3364931562061824
Energy: 1.3112788701446625
Energy: 1.1951443884815565
Energy: 1.1457222994076708
Energy: 1.1951443884815565
Energy: 1.1457222994076708
Energy: 1.1951443884815565
Energy: 1.1457222994076708
Energy: 1.3646847499515484
Energy: 1.3662419682363922
Energy: 1.3646847499520531
Energy: 1.3662419682363922
Energy: 1.3646847499520531
Energy: 1.3662419682363922
Energy: 1.2135904929572425
Energy: 1.3003526804071002
Energy: 1.2135904929572425
Energy: 1.3003526804071002
Energy: 1.2135904929572425
Energy: 1.3003526804071002
Energy: 1.2843468840478747
Energy: 1.3144651281193016
Energy: 1.2843468840483794
Energy: 1.3144651281193016
Energy: 1.2843468840483794
Energy: 1.3144651281198065
Energy: 1.2485801919517854
Energy: 1.2970903872936161
Energy: 1.248580191951281
Energy: 1.2970903872936161
Energy: 1.248580191951281
Energy: 1.2970903872941209
Energy: 1.2072513589134142
Energy: 1.2990438729126543
Energy: 1.2072513589139189
Energy: 1.2990438729126543
Energy: 1.2072513589134142
Energy: 1.2990438729126543
Energy: 1.3500102118750796
Energy: 1.2448369259103407
Energy: 1.350010211874575
Energy: 1.2448369259103407
Energy: 1.3500102118750796
Energy: 1.2448369259108452
Energy: 1.2018201974351765
Energy: 1.2305893799488874
Energy: 1.2018201974346718
Energy: 1.2305893799488874
Energy: 1.2018201974346718
Energy: 1.2305893799488874

minimum gb energy = 1.1457222994076708 eV
minimum distance =  2.31904208941769 Angstroms
sigma value = 41


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

Energy: 1.4888588315095652
Energy: 1.3519661439598443
Energy: 1.4888588315095652
Energy: 1.3519661439598443
Energy: 1.4888588315095652
Energy: 1.3519661439598443
Energy: 1.3531783451396142
Energy: 1.4425633593918763
Energy: 1.3531783451382362
Energy: 1.4425633593918763
Energy: 1.3531783451396142
Energy: 1.4425633593918763
Energy: 1.6248675329454372
Energy: 1.4441399403825543
Energy: 1.565322132960394
Energy: 1.4441399403825543
Energy: 1.565322132960394
Energy: 1.4441399403825543
Energy: 1.5105588822105813
Energy: 1.5673633002806757
Energy: 1.510558882211959
Energy: 1.5673633002806757
Energy: 1.510558882211959
Energy: 1.5673633002806757
Energy: 1.469642940818654
Energy: 1.4495058804622412
Energy: 1.469642940818654
Energy: 1.4495058804636194
Energy: 1.469642940818654
Energy: 1.4495058804622412
Energy: 1.5758426928406342
Energy: 1.4783498897654883
Energy: 1.5758426928406342
Energy: 1.4783498897668665
Energy: 1.5758426928406342
Energy: 1.4783498897668665
Energy: 1.5066968792167332
Energy: 1.367220808746341
Energy: 1.5066968792167332
Energy: 1.367220808747719
Energy: 1.5066968792167332
Energy: 1.367220808747719
Energy: 1.4388512147267458
Energy: 1.469215009256066
Energy: 1.4388512147267458
Energy: 1.469215009254688
Energy: 1.4388512147267458
Energy: 1.469215009254688
Energy: 1.3528034834790879
Energy: 1.3629240565857568
Energy: 1.3528034834790879
Energy: 1.3629240565843788
Energy: 1.3528034834790879
Energy: 1.3629240565843788
Energy: 1.5017493542912237
Energy: 1.388528417092086
Energy: 1.5017493542926015
Energy: 1.388528417092086
Energy: 1.5017493542912237
Energy: 1.388528417092086
Energy: 1.3540082695664422
Energy: 1.443672025786669
Energy: 1.3540082695664422
Energy: 1.443672025786669
Energy: 1.3540082695650641
Energy: 1.443672025786669
Energy: 1.4340180568722434
Energy: 1.4407587944254285
Energy: 1.4340180568736212
Energy: 1.4407587944254285
Energy: 1.4340180568736212
Energy: 1.4407587944254285
Energy: 1.478991367358989
Energy: 1.467477341916493
Energy: 1.478991367358989
Energy: 1.467477341916493
Energy: 1.478991367358989
Energy: 1.467477341916493
Energy: 1.4715938779845141
Energy: 1.4644484121369827
Energy: 1.4715938779845141
Energy: 1.4644484121369827
Energy: 1.4715938779845141
Energy: 1.4644484121369827

minimum gb energy = 1.3519661439598443 eV
minimum distance =  2.27512854455277 Angstroms
sigma value = 11


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

Energy: 1.6537328897935115
Energy: 1.6379030598625133
Energy: 1.6537328897935115
Energy: 1.6379030598625133
Energy: 1.653732889794117
Energy: 1.6379030598625133
Energy: 1.4440626707247786
Energy: 1.5993489447808407
Energy: 1.4440626707247786
Energy: 1.599348944781446
Energy: 1.444062670724173
Energy: 1.599348944781446
Energy: 1.5805554145844027
Energy: 1.552670533787557
Energy: 1.6210523133218042
Energy: 1.5526705337881626
Energy: 1.5805554145844027
Energy: 1.552670533787557
Energy: 1.5590207415455433
Energy: 1.4485328307303773
Energy: 1.5590207415467539
Energy: 1.4485328307303773
Energy: 1.5590207415455433
Energy: 1.448532830729772
Energy: 1.6049061790008492
Energy: 1.5356276986307766
Energy: 1.6049061790008492
Energy: 1.5356276986307766
Energy: 1.6049061790008492
Energy: 1.5356276986307766
Energy: 1.5230020618792215
Energy: 1.5748977942356044
Energy: 1.5230020618786162
Energy: 1.5748977942362097
Energy: 1.5230020618792215
Energy: 1.5748977942362097
Energy: 1.5722501158153457
Energy: 1.5373579080293558
Energy: 1.5722501158153457
Energy: 1.537357908029961
Energy: 1.5722501158153457
Energy: 1.537357908029961
Energy: 1.530092542202608
Energy: 1.5709363708888016
Energy: 1.530092542202608
Energy: 1.5709363708888016
Energy: 1.530092542202608
Energy: 1.570936370888196
Energy: 1.551437406979565
Energy: 1.545701646166053
Energy: 1.551437406979565
Energy: 1.5457016461666586
Energy: 1.5514374069801702
Energy: 1.545701646166053
Energy: 1.535832506456304
Energy: 1.5397699073094517
Energy: 1.5358325064569096
Energy: 1.5397699073094517
Energy: 1.535832506456304
Energy: 1.5397699073094517
Energy: 1.524268019539177
Energy: 1.5867213506833944
Energy: 1.524268019539177
Energy: 1.5867213506833944
Energy: 1.5242680195385716
Energy: 1.5867213506833944
Energy: 1.5657819405651123
Energy: 1.5909200140177941
Energy: 1.5657819405657174
Energy: 1.5909200140183994
Energy: 1.5657819405657174
Energy: 1.5909200140183994
Energy: 1.560680993003729
Energy: 1.4914650760232198
Energy: 1.560680993003729
Energy: 1.491465076023825
Energy: 1.560680993003729
Energy: 1.4914650760232198
Energy: 1.5347184608901492
Energy: 1.5774950981461375
Energy: 1.5347184608907545
Energy: 1.5774950981461375
Energy: 1.5347184608907545
Energy: 1.577495098146743
Energy: 1.4937677184486429
Energy: 1.5124508995685133
Energy: 1.4937677184486429
Energy: 1.5124508995691186
Energy: 1.4937677184486429
Energy: 1.5124508995691186
Energy: 1.5774759709876591
Energy: 1.5382067346498092
Energy: 1.5774759709876591
Energy: 1.5382067346498092
Energy: 1.5774759709876591
Energy: 1.5382067346492039
Energy: 1.4673904681603889
Energy: 1.5543615745490622
Energy: 1.4673904681603889
Energy: 1.5543615745490622
Energy: 1.4673904681603889
Energy: 1.5543615745490622
Energy: 1.5757163503750111
Energy: 1.5872102415497547
Energy: 1.5757163503750111
Energy: 1.5872102415497547
Energy: 1.5757163503750111
Energy: 1.5872102415497547
Energy: 1.5231709396640767
Energy: 1.4536124236393853
Energy: 1.5231709396640767
Energy: 1.4536124236393853
Energy: 1.5231709396646822
Energy: 1.4536124236399908
Energy: 1.5291119852299204
Energy: 1.5597257559561233
Energy: 1.5291119852299204
Energy: 1.559725755955518
Energy: 1.5291119852299204
Energy: 1.5597257559561233
Energy: 1.4516325801520351
Energy: 1.4938609110968535
Energy: 1.4516325801514298
Energy: 1.493860911096248
Energy: 1.4516325801514298
Energy: 1.4938609110968535
Energy: 1.6063918503467223
Energy: 1.6460184095501218
Energy: 1.606391850346117
Energy: 1.6460184095501218
Energy: 1.606391850346117
Energy: 1.6460184095501218
Energy: 1.508614227337879
Energy: 1.55251686101026
Energy: 1.508614227337879
Energy: 1.5525168610108653
Energy: 1.508614227337879
Energy: 1.55251686101026
Energy: 1.5855511406996927
Energy: 1.5984120067667145
Energy: 1.5855511406996927
Energy: 1.5984120067667145
Energy: 1.5855511406996927
Energy: 1.5984120067667145
Energy: 1.535102660010848
Energy: 1.5446753523038186
Energy: 1.535102660010848
Energy: 1.5446753523038186
Energy: 1.535102660010848
Energy: 1.5446753523038186
Energy: 1.469917820382087
Energy: 1.5729816553123221
Energy: 1.469917820382087
Energy: 1.5729816553123221
Energy: 1.4699178203826924
Energy: 1.5729816553117169
Energy: 1.5229908748995895
Energy: 1.593685658461299
Energy: 1.5229908748995895
Energy: 1.593685658461299
Energy: 1.5229908748995895
Energy: 1.593685658461299
Energy: 1.560878849867881
Energy: 1.4883390513803112
Energy: 1.560878849867881
Energy: 1.4883390513803112
Energy: 1.560878849867881
Energy: 1.4883390513803112
Energy: 1.5334603741261605
Energy: 1.6033510293528588
Energy: 1.5334603741255552
Energy: 1.6033510293528588
Energy: 1.5334603741261605
Energy: 1.6033510293534643
Energy: 1.4952728128969694
Energy: 1.4319996454510822
Energy: 1.4952728128969694
Energy: 1.4319996454510822
Energy: 1.4952728128969694
Energy: 1.4319996454516875
Energy: 1.5336795718841145
Energy: 1.6059084183409698
Energy: 1.5336795718847198
Energy: 1.6059084183397592
Energy: 1.5336795718847198
Energy: 1.6059084183397592

minimum gb energy = 1.4319996454510822 eV
minimum distance =  2.25724432382421 Angstroms
sigma value = 57


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

Energy: 1.4550591953532381
Energy: 1.3681725399717481
Energy: 1.455059195352161
Energy: 1.3681725399717481
Energy: 1.4550591953532381
Energy: 1.3681725399717481
Energy: 1.5653104426975117
Energy: 1.6069079991246973
Energy: 1.5653104426975117
Energy: 1.6069079991246973
Energy: 1.5653104426975117
Energy: 1.60690799912362
Energy: 1.6160032905850465
Energy: 1.4988521376113557
Energy: 1.6160032905839699
Energy: 1.4988521376113557
Energy: 1.6160032905839699
Energy: 1.4988521376113557
Energy: 1.4518464438183718
Energy: 1.4515257117873226
Energy: 1.4518464438162173
Energy: 1.4515257117873226
Energy: 1.4518464438183718
Energy: 1.4515257117862455
Energy: 1.6161659484330042
Energy: 1.4988154723722114
Energy: 1.6161659484330042
Energy: 1.498815472371134
Energy: 1.6161659484330042
Energy: 1.4988154723722114
Energy: 1.5658198363774267
Energy: 1.5416655708957858
Energy: 1.5658198363763496
Energy: 1.4085518175695677
Energy: 1.5658198363774267
Energy: 1.4085518175695677
Energy: 1.455059195352161
Energy: 1.3681725399706708
Energy: 1.455059195352161
Energy: 1.3681725399706708
Energy: 1.455059195352161
Energy: 1.3681725399706708
Energy: 1.5653104426975117
Energy: 1.6069079991246973
Energy: 1.5653104426975117
Energy: 1.6069079991246973
Energy: 1.5653104426975117
Energy: 1.60690799912362
Energy: 1.6160032905839699
Energy: 1.4988521376113557
Energy: 1.6160032905839699
Energy: 1.4988521376113557
Energy: 1.6160032905839699
Energy: 1.4988521376102784
Energy: 1.4518464438172944
Energy: 1.630641227558135
Energy: 1.4518464438172944
Energy: 1.630641227557058
Energy: 1.4518464438183718
Energy: 1.630641227557058
Energy: 1.6161659484330042
Energy: 1.4988154723722114
Energy: 1.6161659484330042
Energy: 1.4988154723722114
Energy: 1.6161659484330042
Energy: 1.4988154723722114
Energy: 1.5658198363774267
Energy: 1.4085518175695677
Energy: 1.5658198363774267
Energy: 1.4085518175695677
Energy: 1.5658198363774267
Energy: 1.4085518175695677
Energy: 1.4550591953532381
Energy: 1.3681725399717481
Energy: 1.455059195352161
Energy: 1.3681725399717481
Energy: 1.4550591953532381
Energy: 1.3681725399717481
Energy: 1.5653104426975117
Energy: 1.6069079991246973
Energy: 1.5653104426975117
Energy: 1.6069079991246973
Energy: 1.5653104426975117
Energy: 1.6069079991246973
Energy: 1.6160032905850465
Energy: 1.4988521376113557
Energy: 1.6160032905850465
Energy: 1.4988521376113557
Energy: 1.6160032905839699
Energy: 1.4988521376113557
Energy: 1.4518464438183718
Energy: 1.3801304231746465
Energy: 1.4518464438162173
Energy: 1.3801304231746465
Energy: 1.451846443819449
Energy: 1.3801304231746465
Energy: 1.6161659484330042
Energy: 1.498815472371134
Energy: 1.6161659484330042
Energy: 1.498815472371134
Energy: 1.6161659484330042
Energy: 1.498815472371134

minimum gb energy = 1.3681725399706708 eV
minimum distance =  2.29877008293682 Angstroms
sigma value = 9


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

Energy: 1.5576693947194353
Energy: 1.64049168043673
Energy: 1.5576693947194353
Energy: 1.6404916804376093
Energy: 1.5576693947194353
Energy: 1.6404916804376093
Energy: 1.5186048461821695
Energy: 1.5237037313934314
Energy: 1.5186048461812902
Energy: 1.5237037313925517
Energy: 1.5186048461812902
Energy: 1.5237037313925517
Energy: 1.5799523268157822
Energy: 1.5089431834787086
Energy: 1.5098150202581753
Energy: 1.5089431834795883
Energy: 1.5799523268157822
Energy: 1.5089431834787086
Energy: 1.4785665075505632
Energy: 1.6061280792519401
Energy: 1.4785665075514427
Energy: 1.6061280792519401
Energy: 1.4785665075514427
Energy: 1.6061280792519401
Energy: 1.5181863420224802
Energy: 1.5293588429041083
Energy: 1.5181863420224802
Energy: 1.5293588429041083
Energy: 1.5181863420224802
Energy: 1.5293588429041083
Energy: 1.528216290560152
Energy: 1.5151007450091967
Energy: 1.528216290560152
Energy: 1.5151007450083172
Energy: 1.528216290560152
Energy: 1.5151007450083172
Energy: 1.4965398457054953
Energy: 1.537045398272418
Energy: 1.4965398457054953
Energy: 1.537045398272418
Energy: 1.4965398457054953
Energy: 1.537045398272418
Energy: 1.4933144378070213
Energy: 1.55109499478352
Energy: 1.4933144378070213
Energy: 1.5510949947826405
Energy: 1.4933144378070213
Energy: 1.55109499478352
Energy: 1.7089770257073271
Energy: 1.5659013313437882
Energy: 1.7089770257073271
Energy: 1.5659013313437882
Energy: 1.7089770257073271
Energy: 1.5659013313437882
Energy: 1.4984640372980296
Energy: 1.5055794507688927
Energy: 1.4984640372980296
Energy: 1.5055794507680134
Energy: 1.4984640372980296
Energy: 1.5055794507688927
Energy: 1.5054093117801253
Energy: 1.5186736165365378
Energy: 1.505409311779246
Energy: 1.5186736165374173
Energy: 1.5054093117801253
Energy: 1.5186736165365378
Energy: 1.5842803916026929
Energy: 1.5458301513722423
Energy: 1.5842803916035724
Energy: 1.5458301513722423
Energy: 1.5842803916026929
Energy: 1.5458301513722423
Energy: 1.478312836897978
Energy: 1.562852022483623
Energy: 1.4783128368970988
Energy: 1.5628520224827436
Energy: 1.478312836897978
Energy: 1.5628520224827436
Energy: 1.5370435201845862
Energy: 1.5079239181019664
Energy: 1.537043520185466
Energy: 1.507923918102846
Energy: 1.5370435201845862
Energy: 1.5079239181019664
Energy: 1.528632723025504
Energy: 1.5405078609093361
Energy: 1.5286327230263834
Energy: 1.5405078609093361
Energy: 1.5286327230263834
Energy: 1.5405078609093361
Energy: 1.5551578590415516
Energy: 1.5173675920195335
Energy: 1.5551578590406723
Energy: 1.5173675920204128
Energy: 1.5551578590406723
Energy: 1.5173675920204128
Energy: 1.5505344310250952
Energy: 1.5181692601649324
Energy: 1.5505344310250952
Energy: 1.5181692601649324
Energy: 1.5505344310259745
Energy: 1.5181692601658119
Energy: 1.7212545601487537
Energy: 1.5291987753898284
Energy: 1.7212545601487537
Energy: 1.5291987753907077
Energy: 1.7212545601487537
Energy: 1.5291987753898284
Energy: 1.4960227873302168
Energy: 1.5093680760820698
Energy: 1.496022787329337
Energy: 1.5093680760820698
Energy: 1.4960227873302168
Energy: 1.5093680760820698
Energy: 1.5913249713677133
Energy: 1.5553108711491237
Energy: 1.5913249713668336
Energy: 1.555310871148244
Energy: 1.5913249713668336
Energy: 1.555310871148244
Energy: 1.5862876839367575
Energy: 1.5434936529958962
Energy: 1.5862876839367575
Energy: 1.5434936529958962
Energy: 1.5862876839367575
Energy: 1.5434936529958962

minimum gb energy = 1.4783128368970988 eV
minimum distance =  2.28592534157213 Angstroms
sigma value = 27


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

Energy: 1.6139483906777674
Energy: 1.8373448803852335
Energy: 1.5698037525722282
Energy: 1.8373448803852335
Energy: 1.6139483906777674
Energy: 1.8373448803844918
Energy: 1.6082269733096868
Energy: 1.5411401656592332
Energy: 1.6082269733096868
Energy: 1.5411401656592332
Energy: 1.6082269733096868
Energy: 1.5411401656592332
Energy: 1.4862953425271535
Energy: 1.4985943169629854
Energy: 1.4862953425278946
Energy: 1.4985943169629854
Energy: 1.4862953425271535
Energy: 1.4985943169629854
Energy: 1.4535976475684809
Energy: 1.5975130163512576
Energy: 1.453597647569222
Energy: 1.597513016351999
Energy: 1.4535976475677395
Energy: 1.597513016348292
Energy: 1.4535794115983667
Energy: 1.567790884695588
Energy: 1.4535794115968839
Energy: 1.567790884695588
Energy: 1.4535794115961427
Energy: 1.5677908846948467
Energy: 1.5763074059955577
Energy: 1.585451830575563
Energy: 1.5763074059948161
Energy: 1.585451830575563
Energy: 1.5763074059955577
Energy: 1.5854518305748218
Energy: 1.4781245620293337
Energy: 1.5870852452641953
Energy: 1.4781245620293337
Energy: 1.5870852452649367
Energy: 1.4781245620293337
Energy: 1.5870852452671607
Energy: 1.5670184565643015
Energy: 1.4851683431041545
Energy: 1.5670184565643015
Energy: 1.4851683431041545
Energy: 1.5670184565643015
Energy: 1.4851683431041545
Energy: 1.6561398296730148
Energy: 1.453426907258855
Energy: 1.656132513242821
Energy: 1.4534269072581139
Energy: 1.6561398296722731
Energy: 1.4534269072595964
Energy: 1.5850362147419972
Energy: 1.5349633021234406
Energy: 1.5851094345646937
Energy: 1.5349633021234406
Energy: 1.5850362147419972
Energy: 1.534963302124182
Energy: 1.5847042908332418
Energy: 1.5664817452855888
Energy: 1.584755968487021
Energy: 1.5664817452848476
Energy: 1.5847042908332418
Energy: 1.566481745284106
Energy: 1.588801692224308
Energy: 1.4793365512139507
Energy: 1.5888016922228254
Energy: 1.4793365512139507
Energy: 1.588801692224308
Energy: 1.4793365512109855
Energy: 1.520084129347796
Energy: 1.5994585148671172
Energy: 1.5200841293470544
Energy: 1.5994585148678586
Energy: 1.520084129347796
Energy: 1.5994585148678586
Energy: 1.4536411073771434
Energy: 1.5117208593185505
Energy: 1.4536411073786262
Energy: 1.5117208593178093
Energy: 1.4536411073771434
Energy: 1.511720859317068
Energy: 1.661876046080235
Energy: 1.582745232431478
Energy: 1.66248285304804
Energy: 1.582745232431478
Energy: 1.6618760460794935
Energy: 1.582745232429995
Energy: 1.5414437647065897
Energy: 1.5683772188025151
Energy: 1.5414437647080725
Energy: 1.5683772188032565
Energy: 1.5414437647065897
Energy: 1.5683772188010323
Energy: 1.4783372672688375
Energy: 1.4865615698215071
Energy: 1.47833726727032
Energy: 1.4865615698222485
Energy: 1.478337267268096
Energy: 1.4865615698222485
Energy: 1.5967266362566466
Energy: 1.513449216094497
Energy: 1.5967266362559054
Energy: 1.513449216094497
Energy: 1.5967266362566466
Energy: 1.5134492160930142
Energy: 1.5192091505812784
Energy: 1.5074111696037642
Energy: 1.5248879617196964
Energy: 1.5074111696037642
Energy: 1.5192091505805372
Energy: 1.5074111696045056
Energy: 1.6139483906762848
Energy: 1.8373448803844918
Energy: 1.5698037525722282
Energy: 1.8373448803852335
Energy: 1.6139483906770264
Energy: 1.8373448803844918
Energy: 1.6082269733089454
Energy: 1.5411401656599748
Energy: 1.6082269733089454
Energy: 1.5411401656599748
Energy: 1.6082269733089454
Energy: 1.541140165660716
Energy: 1.486295342526412
Energy: 1.4985943169629854
Energy: 1.486295342526412
Energy: 1.4985943169629854
Energy: 1.486295342526412
Energy: 1.4985943169629854
Energy: 1.4535976475677395
Energy: 1.5975130163505162
Energy: 1.453597647569222
Energy: 1.597513016351999
Energy: 1.4535976475677395
Energy: 1.5975130163497748
Energy: 1.4535794115961427
Energy: 1.567790884695588
Energy: 1.4535794115961427
Energy: 1.567790884695588
Energy: 1.4535794115968839
Energy: 1.5677908846948467
Energy: 1.5763074059948161
Energy: 1.585451830575563
Energy: 1.5763074059933335
Energy: 1.5854518305763043
Energy: 1.5763074059948161
Energy: 1.5854518305748218

minimum gb energy = 1.4534269072581139 eV
minimum distance =  2.25955348291393 Angstroms
sigma value = 19


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

Energy: 1.4702558485299455
Energy: 1.699164454883062
Energy: 1.4702558485299455
Energy: 1.699164454883062
Energy: 1.4702558485299455
Energy: 1.699164454883062
Energy: 1.5219906070214708
Energy: 1.5263393664807532
Energy: 1.5219906070214708
Energy: 1.5263393664807532
Energy: 1.5219906070208307
Energy: 1.5263393664807532
Energy: 1.558382979909725
Energy: 1.4269261515098632
Energy: 1.558382979909725
Energy: 1.4269261515098632
Energy: 1.558382979909725
Energy: 1.4269261515105032
Energy: 1.4182422535042933
Energy: 1.5504759872025478
Energy: 1.4182422535042933
Energy: 1.5504759872025478
Energy: 1.4182422535049333
Energy: 1.5504759872025478
Energy: 1.5221883352386145
Energy: 1.519194198438798
Energy: 1.5221883352386145
Energy: 1.519194198438798
Energy: 1.5221883352386145
Energy: 1.519194198438798
Energy: 1.5651876154980113
Energy: 1.4256901323222622
Energy: 1.5651876154980113
Energy: 1.4256901323222622
Energy: 1.5651876154980113
Energy: 1.4256901323222622
Energy: 1.4683210292912283
Energy: 1.6390967038950826
Energy: 1.4683210292912283
Energy: 1.6390967038944426
Energy: 1.468321029291868
Energy: 1.6390967038944426
Energy: 1.4498779184449653
Energy: 1.6440424256400168
Energy: 1.4498779184443253
Energy: 1.6440424256400168
Energy: 1.4498779184449653
Energy: 1.6440424256400168
Energy: 1.5925863111699747
Energy: 1.3966718521805042
Energy: 1.5925863111699747
Energy: 1.3966718521805042
Energy: 1.5925863111699747
Energy: 1.3966718521805042
Energy: 1.5219538990480768
Energy: 1.5175598012852345
Energy: 1.5219538990474368
Energy: 1.5175598012852345
Energy: 1.5219538990480768
Energy: 1.5175598012852345
Energy: 1.4076270947380027
Energy: 1.6308334780218225
Energy: 1.4076270947380027
Energy: 1.6308334780243827
Energy: 1.4076270947386427
Energy: 1.6308334780243827
Energy: 1.5942714434831233
Energy: 1.425057109558865
Energy: 1.5942714434824834
Energy: 1.425057109558865
Energy: 1.5942714434818432
Energy: 1.425057109558865
Energy: 1.5427398595605204
Energy: 1.480830366529396
Energy: 1.5427398595605204
Energy: 1.480830366529396
Energy: 1.5427398595605204
Energy: 1.480830366529396
Energy: 1.424064659658863
Energy: 1.5485081668986231
Energy: 1.424064659658863
Energy: 1.5485081668986231
Energy: 1.424064659658863
Energy: 1.5485081668986231
Energy: 1.56289334142997
Energy: 1.4342824227411892
Energy: 1.56289334142933
Energy: 1.4342824227411892
Energy: 1.56289334142933
Energy: 1.4342824227418292
Energy: 1.6226550486341047
Energy: 1.3968288769723491
Energy: 1.6226550486341047
Energy: 1.3968288769723491
Energy: 1.6226550486341047
Energy: 1.3968288769723491
Energy: 1.4348503254683935
Energy: 1.5454404389364707
Energy: 1.4348503254683935
Energy: 1.5454404389364707
Energy: 1.4348503254683935
Energy: 1.5454404389364707
Energy: 1.5038960816351459
Energy: 1.541924845391599
Energy: 1.5038960816351459
Energy: 1.541924845391599
Energy: 1.5038960816351459
Energy: 1.541924845392239
Energy: 1.5353899273086982
Energy: 1.4246274382183828
Energy: 1.5353899273086982
Energy: 1.4246274382190227
Energy: 1.5353899273080585
Energy: 1.4246274382190227
Energy: 1.433740956814701
Energy: 1.5205388512663363
Energy: 1.4337409568140613
Energy: 1.5205388512663363
Energy: 1.433740956814701
Energy: 1.5205388512663363
Energy: 1.4298535100750047
Energy: 1.6272393878407048
Energy: 1.4298535100750047
Energy: 1.6272393878407048
Energy: 1.4298535100750047
Energy: 1.6272393878407048
Energy: 1.5998165118902166
Energy: 1.4267986680557374
Energy: 1.5998165118902166
Energy: 1.4267986680550975
Energy: 1.5998165118895766
Energy: 1.4267986680557374
Energy: 1.5656929309667764
Energy: 1.5240435909367918
Energy: 1.5656929309667764
Energy: 1.5240435909367918
Energy: 1.5656929309661365
Energy: 1.5240435909367918
Energy: 1.4586676611351514
Energy: 1.5304164081997196
Energy: 1.4586676611351514
Energy: 1.5304164081997196
Energy: 1.4586676611357914
Energy: 1.5304164081997196
Energy: 1.500474140068594
Energy: 1.4269640448726044
Energy: 1.500474140068594
Energy: 1.4269640448732444
Energy: 1.500474140068594
Energy: 1.4269640448726044
Energy: 1.5503821926041939
Energy: 1.4507945117386196
Energy: 1.5503821926041939
Energy: 1.4507945117386196
Energy: 1.5503821926041939
Energy: 1.4507945117386196
Energy: 1.401089278529505
Energy: 1.5322677957435518
Energy: 1.401089278530145
Energy: 1.5322677957435518
Energy: 1.401089278529505
Energy: 1.5322677957435518
Energy: 1.5475872011280998
Energy: 1.4243322289679197
Energy: 1.5475872011280998
Energy: 1.4243322289679197
Energy: 1.5475872011287397
Energy: 1.4243322289679197
Energy: 1.5116714775653282
Energy: 1.4246633043326349
Energy: 1.5116714775646882
Energy: 1.424663304333275
Energy: 1.5116714775646882
Energy: 1.4246633043319952

minimum gb energy = 1.3966718521805042 eV
minimum distance =  2.2786299723418 Angstroms
sigma value = 101


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

Energy: 1.3820956316042952
Energy: 1.5673825711133673
Energy: 1.3820956316048576
Energy: 1.5673825711133673
Energy: 1.3820956316037327
Energy: 1.5673825711133673
Energy: 1.4965018658402285
Energy: 1.4331409919658988
Energy: 1.4965018658402285
Energy: 1.4331409919653362
Energy: 1.4965018658407911
Energy: 1.4331409919653362
Energy: 1.4772501580130675
Energy: 1.3616888833355332
Energy: 1.4772501580130675
Energy: 1.3616888833355332
Energy: 1.4772501580130675
Energy: 1.3616888833355332
Energy: 1.3235002154738968
Energy: 1.7911201021480654
Energy: 1.3235002154738968
Energy: 1.7507877077645422
Energy: 1.3235002154744595
Energy: 1.7507877077651048
Energy: 1.4377027874566066
Energy: 1.4219665755919804
Energy: 1.4377027874560442
Energy: 1.4219665755942301
Energy: 1.4377027874566066
Energy: 1.4219665755942301
Energy: 1.5467672061927824
Energy: 1.3420821679314299
Energy: 1.5467672061927824
Energy: 1.3420821679314299
Energy: 1.5467672061933448
Energy: 1.3420821679314299
Energy: 1.35789169342115
Energy: 1.6555615384151732
Energy: 1.3578916934217125
Energy: 1.6555615384151732
Energy: 1.3578916934205876
Energy: 1.6555615384151732
Energy: 1.3423570241482015
Energy: 1.4937099601219894
Energy: 1.342357024148764
Energy: 1.4937099601231145
Energy: 1.3423570241476388
Energy: 1.4937099601231145
Energy: 1.5423082163650152
Energy: 1.343374496897568
Energy: 1.542308216365578
Energy: 1.343374496897568
Energy: 1.5423082163650152
Energy: 1.3433744968981303
Energy: 1.5152412026250481
Energy: 1.4356567310303596
Energy: 1.5152412026250481
Energy: 1.5000637257976162
Energy: 1.5152412026244855
Energy: 1.5000637257981786
Energy: 1.3224508704175921
Energy: 1.654505010733977
Energy: 1.3224508704187172
Energy: 1.654505010733977
Energy: 1.3224508704181548
Energy: 1.654505010733977
Energy: 1.4283304342053897
Energy: 1.3972420903501932
Energy: 1.4283304342059524
Energy: 1.3972420903496305
Energy: 1.4283304342048273
Energy: 1.3972420903496305
Energy: 1.5049777315487112
Energy: 1.3622303098875235
Energy: 1.5049777315492736
Energy: 1.3622303098875235
Energy: 1.5049777315487112
Energy: 1.3622303098875235
Energy: 1.3822231163771903
Energy: 1.5253653206729476
Energy: 1.3822231163760654
Energy: 1.5764130667054705
Energy: 1.3822231163760654
Energy: 1.5764130667049079
Energy: 1.4835708824924227
Energy: 1.4095601360594356
Energy: 1.4835708824924227
Energy: 1.409560136059998
Energy: 1.48357088249186
Energy: 1.409560136059998
Energy: 1.5583215052377315
Energy: 1.36503875872154
Energy: 1.5583215052382942
Energy: 1.36503875872154
Energy: 1.5583215052377315
Energy: 1.36503875872154
Energy: 1.3225078279982578
Energy: 1.4547576375126485
Energy: 1.3225078279982578
Energy: 1.4547576375075857
Energy: 1.3225078279982578
Energy: 1.4547576375064604
Energy: 1.3166130789272616
Energy: 1.477268480527317
Energy: 1.3166130789283867
Energy: 1.477268480527317
Energy: 1.3166130789289492
Energy: 1.477268480527317
Energy: 1.543788757525881
Energy: 1.342634405761273
Energy: 1.5437887575253184
Energy: 1.342634405761273
Energy: 1.543788757525881
Energy: 1.342634405761784
Energy: 1.4311057492803334
Energy: 1.4819470742294998
Energy: 1.431105749279208
Energy: 1.4819470742289371
Energy: 1.4311057492808958
Energy: 1.4819470742289371
Energy: 1.3423345567521594
Energy: 1.6394276540875048
Energy: 1.3423345567521594
Energy: 1.6394276540875048
Energy: 1.3423345567521594
Energy: 1.6394276540875048
Energy: 1.658469891941962
Energy: 1.3415358608130379
Energy: 1.6584698919425247
Energy: 1.341535860814163
Energy: 1.658469891941962
Energy: 1.3415358608136005
Energy: 1.545161957469138
Energy: 1.3423805635481159
Energy: 1.545161957469138
Energy: 1.3423805635481159
Energy: 1.545161957469138
Energy: 1.3423805635481159
Energy: 1.3236900985983922
Energy: 1.547419813451627
Energy: 1.3236900985983922
Energy: 1.5474198134510644
Energy: 1.3236900985983922
Energy: 1.5474198134510644
Energy: 1.4297775184611248
Energy: 1.3934737423559176
Energy: 1.4297775184611248
Energy: 1.3934737423570425
Energy: 1.4297775184605623
Energy: 1.39347374235648
Energy: 1.505679827234505
Energy: 1.3616301145843248
Energy: 1.505679827234505
Energy: 1.3616301145848875
Energy: 1.5056798272339424
Energy: 1.3616301145843248
Energy: 1.3822056891673402
Energy: 1.500794665604865
Energy: 1.3822056891667778
Energy: 1.500794665604865
Energy: 1.3822056891679029
Energy: 1.5007946656054274
Energy: 1.3827310653259142
Energy: 1.518497646673606
Energy: 1.3827310653242264
Energy: 1.5184976466741686
Energy: 1.3827310653247888
Energy: 1.518497646673606
Energy: 1.547449363066581
Energy: 1.3615909534609276
Energy: 1.547449363065456
Energy: 1.3615909534609276
Energy: 1.5474493630660184
Energy: 1.3615909534609276
Energy: 1.3164919775299497
Energy: 1.4968961550261384
Energy: 1.3164919775299497
Energy: 1.4968961550261384
Energy: 1.3164919775293868
Energy: 1.4968961550261384
Energy: 1.3223833821407578
Energy: 1.4708177182623308
Energy: 1.322383382139633
Energy: 1.470817718261768
Energy: 1.322383382139633
Energy: 1.4708177182623308
Energy: 1.5267260971392185
Energy: 1.3413162872732842
Energy: 1.5267260971392185
Energy: 1.341316287274409
Energy: 1.526726097138656
Energy: 1.3413162872738469
Energy: 1.659393412433256
Energy: 1.3424103680786665
Energy: 1.6593934124338188
Energy: 1.3424103680797916
Energy: 1.659393412433256
Energy: 1.3424103680786665

minimum gb energy = 1.3164919775293868 eV
minimum distance =  2.29769315825596 Angstroms
sigma value = 33


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

Energy: 0.020522327700621294
Energy: 1.2229119851738235
Energy: 0.020522327700621294
Energy: 1.2229119851738235
Energy: 0.020522327700621294
Energy: 1.2229119851738235
Energy: 0.02143622067908235
Energy: 0.45538607244461027
Energy: 0.02143622067908235
Energy: 0.45538607244461027
Energy: 0.02143622067908235
Energy: 0.45538607244507767
Energy: 1.2236516056044997
Energy: 0.4546869399852485
Energy: 1.2239735740309128
Energy: 0.45468693987146214
Energy: 1.2235845011208346
Energy: 0.454686940265274
Energy: 0.021436220680017156
Energy: 0.45538607244507767
Energy: 0.021436220680017156
Energy: 0.45538607244461027
Energy: 0.021436220680017156
Energy: 0.45538607244461027

minimum gb energy = 0.020522327700621294 eV
minimum distance =  2.48492838952637 Angstroms
sigma value = 1