Model name: model_name=EAM_Dynamo_BorovikovMendelevKing_2016_CuZr__MO_097471813275_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.638568460941315
cohesive_energy=3.4069304484773077
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013010087420719066
Energy: 0.9817632393525301
Energy: 0.013010087420719066
Energy: 0.9817632393519453
Energy: 0.013010087420719066
Energy: 0.9817632393525301
Energy: 0.9817632393525301
Energy: 0.8813053536789035
Energy: 0.9817632393525301
Energy: 0.8813053536792129
Energy: 0.9817632393525301
Energy: 0.8813053536789035
Energy: 0.013010087420719066
Energy: 0.9817632393528396
Energy: 0.013010087420719066
Energy: 0.9817632393525301
Energy: 0.013010087420719066
Energy: 0.9817632393525301
Energy: 0.9817632393522204
Energy: 0.8813053536789035
Energy: 0.9817632393522204
Energy: 0.8813053536792129
Energy: 0.9817632393522204
Energy: 0.8813053536789035
Energy: 0.013010087420719066
Energy: 0.9817632393525301
Energy: 0.013010087420719066
Energy: 0.9817632393525301
Energy: 0.013010087420719066
Energy: 0.9817632393525301
Energy: 0.9817632393525301
Energy: 0.8813053536795226
Energy: 0.9817632393528396
Energy: 0.8813053536792129
Energy: 0.9817632393522204
Energy: 0.8813053536792129

minimum gb energy = 0.013010087420719066 eV
minimum distance =  2.29897675505795 Angstroms
sigma value = 1


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

Energy: 1.0124164678649579
Energy: 0.9558584417470926
Energy: 1.0124164678649579
Energy: 0.9558584417456022
Energy: 1.0124164678649579
Energy: 0.9558584417478379
Energy: 1.147345156177832
Energy: 0.8906583134105182
Energy: 1.1473451554329914
Energy: 0.8906583134105182
Energy: 1.1473451510192236
Energy: 0.8906583134105182
Energy: 0.952028000339929
Energy: 1.0073904851532645
Energy: 0.9992919903676064
Energy: 1.0073904851547546
Energy: 0.9520280003391838
Energy: 1.0073904851532645
Energy: 1.0954155257581049
Energy: 0.9330441205849521
Energy: 1.0954155257536338
Energy: 0.9330441205856974
Energy: 1.0954155257491631
Energy: 0.9330441205849521
Energy: 0.9699180005546946
Energy: 1.0581135477674026
Energy: 0.9699180005554396
Energy: 1.0581135477674026
Energy: 0.9699180005546946
Energy: 1.0581135477703834
Energy: 1.016050508546369
Energy: 0.9047001653360289
Energy: 1.0160505085433884
Energy: 0.9047001653323034
Energy: 1.0160505085448786
Energy: 0.9047001653330484
Energy: 0.9569071557552876
Energy: 0.9952084464855269
Energy: 0.9569071557545423
Energy: 0.9952084464818012
Energy: 0.9569071557530522
Energy: 0.9952084464795657
Energy: 0.9292764954372207
Energy: 1.0750973120906113
Energy: 0.9292764954394561
Energy: 1.0750973120898661
Energy: 0.9292764954394561
Energy: 1.075097312089121
Energy: 1.039482744684882
Energy: 1.0021392122534358
Energy: 1.0394827446863724
Energy: 1.0021392122534358
Energy: 1.039482744684882
Energy: 1.0021392122526904
Energy: 0.8779661246878565
Energy: 1.0635479225596607
Energy: 0.8779661246878565
Energy: 1.0635479225686026
Energy: 0.8779661246871113
Energy: 1.0635479225715831
Energy: 1.1685893842233595
Energy: 0.9048955574794333
Energy: 1.1685893842203785
Energy: 0.9048955574801784
Energy: 1.168589384222614
Energy: 0.9048955574794333
Energy: 0.8623434573168036
Energy: 1.032837403394348
Energy: 0.8623434573168036
Energy: 1.032836563632916
Energy: 0.8623434573160584
Energy: 1.032835178926304
Energy: 1.119973536063204
Energy: 0.8488584354198635
Energy: 1.1199735360624588
Energy: 0.8488584354198635
Energy: 1.119973536068386
Energy: 0.8488584354198635
Energy: 0.9198160770187334
Energy: 1.0117523244750597
Energy: 0.9198160770187334
Energy: 1.0117523244638824
Energy: 0.9198160770187334
Energy: 1.01175232442588
Energy: 1.1353588375238313
Energy: 0.8848595335500494
Energy: 1.1353588375245762
Energy: 0.88485953355154
Energy: 1.1353588375253216
Energy: 0.8848595335485593
Energy: 1.1367785482956734
Energy: 1.016195118774937
Energy: 1.1367785482956734
Energy: 1.0161951187808982
Energy: 1.1367785482956734
Energy: 1.0161951187697549
Energy: 0.9861877285680255
Energy: 0.979355053801625
Energy: 0.986187728565045
Energy: 0.9793550538053506
Energy: 0.9861877285665352
Energy: 0.9793550538031153
Energy: 0.9863066623167165
Energy: 0.9416907473937655
Energy: 0.9863066623137359
Energy: 0.9416907473878382
Energy: 0.9863066623167165
Energy: 0.9416907473915301
Energy: 0.8779672213489469
Energy: 0.9319124788239568
Energy: 0.8779672213452211
Energy: 0.93191247882101
Energy: 0.8779672213444758
Energy: 0.93191247882101
Energy: 1.0178384677198082
Energy: 0.9046539852930834
Energy: 1.0178384677093761
Energy: 0.9046539852923382
Energy: 1.0178384677116117
Energy: 0.9046539852886125
Energy: 0.9020063931327544
Energy: 1.1427717980092158
Energy: 0.9020063931327544
Energy: 1.1427717980144318
Energy: 0.9020063931334996
Energy: 1.142771798013687
Energy: 1.013618632347086
Energy: 0.9976319856610136
Energy: 1.0136186323515568
Energy: 0.9976319856617588
Energy: 1.0136186323508116
Energy: 0.9976319856617588
Energy: 0.8568562725578267
Energy: 1.1711726509873166
Energy: 0.8568562725578267
Energy: 1.1711726509917872
Energy: 0.8568562725563362
Energy: 1.1711726509835907

minimum gb energy = 0.8488584354198635 eV
minimum distance =  2.32564741412333 Angstroms
sigma value = 33


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

Energy: 1.098444978991787
Energy: 0.882894596245358
Energy: 1.0188288315077907
Energy: 0.8829810310817156
Energy: 1.0984449789934823
Energy: 0.8829013036034776
Energy: 0.935155897630484
Energy: 0.9237923397785439
Energy: 0.9349381868456541
Energy: 0.923792339757352
Energy: 0.9349252378079284
Energy: 0.9237923397450608
Energy: 0.9011917909427887
Energy: 0.8069348841554076
Energy: 0.9011917909427887
Energy: 0.8069348841282821
Energy: 0.9011917909410933
Energy: 0.8069348841554076
Energy: 0.9042643302190303
Energy: 1.0862401262776786
Energy: 0.9042642966919351
Energy: 1.0862401262768309
Energy: 0.9042642715759834
Energy: 1.0862401262785264
Energy: 0.8818541240640537
Energy: 0.8398185558082711
Energy: 0.8818530765520748
Energy: 0.8398185691506329
Energy: 0.8818521462927453
Energy: 0.8398185880542256
Energy: 0.8731925106106674
Energy: 0.9031119303485203
Energy: 0.8731925307457736
Energy: 0.9046999921665467
Energy: 0.8731925463504571
Energy: 0.9031119303510633
Energy: 1.170378250888508
Energy: 0.8280324686911942
Energy: 1.170378250886813
Energy: 0.847300900235706
Energy: 1.1703782508897798
Energy: 0.8280196262496444
Energy: 0.811676854354357
Energy: 0.8845152455067302
Energy: 0.8116768679195407
Energy: 0.8845158905111997
Energy: 0.8116768785416836
Energy: 0.8845160577716584
Energy: 0.8854948843665941
Energy: 0.919415694526903
Energy: 0.8854948843674418
Energy: 0.9194156945332221
Energy: 0.885494884374647
Energy: 0.9194156945315267
Energy: 0.8866151345077561
Energy: 0.8900243829651718
Energy: 0.8865950429597714
Energy: 0.8903353457730987
Energy: 0.886615134500551
Energy: 0.8903729078861942
Energy: 0.8871865437620702
Energy: 0.8973328214823395
Energy: 0.8871865437493549
Energy: 0.8973328214827633
Energy: 0.887186543744269
Energy: 0.8973328214865776
Energy: 0.9171615141817953
Energy: 0.9783009569495261
Energy: 0.9171598261022178
Energy: 0.9783009569491022
Energy: 0.9171615141754377
Energy: 0.9783009569571552
Energy: 0.8071196139618011
Energy: 0.9099665723841972
Energy: 0.80712708311606
Energy: 0.9099665723863164
Energy: 0.8071177846032667
Energy: 0.9099665723884356
Energy: 0.8026153380598345
Energy: 0.8767730910238718
Energy: 0.8026135063009234
Energy: 0.8767728045399639
Energy: 0.8026120924381257
Energy: 0.8767726652076866
Energy: 0.8921607865241986
Energy: 0.923921055472386
Energy: 0.8921594299915575
Energy: 0.9239210554571279
Energy: 0.8921573490907833
Energy: 0.9239210554499228
Energy: 0.9010674799286765
Energy: 0.8343617618288894
Energy: 0.9010674799346103
Energy: 0.8343617619000554
Energy: 0.9010674799324911
Energy: 0.834361761958121
Energy: 0.896879529273611
Energy: 0.8124964726375916
Energy: 0.896879797735929
Energy: 0.8124964726541212
Energy: 0.8968800371296383
Energy: 0.8124964726625981
Energy: 0.8820379534037157
Energy: 0.9020280267568295
Energy: 0.8820446342469548
Energy: 0.9017280919633958
Energy: 0.8820503196073374
Energy: 0.9020280267576772
Energy: 0.8736098973554998
Energy: 0.8935129238574578
Energy: 0.8736098516964418
Energy: 0.9232932975189856
Energy: 0.8736097985137913
Energy: 0.8935129238455903
Energy: 1.0808821648639786
Energy: 1.0609680353644415
Energy: 1.0808821648627072
Energy: 1.0206010889345367
Energy: 1.0808821648597404
Energy: 1.0609680353674085
Energy: 0.830355485930109
Energy: 0.8729063795918522
Energy: 0.8303554859339236
Energy: 0.8729052888148344
Energy: 0.830355485933076
Energy: 0.872904859456959
Energy: 0.8069136564017984
Energy: 0.9190112166689514
Energy: 0.8069136564136659
Energy: 0.9190112166748851
Energy: 0.8069136563916263
Energy: 0.9190112166736135
Energy: 0.8944287377157101
Energy: 0.9096372358196242
Energy: 0.8944292133211208
Energy: 0.9096214377446658
Energy: 0.8944287377148625
Energy: 0.9093914859890816
Energy: 0.8984077036971302
Energy: 1.0055655930953489
Energy: 0.8984077036111301
Energy: 1.0055655931029777
Energy: 0.8984077035132624
Energy: 1.005565593104249
Energy: 0.9019395816583476
Energy: 0.8968173684408612
Energy: 0.9050764259953975
Energy: 0.8968173684438283
Energy: 0.9019395816596193
Energy: 0.8968173684378945
Energy: 0.8784022692381058
Energy: 1.0694587412119825
Energy: 0.8077043152009291
Energy: 1.0694587412064724
Energy: 0.8784234686212797
Energy: 1.0694587412060488
Energy: 0.8852198496287496
Energy: 0.8544803621920496
Energy: 0.8073540308080599
Energy: 0.8544784919027734
Energy: 0.8852193898970041
Energy: 0.8544756041267636
Energy: 0.9047479747706899
Energy: 0.8100030274659129
Energy: 0.9047479747745043
Energy: 0.810039570808591
Energy: 0.9047479747736568
Energy: 0.810065293398042
Energy: 0.8991259077157167
Energy: 0.8101896033754893
Energy: 0.8989855366961442
Energy: 0.8101896055004881
Energy: 0.8989555687799882
Energy: 0.8101896079428245
Energy: 0.8945866221566231
Energy: 0.9033231057408099
Energy: 0.8945866221591662
Energy: 0.903323105481114
Energy: 0.8945866221574708
Energy: 0.9033231052070076
Energy: 0.8819217113366139
Energy: 0.919400544552383
Energy: 0.8819218018655086
Energy: 0.9195857866953296
Energy: 0.8819218397672094
Energy: 0.9194005445566213
Energy: 0.9086509587432243
Energy: 0.8031193255293332
Energy: 0.9086509587453435
Energy: 0.8451263437987732
Energy: 0.9086509587394099
Energy: 0.8031131613603403
Energy: 1.0857380630852798
Energy: 1.020567333835191
Energy: 1.085738063089056
Energy: 1.0609685926673886
Energy: 1.085738063088208
Energy: 1.020567333833496
Energy: 0.8117274481136543
Energy: 0.8935645927156503
Energy: 0.8117183918864043
Energy: 0.8935636701129205
Energy: 0.8117088824460856
Energy: 0.8935636699790269
Energy: 0.8360846244523666
Energy: 0.9019267034672598
Energy: 0.8360846244655057
Energy: 0.9019267034710744
Energy: 0.8360846244561813
Energy: 0.9019267034676836
Energy: 1.0865370040989457
Energy: 0.9076014925613668
Energy: 1.086537004097674
Energy: 0.9076008571533951
Energy: 1.0865370040972504
Energy: 0.9076005438640095
Energy: 0.9011897877551444
Energy: 0.8815416618630036
Energy: 0.9012200832842285
Energy: 0.8815412605946755
Energy: 0.9011897877534489
Energy: 0.8815412015644352
Energy: 0.9224727063736072
Energy: 0.8752328330411453
Energy: 0.9224727063723358
Energy: 0.875232674248162
Energy: 0.9224727062405612
Energy: 0.875232689928211
Energy: 0.8060664416875887
Energy: 0.8836800498340419
Energy: 0.8060665686569897
Energy: 0.8836667329487006
Energy: 0.8060666700579749
Energy: 0.8836364297592022
Energy: 0.8815519103368795
Energy: 0.8299741460391742
Energy: 0.8815543991187117
Energy: 0.8299741460408696
Energy: 0.8815565889461442
Energy: 0.8299741460417173
Energy: 0.9170685826272131
Energy: 0.8938048201688377
Energy: 0.917068582622551
Energy: 0.8938048201701091
Energy: 0.917068582617041
Energy: 0.8938048201667185

minimum gb energy = 0.8026120924381257 eV
minimum distance =  2.39067157278879 Angstroms
sigma value = 51


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

Energy: 0.9969827965018799
Energy: 1.0113902621283493
Energy: 0.9969827965018799
Energy: 1.0113902621283493
Energy: 0.9969827965018799
Energy: 1.0113902621263853
Energy: 1.0680909685506699
Energy: 0.9463502279355491
Energy: 1.068090968553616
Energy: 0.9463502279365311
Energy: 1.0680909685526339
Energy: 0.9463502279355491
Energy: 0.9517972007769293
Energy: 0.9937477979909433
Energy: 0.9517972007739833
Energy: 0.9937477977661718
Energy: 0.9517972007749653
Energy: 0.9937477973097324
Energy: 0.9939045622097615
Energy: 0.8707215500690193
Energy: 0.9939045622107435
Energy: 0.8707215500719653
Energy: 0.9939045622136896
Energy: 0.8707215500680372
Energy: 1.0103951721261633
Energy: 0.9659212339578057
Energy: 1.0103951721310733
Energy: 0.9659212339578057
Energy: 1.0103951721281272
Energy: 0.9659212339587877
Energy: 1.0115400926711804
Energy: 0.9656203168364392
Energy: 1.0115400926780544
Energy: 0.9656203168403672
Energy: 1.0115400926770726
Energy: 0.9656203168354572
Energy: 0.9810148026138893
Energy: 0.9657385225717793
Energy: 0.9810148026187995
Energy: 0.9657385225688333
Energy: 0.9810148026178174
Energy: 0.9657385225658872
Energy: 0.9192679071184482
Energy: 0.9663500269190112
Energy: 0.919267907117466
Energy: 0.9663500269190112
Energy: 0.919267907117466
Energy: 0.9663500269219573
Energy: 1.1553556849900444
Energy: 0.8708185626050842
Energy: 1.1553556849929905
Energy: 0.8708185626050842
Energy: 1.1553556849900444
Energy: 0.8708185626050842
Energy: 0.8913273218134149
Energy: 1.1415669450789672
Energy: 0.891327321814397
Energy: 1.1415669450789672
Energy: 0.8913273218134149
Energy: 1.1415669450770032
Energy: 1.1512259494979664
Energy: 0.873840251122069
Energy: 1.1512259282162078
Energy: 0.8738402511230511
Energy: 1.151225830192077
Energy: 0.873840251122069
Energy: 0.9925016123372462
Energy: 1.0112596921820496
Energy: 0.9925016123382282
Energy: 1.0112596921859776
Energy: 0.9925016123372462
Energy: 1.0112596921830315
Energy: 1.1609268818848266
Energy: 0.9472372968710611
Energy: 1.1609268818907186
Energy: 0.9472372968710611
Energy: 1.1609268818789344
Energy: 0.9472372968710611
Energy: 0.9518223887568547
Energy: 0.9372888097058666
Energy: 0.9518223887568547
Energy: 0.9372888097019384
Energy: 0.9518223887607826
Energy: 0.9372888097019384
Energy: 1.0086879289052677
Energy: 1.0087613105981272
Energy: 1.0086879289062498
Energy: 1.0087613106030373
Energy: 1.0086879289042856
Energy: 1.0087613106030373
Energy: 1.0107818474814623
Energy: 0.9656837276878247
Energy: 1.0107818474804802
Energy: 0.9656837276888066
Energy: 1.0107818474716643
Energy: 0.9656837276878247
Energy: 1.0105863943546658
Energy: 1.0485274916234482
Energy: 1.010586394353684
Energy: 1.04852749162539
Energy: 1.01058639434585
Energy: 1.04852749161952
Energy: 0.9816551166002501
Energy: 0.9658754859281257
Energy: 0.981655116602214
Energy: 0.9658754859271437
Energy: 0.9816551166012322
Energy: 0.9658754859261617

minimum gb energy = 0.8707215500680372 eV
minimum distance =  2.21547992283156 Angstroms
sigma value = 19


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

Energy: 0.8327007429628155
Energy: 0.8413622477463072
Energy: 0.8327007429569905
Energy: 0.8413622477474723
Energy: 0.8327007429587379
Energy: 0.8413622477468897
Energy: 0.9693735828178366
Energy: 1.0081728545174937
Energy: 0.9693735828253828
Energy: 1.0081728545215713
Energy: 0.9693735828236353
Energy: 1.0081728545169113
Energy: 0.7972083266990825
Energy: 1.0082358856805458
Energy: 0.797208326699665
Energy: 1.0082358856822933
Energy: 0.797208326699665
Energy: 1.0082358856735558
Energy: 0.8722042457199962
Energy: 0.7972416946763445
Energy: 0.8722042457188313
Energy: 0.7972416946751796
Energy: 0.8722042457165012
Energy: 0.7972416946769272
Energy: 0.8238284255242527
Energy: 0.8324869113725502
Energy: 0.8238284255248352
Energy: 0.8324869113719676
Energy: 0.8238284255230877
Energy: 0.8324869113719676
Energy: 0.8238158229786577
Energy: 0.8324582013909261
Energy: 0.8238158229780751
Energy: 0.8324582013915086
Energy: 0.8238158229763277
Energy: 0.8324582013915086
Energy: 0.8722424414491942
Energy: 0.7972299350500729
Energy: 0.8722424414468641
Energy: 0.7972299350506553
Energy: 0.8722424414491942
Energy: 0.7972299350524028
Energy: 0.7971977535332689
Energy: 1.0082890167721006
Energy: 0.7971977535338514
Energy: 1.0082890167744305
Energy: 0.7971977535326863
Energy: 1.0082890167697707
Energy: 0.9693689816106261
Energy: 1.0082017703303425
Energy: 0.9693689816088785
Energy: 1.0082017703326722
Energy: 0.9693689816094611
Energy: 1.0082017703280122
Energy: 0.8327007429581554
Energy: 0.8413622477463072
Energy: 0.8327007429616504
Energy: 0.8413622477463072
Energy: 0.8327007429564077
Energy: 0.8413622477457512
Energy: 0.969373582814924
Energy: 1.0081728545157462
Energy: 0.9693735828201402
Energy: 1.0081728545192412
Energy: 0.9693735828213051
Energy: 1.0081728545174937
Energy: 0.797208326699665
Energy: 1.0082358856776334
Energy: 0.797208326699665
Energy: 1.0082358856787985
Energy: 0.797208326699665
Energy: 1.0082358856787985
Energy: 0.8722042457217438
Energy: 0.7972416946740147
Energy: 0.8722042457159187
Energy: 0.7972416946751796
Energy: 0.8722042457205786
Energy: 0.7972416946763445
Energy: 0.8238284255236703
Energy: 0.8324869113725502
Energy: 0.8238284255225051
Energy: 0.8324869113725502
Energy: 0.8238284255230877
Energy: 0.8324869113725502
Energy: 0.8238158229757453
Energy: 0.8324582013909261
Energy: 0.8238158229774927
Energy: 0.832458201392091
Energy: 0.8238158229792403
Energy: 0.832458201392091
Energy: 0.8722424414521067
Energy: 0.7972299350518204
Energy: 0.8722424414491942
Energy: 0.7972299350512378
Energy: 0.8722424414491942
Energy: 0.7972299350518204
Energy: 0.7971977535332689
Energy: 1.008289016771518
Energy: 0.7971977535338514
Energy: 1.0082890167686054
Energy: 0.7971977535326863
Energy: 1.008289016768023
Energy: 0.9693689816123736
Energy: 1.0082017703338373
Energy: 0.9693689816141211
Energy: 1.0082017703320898
Energy: 0.9693689816112085
Energy: 1.0082017703350024
Energy: 0.8327007429564077
Energy: 0.8413622477480547
Energy: 0.8327007429593203
Energy: 0.8413622477457512
Energy: 0.8327007429593203
Energy: 0.8413622477457512
Energy: 0.9693735828189751
Energy: 1.0081728545209887
Energy: 0.9693735828236353
Energy: 1.0081728545209887
Energy: 0.9693735828236353
Energy: 1.0081728545163289
Energy: 0.7972083266985
Energy: 1.0082358856764682
Energy: 0.797208326699665
Energy: 1.0082358856776334
Energy: 0.797208326699665
Energy: 1.0082358856782159
Energy: 0.8722042457182488
Energy: 0.797241694675762
Energy: 0.8722042457176664
Energy: 0.797241694675762
Energy: 0.8722042457229088
Energy: 0.797241694675762
Energy: 0.8238284255242527
Energy: 0.8324869113725502
Energy: 0.8238284255236703
Energy: 0.8324869113719676
Energy: 0.8238284255225051
Energy: 0.8324869113719676
Energy: 0.8238158229786577
Energy: 0.8324582013915086
Energy: 0.8238158229798228
Energy: 0.8324582013915086
Energy: 0.8238158229763277
Energy: 0.8324582013909261
Energy: 0.8722424414538543
Energy: 0.7972299350512378
Energy: 0.8722424414503593
Energy: 0.7972299350500729
Energy: 0.8722424414462817
Energy: 0.7972299350524028
Energy: 0.7971977535332689
Energy: 1.0082890167721006
Energy: 0.7971977535326863
Energy: 1.0082890167686054
Energy: 0.7971977535326863
Energy: 1.0082890167709355
Energy: 0.9693689816146772
Energy: 1.0082017703326722
Energy: 0.9693689816112085
Energy: 1.0082017703361674
Energy: 0.9693689816053835
Energy: 1.0082017703338373
Energy: 0.8327007429552429
Energy: 0.8413622477468897
Energy: 0.8327007429564077
Energy: 0.8413622477463072
Energy: 0.8327007429569905
Energy: 0.8413622477463072
Energy: 0.9693735828178366
Energy: 1.0081728545174937
Energy: 0.9693735828224702
Energy: 1.0081728545157462
Energy: 0.969373582817254
Energy: 1.0081728545180761
Energy: 0.7972083267002474
Energy: 1.0082358856793807
Energy: 0.797208326699665
Energy: 1.0082358856782159
Energy: 0.797208326699665
Energy: 1.0082358856776334

minimum gb energy = 0.7971977535326863 eV
minimum distance =  2.2388833844667 Angstroms
sigma value = 27


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

Energy: 0.8183567770586898
Energy: 0.802949951211465
Energy: 0.818356777057263
Energy: 0.802949951211465
Energy: 0.818356777057263
Energy: 0.802949951211465
Energy: 0.8874926248015208
Energy: 0.8377518373197791
Energy: 0.8874926248029475
Energy: 0.8377518373183522
Energy: 0.8874926248015208
Energy: 0.8377518373183522
Energy: 0.8166562421637951
Energy: 0.9000453933365723
Energy: 0.8166562421637951
Energy: 0.9000453933365723
Energy: 0.8166562421637951
Energy: 0.9000453933365723
Energy: 0.9150020574689617
Energy: 0.7799959590016577
Energy: 0.9150020574703887
Energy: 0.7799959590002309
Energy: 0.9150020574689617
Energy: 0.7799959590002309
Energy: 0.9142093279029424
Energy: 0.7799341039703661
Energy: 0.9142093279029424
Energy: 0.7799341039689394
Energy: 0.9142093279057961
Energy: 0.7799341039689394
Energy: 0.9228310730891944
Energy: 0.9601418268173132
Energy: 0.9228310730920483
Energy: 0.9601418268130326
Energy: 0.9228310730891944
Energy: 0.9601418268158864
Energy: 0.8740501663555149
Energy: 0.8406095837649791
Energy: 0.8740501663569417
Energy: 0.8406095837649791
Energy: 0.8740501663612223
Energy: 0.8406095837649791
Energy: 0.8172771566185555
Energy: 0.8038686673560819
Energy: 0.8172771566185555
Energy: 0.803868667354655
Energy: 0.8172771566171285
Energy: 0.803868667354655
Energy: 0.9486044723410876
Energy: 0.8173035782909699
Energy: 0.9486044723425143
Energy: 0.8173035782895431
Energy: 0.9486044723410876
Energy: 0.8173035782909699
Energy: 0.883493575562689
Energy: 0.9468106759861544
Energy: 0.883493575562689
Energy: 0.9468106759847276
Energy: 0.8834935755612621
Energy: 0.9468106759861544
Energy: 0.9412167500033043
Energy: 0.7817386212161923
Energy: 0.9412167500033043
Energy: 0.7817386212161923
Energy: 0.8022616583354932
Energy: 0.7817386212161923
Energy: 0.9700509797307725
Energy: 0.8908047326474058
Energy: 0.9700509797321992
Energy: 0.8908047326459789
Energy: 0.9700509797307725
Energy: 0.8908047326516862

minimum gb energy = 0.7799341039689394 eV
minimum distance =  2.19638876324784 Angstroms
sigma value = 9


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

Energy: 0.8267305890954434
Energy: 0.7851787532319661
Energy: 0.8267305890946416
Energy: 0.7851787532323671
Energy: 0.8267305890958444
Energy: 0.7851787532323671
Energy: 0.7866971280966821
Energy: 0.77629745086762
Energy: 0.786697128097885
Energy: 0.7488111493191983
Energy: 0.786697128101894
Energy: 0.7488111493187976
Energy: 0.7165488413057324
Energy: 0.8139764534153062
Energy: 0.7165488413041287
Energy: 0.8139764534229235
Energy: 0.7165488413085387
Energy: 0.81397645342132
Energy: 0.7560481239186028
Energy: 0.7128812432621937
Energy: 0.7560481239210082
Energy: 0.7128812432621937
Energy: 0.7560481239210082
Energy: 0.7128812432613919
Energy: 0.7761572849247327
Energy: 0.7519709962147213
Energy: 0.7761572849263364
Energy: 0.7519709962155231
Energy: 0.7761572849251337
Energy: 0.7519709962151222
Energy: 0.7951477369321602
Energy: 0.8104313244559757
Energy: 0.7951477369361692
Energy: 0.8104313244603856
Energy: 0.79514773693657
Energy: 0.810431324453971
Energy: 0.7577451658417435
Energy: 0.8137162191731693
Energy: 0.7577451658437481
Energy: 0.8137162191707639
Energy: 0.7577451658341627
Energy: 0.8137162191687592
Energy: 0.7013502806298774
Energy: 0.8130208093671714
Energy: 0.7013502806306793
Energy: 0.8130208093667703
Energy: 0.7013502806298774
Energy: 0.8130208093631621
Energy: 0.8042186988651594
Energy: 0.7530989122458718
Energy: 0.8042186816128853
Energy: 0.7530989122454709
Energy: 0.8042186524344841
Energy: 0.7530989122454709
Energy: 0.7766848003919838
Energy: 0.95192432351826
Energy: 0.7766848003919838
Energy: 0.9519243235210663
Energy: 0.7766848003943891
Energy: 0.9519243235162556
Energy: 0.7520951938184959
Energy: 0.7163448497998683
Energy: 0.752095193820464
Energy: 0.7163448497998683
Energy: 0.7520951938168922
Energy: 0.7163448497998683
Energy: 0.7374667635586265
Energy: 0.833880377877829
Energy: 0.737466763556221
Energy: 0.8338803772943608
Energy: 0.737466763560631
Energy: 0.8338803766852346
Energy: 0.7775608147810916
Energy: 0.7727124175729955
Energy: 0.7775607945000971
Energy: 0.7727124175613692
Energy: 0.7775607555402488
Energy: 0.7727124175653783
Energy: 0.8188515166221789
Energy: 0.9773413464055358
Energy: 0.8188515166205754
Energy: 0.9773413464047341
Energy: 0.8188515166277919
Energy: 0.9773413464051348
Energy: 0.7277848729396377
Energy: 0.7944209455135663
Energy: 0.7277848729404395
Energy: 0.7944209455127647
Energy: 0.7277848729400386
Energy: 0.7944209455111972
Energy: 0.7229702962815496
Energy: 0.8561798673171479
Energy: 0.7229702962651489
Energy: 0.8523919307003458
Energy: 0.7229702962475089
Energy: 0.8561798673127379
Energy: 0.93538192395323
Energy: 0.7133936124695295
Energy: 0.9353819239520275
Energy: 0.7133936124691286
Energy: 0.93538192395323
Energy: 0.7133936124707322
Energy: 0.7435783733674995
Energy: 0.7527702575843292
Energy: 0.7435783733747159
Energy: 0.7527702575847302
Energy: 0.743578373369905
Energy: 0.7527702575847302
Energy: 0.6967214052529912
Energy: 0.9399068925674442
Energy: 0.696721405257802
Energy: 0.9399068925610295
Energy: 0.6967214052541939
Energy: 0.9399068925578223
Energy: 0.8650948044494661
Energy: 0.7967241312273449
Energy: 0.8650948044474617
Energy: 0.7153465624199279
Energy: 0.8650948044482635
Energy: 0.7153465624175225
Energy: 0.6967305581036649
Energy: 0.9397949353410374
Energy: 0.696730558098854
Energy: 0.9397949353390328
Energy: 0.6967305581012594
Energy: 0.9397949353394337
Energy: 0.7435891899593251
Energy: 0.7527712255493006
Energy: 0.7435891899625325
Energy: 0.7527712255497017
Energy: 0.7435891899581225
Energy: 0.7527712255493006
Energy: 0.9352410090839631
Energy: 0.7134955271394118
Energy: 0.9352410090851656
Energy: 0.7134955271422182
Energy: 0.9352410090871703
Energy: 0.71349552713861
Energy: 0.7230050905974251
Energy: 0.8055836892670675
Energy: 0.7230050905942179
Energy: 0.805583689261455
Energy: 0.723005090593817
Energy: 0.8055836892682703
Energy: 0.7279405654481477
Energy: 0.7945978950597048
Energy: 0.7279405654417332
Energy: 0.7945978950613084
Energy: 0.7279405654437376
Energy: 0.7945978950601056
Energy: 0.8188267051852132
Energy: 0.7938553233388916
Energy: 0.8188267051832085
Energy: 0.7938553233388916
Energy: 0.8188267051860149
Energy: 0.7938553233381263
Energy: 0.7775397694676188
Energy: 0.7726041788059557
Energy: 0.7775397427753262
Energy: 0.7726041788027483
Energy: 0.7775396936970488
Energy: 0.772604178799942
Energy: 0.7374778171963751
Energy: 0.7793326269063697
Energy: 0.7374778171975777
Energy: 0.7793326269031624
Energy: 0.7374778171955733
Energy: 0.7793326269007569
Energy: 0.7520969555282858
Energy: 0.7165721073242173
Energy: 0.752096955527484
Energy: 0.7165721073238164
Energy: 0.7520969555294886
Energy: 0.7165721073234155
Energy: 0.7769087228942453
Energy: 0.7966940681814718
Energy: 0.7769087228962497
Energy: 0.7966940513191362
Energy: 0.7769087228978535
Energy: 0.7966940347408992
Energy: 0.8041819391616155
Energy: 0.7528726514144927
Energy: 0.8041819173738961
Energy: 0.752872651413691
Energy: 0.8041818768972638
Energy: 0.75287265141329
Energy: 0.7014826216629007
Energy: 0.813012656339618
Energy: 0.7014826216633017
Energy: 0.8130126563352079
Energy: 0.7014826216629007
Energy: 0.8130126563376135
Energy: 0.7576906744153202
Energy: 0.8137489221247358
Energy: 0.757690674416924
Energy: 0.813748922128344
Energy: 0.7576906744117121
Energy: 0.8137489221255377
Energy: 0.7949961181569599
Energy: 0.7777247182795727
Energy: 0.7949961181553562
Energy: 0.7777247182731581
Energy: 0.7949961181645772
Energy: 0.77772471827396
Energy: 0.7761616488416636
Energy: 0.7519817818540876
Energy: 0.7761616488416636
Energy: 0.7519817818544885
Energy: 0.7761616488408617
Energy: 0.7519817818536867
Energy: 0.7560491583099066
Energy: 0.7128032597033452
Energy: 0.7560491583091047
Energy: 0.7128032597021425
Energy: 0.7560491583111093
Energy: 0.7128032597033452
Energy: 0.7164637331826138
Energy: 0.8140187507877393
Energy: 0.7164637331870238
Energy: 0.8140187507949557
Energy: 0.7164637331838165
Energy: 0.8140187507985275
Energy: 0.7866379602352938
Energy: 0.717674143090522
Energy: 0.7866379602320863
Energy: 0.7176741430897202
Energy: 0.7866379602276765
Energy: 0.7852661894545027
Energy: 0.8267305890962452
Energy: 0.7851787532327679
Energy: 0.8267305890962452
Energy: 0.7851787532331689
Energy: 0.8267305890958444
Energy: 0.7851787532331689
Energy: 0.7866971280934749
Energy: 0.7488111493187976
Energy: 0.7866971280938759
Energy: 0.7488111493183967
Energy: 0.7866971281002905
Energy: 0.7488111493183967
Energy: 0.7165488413029258
Energy: 0.8139764534137026
Energy: 0.7165488413029258
Energy: 0.81397645342132
Energy: 0.716548841302124
Energy: 0.8139764534145044
Energy: 0.7560481239174001
Energy: 0.7128812432633965
Energy: 0.756048123917801
Energy: 0.7128812432621937
Energy: 0.7560481239161974
Energy: 0.7128812432605901
Energy: 0.7761572849247327
Energy: 0.7519709962143204
Energy: 0.7761572849239309
Energy: 0.7519709962147213
Energy: 0.7761572849271382
Energy: 0.7519709962143204

minimum gb energy = 0.6967214052529912 eV
minimum distance =  2.33609596270143 Angstroms
sigma value = 57


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

Energy: 0.3734761201316301
Energy: 0.38127671521360434
Energy: 0.3734761201316301
Energy: 0.38127671521360434
Energy: 0.3734761201298049
Energy: 0.381276715214517
Energy: 0.43894108980426233
Energy: 0.3737964467318627
Energy: 0.43894108980426233
Energy: 0.3737964467254744
Energy: 0.43894108980517504
Energy: 0.37379644672364915
Energy: 0.40683930693571335
Energy: 0.44518467957360636
Energy: 0.4068393069384512
Energy: 0.4451846795872956
Energy: 0.4068393069375385
Energy: 0.4451846795891208
Energy: 0.38309827698855
Energy: 0.37305698339022486
Energy: 0.3830982769876374
Energy: 0.3730569833801861
Energy: 0.3830982769876374
Energy: 0.3730569833911375
Energy: 0.4388969861353053
Energy: 0.4405170637502456
Energy: 0.43889698613439265
Energy: 0.4405170637392943
Energy: 0.43889698613439265
Energy: 0.4405170637465952
Energy: 0.3732122961466204
Energy: 0.40856195040532955
Energy: 0.37321229614296997
Energy: 0.40856195040532955
Energy: 0.37321229615209606
Energy: 0.40856195040532955
Energy: 0.37322034795838893
Energy: 0.4078635691239724
Energy: 0.37322034795565107
Energy: 0.4078635691239724
Energy: 0.37322034795838893
Energy: 0.4078635691239724
Energy: 0.4389387386593338
Energy: 0.44045661592395013
Energy: 0.4389387386593338
Energy: 0.44045661592760066
Energy: 0.43893873866024635
Energy: 0.4404566159266879
Energy: 0.38324434665611273
Energy: 0.37305152552030113
Energy: 0.3832443466533749
Energy: 0.37305152551847587
Energy: 0.38324434666067586
Energy: 0.3730515255248642
Energy: 0.40681908244812476
Energy: 0.4451868592215965
Energy: 0.40681908244994996
Energy: 0.44518685921155776
Energy: 0.40681908244812476
Energy: 0.4451868592060821
Energy: 0.43890529812885587
Energy: 0.3736938339312871
Energy: 0.4389052981297685
Energy: 0.37369383392854927
Energy: 0.43890529812794327
Energy: 0.3736938339312871
Energy: 0.3734761201298049
Energy: 0.38127671521634215
Energy: 0.3734761201316301
Energy: 0.381276715214517
Energy: 0.37347612013071746
Energy: 0.38127671521634215
Energy: 0.43894108980517504
Energy: 0.37379644672456175
Energy: 0.43894108980426233
Energy: 0.37379644672364915
Energy: 0.43894108980426233
Energy: 0.3737964467300374
Energy: 0.4068393069384512
Energy: 0.44518467958638286
Energy: 0.4068393069366259
Energy: 0.445184679590946
Energy: 0.4068393069384512
Energy: 0.44518467959642166
Energy: 0.3830982769894626
Energy: 0.3730569833929627
Energy: 0.3830982769894626
Energy: 0.37305698338657445
Energy: 0.38309827699037524
Energy: 0.3730569833883997
Energy: 0.4388969861353053
Energy: 0.4405170637484204
Energy: 0.43889698613621786
Energy: 0.4405170637456826
Energy: 0.43889698613621786
Energy: 0.4405170637529835
Energy: 0.37321229614114476
Energy: 0.40856195040532955
Energy: 0.3732122961384069
Energy: 0.40856195040624216
Energy: 0.3732122961539213
Energy: 0.40856195040532955
Energy: 0.37322034795930153
Energy: 0.4078635691239724
Energy: 0.37322034795930153
Energy: 0.4078635691239724
Energy: 0.37322034796386466
Energy: 0.4078635691239724
Energy: 0.43893873866024635
Energy: 0.44045661592760066
Energy: 0.43893873866024635
Energy: 0.44045661592760066
Energy: 0.43893873866024635
Energy: 0.44045661592029967

minimum gb energy = 0.37305152551847587 eV
minimum distance =  2.45320793987873 Angstroms
sigma value = 11


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

Energy: 0.6476359912103672
Energy: 0.7857484146105774
Energy: 0.64763599120903
Energy: 0.7857484146099091
Energy: 0.6476359912096986
Energy: 0.7857484146105774
Energy: 0.8011428352233699
Energy: 0.6836971196458365
Energy: 0.8011428352247069
Energy: 0.683697119645168
Energy: 0.8011428352240383
Energy: 0.6836971196458365
Energy: 0.8405094395810861
Energy: 1.0207788060088092
Energy: 0.8162548430139072
Energy: 1.0207788060094778
Energy: 0.8162548430119017
Energy: 1.0207788060081406
Energy: 0.9087110542019693
Energy: 0.6142746325715037
Energy: 0.9087110542019693
Energy: 0.6142746325715037
Energy: 0.9087110542019693
Energy: 0.6142746325715037
Energy: 0.7572366764512153
Energy: 0.5949528290382877
Energy: 0.7572366764518838
Energy: 0.5949528290376193
Energy: 0.7572366764525522
Energy: 0.5949528290376193
Energy: 0.7206411498514346
Energy: 0.6123548471993386
Energy: 0.7206411498514346
Energy: 0.6123548471966647
Energy: 0.7206411498507661
Energy: 0.6123548471953276
Energy: 0.5879452858991636
Energy: 0.7590766144072367
Energy: 0.5879452858984949
Energy: 0.7590766144145903
Energy: 0.5879452858984949
Energy: 0.7590766144085738
Energy: 0.7821643566696214
Energy: 0.5698165998419361
Energy: 0.7821643566696214
Energy: 0.5698165998412675
Energy: 0.7821643566682842
Energy: 0.5698165998419361
Energy: 0.7813921170950417
Energy: 0.572537183916649
Energy: 0.7813921170950417
Energy: 0.5725371839173176
Energy: 0.7813921170970471
Energy: 0.572537183916649
Energy: 0.5819326176579199
Energy: 0.8572072933768772
Energy: 0.5819326176585883
Energy: 0.8572072907521352
Energy: 0.5819326176592569
Energy: 0.8572072860680263
Energy: 0.9031209892512267
Energy: 0.7374934040452154
Energy: 0.903120989249221
Energy: 0.7374934040445469
Energy: 0.9031209892518952
Energy: 0.7374934040452154
Energy: 0.7593440450492537
Energy: 0.6091671950832646
Energy: 0.7593440450519275
Energy: 0.6091671950832646
Energy: 0.7593440450512591
Energy: 0.6091671950832646
Energy: 0.8010970630991361
Energy: 0.618222246201344
Energy: 0.8010970630977992
Energy: 0.6182222462006756
Energy: 0.8010970630984675
Energy: 0.6182222462006756
Energy: 0.8687170762035744
Energy: 0.9872192914489781
Energy: 0.8687170762022373
Energy: 0.9872192914489781
Energy: 0.8687170762035744
Energy: 0.9872192914516523
Energy: 0.9325507615390081
Energy: 0.6855982543893542
Energy: 0.932550761536334
Energy: 0.6855982543886856
Energy: 0.9325507615376709
Energy: 0.6855982543900226
Energy: 0.6286006097689321
Energy: 0.7814712420737208
Energy: 0.6286006097669266
Energy: 0.7814712420743891
Energy: 0.6286006097669266
Energy: 0.7814712420737208
Energy: 0.6919051672393549
Energy: 0.6776908657056345
Energy: 0.6919051672393549
Energy: 0.6776908657042976
Energy: 0.6919051672373493
Energy: 0.6776908657042976
Energy: 0.9889274256183279
Energy: 0.8760541366073634
Energy: 0.9889274256203334
Energy: 0.8760541366080319
Energy: 0.9889274256189966
Energy: 0.8760541366080319
Energy: 0.8538814034295171
Energy: 0.6115507545691932
Energy: 0.8538814034301856
Energy: 0.6115507545698617
Energy: 0.853881403430854
Energy: 0.6115507545705303
Energy: 0.7591233742988669
Energy: 0.6967757346279569
Energy: 0.7591233742988669
Energy: 0.6967757346272884
Energy: 0.7591233743022096
Energy: 0.6967757346279569
Energy: 0.5831713868579145
Energy: 0.7006389686919873
Energy: 0.5831713868565775
Energy: 0.7006389686933243
Energy: 0.583171386855909
Energy: 0.700638968692656
Energy: 0.735942824811729
Energy: 0.7583605611979531
Energy: 0.7359428248137344
Energy: 0.7583605611966161
Energy: 0.7359428248110604
Energy: 0.7583605611979531
Energy: 0.7839893888133062
Energy: 0.7015391081814825
Energy: 0.7839893888133062
Energy: 0.701539108180814
Energy: 0.7839893888133062
Energy: 0.701539108183488
Energy: 0.7821905582021954
Energy: 0.6743879301124516
Energy: 0.7821905582001899
Energy: 0.67438793011312
Energy: 0.7821905581995213
Energy: 0.6743879301124516
Energy: 0.5834099828629746
Energy: 0.8577620400583617
Energy: 0.5834099828636431
Energy: 0.8577615088945042
Energy: 0.5834099828636431
Energy: 0.8577609569653519
Energy: 1.103454267196681
Energy: 0.7372361480874116
Energy: 1.103454267196681
Energy: 0.7372361480874116
Energy: 1.1034542671953438
Energy: 0.7372361480880799

minimum gb energy = 0.5698165998412675 eV
minimum distance =  2.32126114487247 Angstroms
sigma value = 41


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

Energy: 0.7287942135488157
Energy: 0.6576664150057627
Energy: 0.7287942135488157
Energy: 0.6576664150062895
Energy: 0.7287942135488157
Energy: 0.6576664150057627
Energy: 0.8538657145067179
Energy: 0.8028619137878328
Energy: 0.8538657145072448
Energy: 0.8028619137878328
Energy: 0.8538657145077717
Energy: 0.8028619137878328
Energy: 0.7782235943081558
Energy: 1.1638979792702526
Energy: 0.7782235943086827
Energy: 1.1638979792454884
Energy: 0.778223594307102
Energy: 1.163897979149641
Energy: 0.6932794259018894
Energy: 0.6541357957956556
Energy: 0.6932794259024163
Energy: 0.6541357957956556
Energy: 0.6932794259024163
Energy: 0.6541357957956556
Energy: 0.637389575727026
Energy: 0.692367288228365
Energy: 0.637389575727026
Energy: 0.692367288228365
Energy: 0.637389575727026
Energy: 0.692367288228365
Energy: 0.8276014080545496
Energy: 0.8157345327634701
Energy: 0.8276014080550765
Energy: 0.815734532763997
Energy: 0.8276014080545496
Energy: 0.8157345327634701
Energy: 0.6456963049687253
Energy: 0.9319415947259773
Energy: 0.6456963049692522
Energy: 0.9319415947270311
Energy: 0.6456963049681984
Energy: 0.9319415947286118
Energy: 0.6332146603425228
Energy: 0.6546018907552005
Energy: 0.633214660341469
Energy: 0.6546018907552005
Energy: 0.633214660341469
Energy: 0.6546018907552005
Energy: 0.6453945747434765
Energy: 0.6773166141387208
Energy: 0.6453945747429496
Energy: 0.6773166141387208
Energy: 0.6453945747424227
Energy: 0.6773166141387208
Energy: 0.6937963081929837
Energy: 0.8889931354281988
Energy: 0.6937963081924566
Energy: 0.8889931354292526
Energy: 0.6937963081929837
Energy: 0.888993135427145
Energy: 0.6883835310837791
Energy: 0.9894710438438871
Energy: 0.6883835310837791
Energy: 0.9894710438412525
Energy: 0.6883835310832522
Energy: 0.989471043839672
Energy: 0.6264231954086269
Energy: 0.7859345817847795
Energy: 0.6264231954091538
Energy: 0.7859345817847795
Energy: 0.6264231954086269
Energy: 0.7859345817842527
Energy: 0.6325762070133185
Energy: 0.6487199832638307
Energy: 0.6325762070112109
Energy: 0.6487199832638307
Energy: 0.6325762070127916
Energy: 0.6487199832638307
Energy: 0.6096406826293831
Energy: 0.8849531531022188
Energy: 0.6096406826293831
Energy: 0.8849531531016919
Energy: 0.60964068262991
Energy: 0.8849531531027457
Energy: 0.8263206062832716
Energy: 0.8167977141154065
Energy: 0.8263206062832716
Energy: 0.8167977141154065
Energy: 0.8263206062843255
Energy: 0.8167977141154065
Energy: 0.6098280635236648
Energy: 0.8026417456242418
Energy: 0.6098280635226111
Energy: 0.8026417456242418
Energy: 0.6098280635236648
Energy: 0.8026417456242418
Energy: 0.637252324332053
Energy: 0.6489482078852961
Energy: 0.6372523243331069
Energy: 0.6489482078847691
Energy: 0.6372523243331069
Energy: 0.6489482078852961
Energy: 0.7619065482072838
Energy: 1.1660326779506691
Energy: 0.7619065482072838
Energy: 1.166032677945927
Energy: 0.761906548206757
Energy: 1.166032677946981
Energy: 0.8598910392678745
Energy: 0.9022597629919528
Energy: 0.8598910392662936
Energy: 0.9022597629919528
Energy: 0.8598910392668206
Energy: 0.9022597629919528
Energy: 0.6874362688476592
Energy: 0.9183632110603249
Energy: 0.6874362688460784
Energy: 0.918363211060852
Energy: 0.6874362688466054
Energy: 0.918363211060852
Energy: 0.6555056448337757
Energy: 0.7960258054911521
Energy: 0.6555056448337757
Energy: 0.7960258054911521
Energy: 0.6555056448337757
Energy: 0.7960258054916788
Energy: 0.7778878603356705
Energy: 1.0594049431307926
Energy: 0.7778878603361974
Energy: 1.0594049431307926
Energy: 0.7778878603351436
Energy: 1.0594049431313195
Energy: 0.6933673459040037
Energy: 0.6497469763086865
Energy: 0.6933673459040037
Energy: 0.6497469763086865
Energy: 0.6933673459034768
Energy: 0.6497469763086865
Energy: 0.6100116440576697
Energy: 0.9296967239310435
Energy: 0.6100116440571428
Energy: 0.9296967239310435
Energy: 0.6100116440581966
Energy: 0.9296967239305166
Energy: 0.6138995285350544
Energy: 0.9310552637421505
Energy: 0.6138995285366351
Energy: 0.9310552637416237
Energy: 0.6138995285350544
Energy: 0.9310552637421505
Energy: 0.6453555719966043
Energy: 0.646341292706044
Energy: 0.6453555719966043
Energy: 0.646341292706044
Energy: 0.6453555719971312
Energy: 0.646341292706044
Energy: 0.6359412416673433
Energy: 0.6496093052687492
Energy: 0.6359412416657628
Energy: 0.6496093052687492
Energy: 0.6359412416662896
Energy: 0.6496093052687492
Energy: 0.6420381060347012
Energy: 0.9020351804467929
Energy: 0.6420381060352282
Energy: 0.9020351804473197
Energy: 0.6420381060352282
Energy: 0.9020351804473197
Energy: 0.6873259787505988
Energy: 0.810593250868433
Energy: 0.6873259787505988
Energy: 0.8105932508679062
Energy: 0.6873259787505988
Energy: 0.8105932508689598
Energy: 0.9231031731073411
Energy: 0.60885991751452
Energy: 0.9231031731105026
Energy: 0.60885991751452
Energy: 0.923103173108395
Energy: 0.60885991751452
Energy: 0.6274741359546822
Energy: 0.7858980205551989
Energy: 0.6274741359541554
Energy: 0.7858980205551989
Energy: 0.6274741359552091
Energy: 0.785898020554672
Energy: 0.6541338430214754
Energy: 0.6773980164853296
Energy: 0.6541338430225292
Energy: 0.6773980164853296
Energy: 0.6541338430209485
Energy: 0.6773980164853296
Energy: 0.613536726813815
Energy: 0.8158401145476347
Energy: 0.6135367268143419
Energy: 0.8158401145476347
Energy: 0.6135367268148688
Energy: 0.8158401145476347

minimum gb energy = 0.60885991751452 eV
minimum distance =  2.39151116072442 Angstroms
sigma value = 33


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

Energy: 0.7579438302816369
Energy: 0.679490527501832
Energy: 0.7579438302786787
Energy: 0.6794905274863012
Energy: 0.7579438302812672
Energy: 0.6794905274992435
Energy: 0.7567345960072139
Energy: 0.6484206849464589
Energy: 0.756734595998709
Energy: 0.6484206849468286
Energy: 0.7567345959890946
Energy: 0.6484206849468286
Energy: 0.7050193935572444
Energy: 0.7815623401595816
Energy: 0.7050193935550594
Energy: 0.7815623401621701
Energy: 0.705019393557984
Energy: 0.78156234016254
Energy: 0.6952552868639286
Energy: 0.6693684496027371
Energy: 0.695255286855827
Energy: 0.6693684496016278
Energy: 0.6952552868432544
Energy: 0.6693684495949717
Energy: 0.6957327061253568
Energy: 0.667439214632651
Energy: 0.6957327061257266
Energy: 0.6674392146400466
Energy: 0.6957327061257266
Energy: 0.6674392146227005
Energy: 0.9325425242406447
Energy: 0.689401606896654
Energy: 0.9325425242406447
Energy: 0.6894016068925864
Energy: 0.932542524238426
Energy: 0.6894016068929562
Energy: 0.6802675803842251
Energy: 0.7467153464884937
Energy: 0.6802675803864437
Energy: 0.7467153464910822
Energy: 0.6802675803838553
Energy: 0.7467153464881239
Energy: 0.7191629438603666
Energy: 0.721464399025243
Energy: 0.7191629438673925
Energy: 0.7214643990222847
Energy: 0.7191629438611062
Energy: 0.7214643990241336
Energy: 0.6827389565023756
Energy: 0.7029102705098157
Energy: 0.6827389564975683
Energy: 0.7029102705068574
Energy: 0.6827389565112504
Energy: 0.7029102705090761
Energy: 0.9798556576503683
Energy: 0.6723916744529755
Energy: 0.9798556576418633
Energy: 0.6723916744529755
Energy: 0.9798556576267022
Energy: 0.6723916744537152
Energy: 0.7197849068180926
Energy: 0.7182675000012531
Energy: 0.7197849068184624
Energy: 0.718267499999774
Energy: 0.7197849068195716
Energy: 0.7182674999887141
Energy: 1.1297692172008678
Energy: 0.6695172793483288
Energy: 1.1297692172001284
Energy: 0.669517279351287
Energy: 1.129769217201238
Energy: 0.6695172793509173
Energy: 0.7089953272358934
Energy: 0.6833583457108544
Energy: 0.7089953272362632
Energy: 0.6833583457119639
Energy: 0.7089953272336748
Energy: 0.6833583457119639
Energy: 0.7347087853537694
Energy: 0.7251232852018151
Energy: 0.7347087853537694
Energy: 0.7251232852051432
Energy: 0.7347087853526602
Energy: 0.7251232852036641
Energy: 0.7252532481326636
Energy: 0.6787955981547676
Energy: 0.7252532481337729
Energy: 0.6787955981540281
Energy: 0.7252532481326636
Energy: 0.6787955981543979
Energy: 0.6939489042956464
Energy: 0.9346730438114074
Energy: 0.6939489042923519
Energy: 0.9346730438106678
Energy: 0.6939489042893937
Energy: 0.9346730438114074
Energy: 0.6639468062647631
Energy: 0.6614702328155678
Energy: 0.6639648815312581
Energy: 0.6614702307874822
Energy: 0.6639499702751022
Energy: 0.6614702345343142
Energy: 0.6659326207678109
Energy: 0.6967488952291373
Energy: 0.6659326207667016
Energy: 0.6967488952309863
Energy: 0.6659326207678109
Energy: 0.6967488952298768
Energy: 0.9754963460987626
Energy: 0.7046718369853421
Energy: 0.9754963461013509
Energy: 0.7046718369879305
Energy: 0.9754963461024603
Energy: 0.7046718369890398
Energy: 0.8782413908618951
Energy: 0.7188790848112153
Energy: 0.8782413908548693
Energy: 0.7188790848108455
Energy: 0.8782413908530202
Energy: 0.7188790848108455
Energy: 0.6867779516958532
Energy: 0.7250802354647097
Energy: 0.6867779516940042
Energy: 0.725080235405948
Energy: 0.686777951692895
Energy: 0.7250802354244035
Energy: 0.6453418518964165
Energy: 0.7586242494761347
Energy: 0.6453418518978956
Energy: 0.758624249480942
Energy: 0.6453418518975258
Energy: 0.7586242494820513
Energy: 0.7257731234338564
Energy: 0.8904789305582856
Energy: 0.7257731234342262
Energy: 0.8904789305597648
Energy: 0.7257731234353355
Energy: 0.8904789305586555
Energy: 0.6743600008843551
Energy: 0.695138515930734
Energy: 0.6743600008847249
Energy: 0.6951385159377598
Energy: 0.674360000882876
Energy: 0.6951385159433066
Energy: 0.6668562225202819
Energy: 0.6617115317752815
Energy: 0.6668562225384012
Energy: 0.6617115326849115
Energy: 0.666856222535443
Energy: 0.6617115316248476
Energy: 0.6869295880983035
Energy: 0.9308035531002178
Energy: 0.6869295880997826
Energy: 0.9308035530994782
Energy: 0.6869295881031107
Energy: 0.9308035531013271
Energy: 0.7564123044876127
Energy: 0.6828023619716704
Energy: 0.7564123044831752
Energy: 0.6828023619716704
Energy: 0.756412304486873
Energy: 0.6828023619716704
Energy: 0.7389333283277512
Energy: 0.6753614754281255
Energy: 0.7389333283277512
Energy: 0.675361475425907
Energy: 0.7389333283381051
Energy: 0.6753614754347816
Energy: 0.7149574401976697
Energy: 0.6833517221605013
Energy: 0.7149574402050654
Energy: 0.6833517221690063
Energy: 0.714957440203956
Energy: 0.683351722167897
Energy: 0.6699265286526324
Energy: 0.9772747350561872
Energy: 0.6699265286530021
Energy: 0.9772747350602548
Energy: 0.6699265286522625
Energy: 0.977274735058406
Energy: 0.6941946587211809
Energy: 0.6633411542220748
Energy: 0.6941946587222902
Energy: 0.6633411542224447
Energy: 0.6941946587219205
Energy: 0.6633411542224447
Energy: 0.6754605934551936
Energy: 0.6665067301918425
Energy: 0.6754605934592611
Energy: 0.6667407514827741
Energy: 0.6754605934563029
Energy: 0.6665050334582695
Energy: 0.8781065138187295
Energy: 0.6853288909788637
Energy: 0.8781065138172504
Energy: 0.6853288909807127
Energy: 0.8781065138242761
Energy: 0.6853288909807127
Energy: 0.7213832018413541
Energy: 0.7292144162868491
Energy: 0.7213832018428332
Energy: 0.7292144162868491
Energy: 0.7213832018391354
Energy: 0.7292144162875888
Energy: 0.7212846769531889
Energy: 0.7293103842747795
Energy: 0.7212846769472724
Energy: 0.7293103842755191
Energy: 0.7212846769472724
Energy: 0.7293103842744098
Energy: 0.8780040161363408
Energy: 0.6851974338597314
Energy: 0.8780040161463251
Energy: 0.6851974338564035
Energy: 0.8780040161333825
Energy: 0.6851974338612107
Energy: 0.6752893996002789
Energy: 0.666303128909165
Energy: 0.6752893995987997
Energy: 0.6663001949555871
Energy: 0.6752893995954716
Energy: 0.6662996827759305
Energy: 0.6941374626831667
Energy: 0.6634499317790314
Energy: 0.6941374626798387
Energy: 0.663449931777922
Energy: 0.6941374626813179
Energy: 0.6634499317845781
Energy: 0.6699210321573259
Energy: 0.9773498777614035
Energy: 0.6699210321580655
Energy: 0.9773498777617732
Energy: 0.6699210321569561
Energy: 0.9773498777617732
Energy: 0.7149529176580816
Energy: 0.6825557875012155
Energy: 0.7149529176551234
Energy: 0.6825557874949292
Energy: 0.7149529176499463
Energy: 0.6825557874845753
Energy: 0.7389053062020436
Energy: 0.6754509326017212
Energy: 0.7389053062013041
Energy: 0.6754509326061586
Energy: 0.7389053062001948
Energy: 0.6754509326028306
Energy: 0.7564407009089642
Energy: 0.6828788726147997
Energy: 0.7564407009148807
Energy: 0.6828788726147997
Energy: 0.756440700912662
Energy: 0.6828788726147997
Energy: 0.6869210110335444
Energy: 0.9312697354377685
Energy: 0.6869210110298466
Energy: 0.9312697354377685
Energy: 0.6869210110309559
Energy: 0.931269735437029
Energy: 0.6669170266243776
Energy: 0.6616848065746684
Energy: 0.6669170266291846
Energy: 0.6616848055570957
Energy: 0.6669170266228983
Energy: 0.6616848058184308
Energy: 0.6751112411117332
Energy: 0.6949869903315528
Energy: 0.6751112411117332
Energy: 0.6949869903215687
Energy: 0.6751112411117332
Energy: 0.6949869903455709
Energy: 0.7257946737909052
Energy: 0.8904831466892146
Energy: 0.7257946737927541
Energy: 0.8904831466862562
Energy: 0.7257946737938634
Energy: 0.8904831466888447
Energy: 0.645488564634948
Energy: 0.7586456029666356
Energy: 0.645488564634948
Energy: 0.7586456029662657
Energy: 0.6454885646356875
Energy: 0.7586456029721823

minimum gb energy = 0.6453418518964165 eV
minimum distance =  2.35436318446523 Angstroms
sigma value = 67


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

Energy: 0.8028134938638802
Energy: 0.7191305778368822
Energy: 0.8028134938643575
Energy: 0.7191305778368822
Energy: 0.8028134938641049
Energy: 0.7191305778363768
Energy: 0.7622786762685823
Energy: 0.6749598246549967
Energy: 0.762278676268835
Energy: 0.6749598246542665
Energy: 0.762278676268835
Energy: 0.6749598246544913
Energy: 0.6760081942523763
Energy: 0.8619541333858728
Energy: 0.6760081942491748
Energy: 0.8619541333861255
Energy: 0.6760081942531346
Energy: 0.8619541333858728
Energy: 0.7622913484428754
Energy: 0.6749500317370541
Energy: 0.7622913484431282
Energy: 0.674950031738037
Energy: 0.7622913484433809
Energy: 0.6749500317375596
Energy: 0.8028134938633746
Energy: 0.7191305778391007
Energy: 0.8028134938633746
Energy: 0.7191305778391007
Energy: 0.8028134938633746
Energy: 0.7191305778393535
Energy: 0.7622786762675994
Energy: 0.6749598246525254
Energy: 0.7622786762678521
Energy: 0.6749598246532557
Energy: 0.7622786762680767
Energy: 0.6749598246525254
Energy: 0.6760081942602959
Energy: 0.8619541333863785
Energy: 0.6760081942570663
Energy: 0.8619541333861255
Energy: 0.6760081942595377
Energy: 0.8619541333863785

minimum gb energy = 0.6749500317370541 eV
minimum distance =  2.36693788202869 Angstroms
sigma value = 3


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

Energy: 0.9501251290872964
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Energy: 0.9223070456059873
Energy: 0.8013905421901467
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Energy: 0.8013905421904525
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Energy: 0.892587133492633
Energy: 0.8037968132176625
Energy: 0.8925871334922659
Energy: 0.8037968131998685
Energy: 0.8925871334942839
Energy: 0.803796813209958
Energy: 0.8163128227593486
Energy: 0.8849279378173112
Energy: 0.8163128227616722
Energy: 0.8849278902249579
Energy: 0.8163128227596543
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Energy: 0.8503395654070838
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Energy: 0.8629606536542367
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Energy: 0.853769660130759
Energy: 0.849848795793132
Energy: 0.85376966013987
Energy: 0.8498487957904414
Energy: 0.8537696601395031
Energy: 0.8498487957917866

minimum gb energy = 0.7829256019289218 eV
minimum distance =  2.28450416471941 Angstroms
sigma value = 81


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

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Energy: 0.8599447896816489
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Energy: 0.7640585769362934
Energy: 0.7952716861834191
Energy: 0.764058576937678
Energy: 0.7952716860556448
Energy: 0.7640585769372166
Energy: 0.7952716858397083
Energy: 0.9038729205757515
Energy: 0.7524889392385798
Energy: 0.90387292057529
Energy: 0.7524889392390415
Energy: 0.9038729205762132
Energy: 0.7524889392376567
Energy: 0.8067643074634584
Energy: 1.0465131100129814
Energy: 0.806764307460689
Energy: 1.0465131100143663
Energy: 0.8067643074616122
Energy: 1.046513110013443
Energy: 0.9639968023309922
Energy: 0.8612154094806854
Energy: 0.9639968023282227
Energy: 0.861215409487609
Energy: 0.9639968023277611
Energy: 0.8612154094903786
Energy: 0.8021208175625143
Energy: 0.8424490673111256
Energy: 0.8021208175611295
Energy: 0.8424490673106642
Energy: 0.8021208175634374
Energy: 0.8424490673115873
Energy: 0.7892814741091126
Energy: 0.7637157027434234
Energy: 0.7892814741077281
Energy: 0.7637157027434234
Energy: 0.7892814741077281
Energy: 0.7637157027443466

minimum gb energy = 0.7425723589471546 eV
minimum distance =  2.39372396730687 Angstroms
sigma value = 43


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

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Energy: 0.7953197767675277
Energy: 1.0031876791254901
Energy: 0.7953197767658525
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Energy: 0.8594506456755424
Energy: 0.8764834442097694
Energy: 0.8594506456755424
Energy: 0.8764834442109035
Energy: 0.856659701448382
Energy: 0.7946974676333731
Energy: 0.8566597014449803
Energy: 0.7948422074551277
Energy: 0.8566597014472482
Energy: 0.7950159304461882
Energy: 0.8945008864662076
Energy: 0.7868881341429692
Energy: 0.8945008864611047
Energy: 0.7868881341429692
Energy: 0.8945008864605378
Energy: 0.7868881341424023
Energy: 0.92336975805997
Energy: 0.8431682766259722
Energy: 0.92336975805997
Energy: 0.8431682766242712
Energy: 0.9233697580594031
Energy: 0.8431682766254052
Energy: 0.9110089998196222
Energy: 0.8257890814269472
Energy: 0.9110089998190553
Energy: 0.8257890814275142
Energy: 0.9110089998196222
Energy: 0.8257890814269472
Energy: 0.8938692897658018
Energy: 0.7865894841227093
Energy: 0.8938692897680439
Energy: 0.7865894841232762
Energy: 0.8938692897652347
Energy: 0.7865894841227093
Energy: 0.8567199453127617
Energy: 0.8515667810617404
Energy: 0.856719945309927
Energy: 0.8515667810623074
Energy: 0.856719945310494
Energy: 0.8515667810628745
Energy: 0.9017771304486698
Energy: 0.8823793957642175
Energy: 0.9017771304486698
Energy: 0.8823793957636505
Energy: 0.9017771304486698
Energy: 0.8823793957636505
Energy: 0.7605631776259921
Energy: 0.895991141399847
Energy: 0.7605631776248581
Energy: 0.8959911414004139
Energy: 0.7605631776259921
Energy: 0.8959911414004139
Energy: 0.9044364465724676
Energy: 0.8535573298138721
Energy: 0.9044364464353382
Energy: 0.8535573298150061
Energy: 0.9044364461973136
Energy: 0.853557329814439
Energy: 0.846322412846418
Energy: 0.8235370363830041
Energy: 0.8463224128458509
Energy: 0.823537036384138
Energy: 0.8463224128458509
Energy: 0.8235370363830041
Energy: 0.903478926904512
Energy: 0.8551915734697867
Energy: 0.903478926904512
Energy: 0.8551915734697867
Energy: 0.9034789269050789
Energy: 0.8551915734692197
Energy: 0.8248363237878839
Energy: 0.9174748227230165
Energy: 0.824836323787317
Energy: 0.9174748227224494
Energy: 0.824836323787317
Energy: 0.9174748227230165
Energy: 0.8967179322532758
Energy: 0.7933815367938105
Energy: 0.8967179322538429
Energy: 0.7933815367938105
Energy: 0.8967179322561107
Energy: 0.7933815367938105
Energy: 0.8299487290853539
Energy: 0.8719102582085848
Energy: 0.8299487290864879
Energy: 0.8719102582040492
Energy: 0.8299487290864879
Energy: 0.871910258207451
Energy: 0.8759779809803053
Energy: 0.8917412026729794
Energy: 0.8759779809803053
Energy: 0.8917412026729794
Energy: 0.8759779809803053
Energy: 0.8917412026724125
Energy: 0.8306861356493377
Energy: 0.8522366106441085
Energy: 0.8306861356482038
Energy: 0.8522366106435416
Energy: 0.8306861356533066
Energy: 0.8522366106441085

minimum gb energy = 0.7596476724739476 eV
minimum distance =  2.34538632421186 Angstroms
sigma value = 57


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

Energy: 0.9084913955833491
Energy: 0.790206734553743
Energy: 0.908491395581881
Energy: 0.790206734553743
Energy: 0.9084913955833491
Energy: 0.790206734553743
Energy: 0.838236156577757
Energy: 0.7570414566160909
Energy: 0.8382361565762887
Energy: 0.7570414566153568
Energy: 0.8382361565770229
Energy: 0.7570414566153568
Energy: 0.8545988978116964
Energy: 0.9360609896784705
Energy: 0.8545988978080259
Energy: 0.9360609896784705
Energy: 0.8545988977940778
Energy: 0.9360609896784705
Energy: 1.0137824134291524
Energy: 0.8606767440814223
Energy: 1.0137824134291524
Energy: 0.8606767440718789
Energy: 1.0137824134306208
Energy: 0.8606767440285998
Energy: 0.8102448602574384
Energy: 0.8609581185567778
Energy: 0.8102448602581726
Energy: 0.8609581050295452
Energy: 0.8102448602581726
Energy: 0.8609580968200075
Energy: 0.8546723752945422
Energy: 0.8182823100846195
Energy: 0.8546723752263039
Energy: 0.8182823100846195
Energy: 0.8546723750399078
Energy: 0.8182823100846195
Energy: 0.8415500202385212
Energy: 0.8402976656487186
Energy: 0.841550020237787
Energy: 0.840297665637707
Energy: 0.8415500202385212
Energy: 0.8402976656465162
Energy: 0.8494555126739317
Energy: 0.793312736289427
Energy: 0.8494555126731974
Energy: 0.793312736288693
Energy: 0.8494555126746658
Energy: 0.793312736289427
Energy: 0.8081112501167627
Energy: 0.7573762232255499
Energy: 0.8081112501160286
Energy: 0.7573762232255499
Energy: 0.8081112501167627
Energy: 0.7573762232255499
Energy: 0.7466241812052208
Energy: 0.8361702252793318
Energy: 0.7466241812044867
Energy: 0.8361702252785977
Energy: 0.7466241812044867
Energy: 0.8361702252793318
Energy: 0.8415832039287001
Energy: 0.8685986097335748
Energy: 0.8415832039294342
Energy: 0.8685986097328405
Energy: 0.8415832039294342
Energy: 0.8685986097321066
Energy: 0.8011704877296681
Energy: 0.9223840023497315
Energy: 0.8011704877304022
Energy: 0.9223840022315738
Energy: 0.8011704877289674
Energy: 0.9223840021339711
Energy: 0.840242979350656
Energy: 0.7574444601646043
Energy: 0.840242979350656
Energy: 0.7574444601638702
Energy: 0.8402429793484536
Energy: 0.7574444601646043
Energy: 0.8473885729799859
Energy: 0.7618311487768139
Energy: 0.8473885729836566
Energy: 0.761831148777548
Energy: 0.847388572988762
Energy: 0.7618311487768139
Energy: 0.8062008478432582
Energy: 0.7618166846099192
Energy: 0.8062008478425241
Energy: 0.7618166846091852
Energy: 0.8062008478432582
Energy: 0.7618166846099192
Energy: 0.8015683301931931
Energy: 0.8166253979403836
Energy: 0.8015683301924591
Energy: 0.8166253979403836
Energy: 0.8015683301931931
Energy: 0.8166253979403836
Energy: 0.7415200951113275
Energy: 0.8377180231457662
Energy: 0.7415200951113275
Energy: 0.8377180231450321
Energy: 0.7415200951098593
Energy: 0.8377180231457662
Energy: 0.8398661568953122
Energy: 0.7423136090011457
Energy: 0.8398661568931098
Energy: 0.7423136090004117
Energy: 0.8398661568945781
Energy: 0.7423136090004117
Energy: 0.741534510481881
Energy: 0.8377159081113246
Energy: 0.7415345104826151
Energy: 0.8377159081113246
Energy: 0.7415345104811469
Energy: 0.8377159081113246
Energy: 0.8015979216717128
Energy: 0.8166029811802376
Energy: 0.8015979216702447
Energy: 0.8166029811802376
Energy: 0.8015979216717128
Energy: 0.8166029811802376
Energy: 0.8061493704326719
Energy: 0.7618388563396887
Energy: 0.8061493704326719
Energy: 0.7618388563396887
Energy: 0.8061493704312036
Energy: 0.7618388563404229
Energy: 0.8476366283732096
Energy: 0.841887834612664
Energy: 0.8476366283511865
Energy: 0.8418878346133981
Energy: 0.8476366283467818
Energy: 0.841887834612664
Energy: 0.8401706964517961
Energy: 0.7573671632316763
Energy: 0.8401706964532644
Energy: 0.7573671632309422
Energy: 0.8401706964562007
Energy: 0.7573671632316763
Energy: 0.8011902172847277
Energy: 0.9223669519729795
Energy: 0.8011902172847277
Energy: 0.9223669519230603
Energy: 0.8011902172839938
Energy: 0.9223669518298622

minimum gb energy = 0.7415200951098593 eV
minimum distance =  2.31330832190126 Angstroms
sigma value = 17


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

Energy: 0.8417512456351017
Energy: 0.7631442678109385
Energy: 0.8417512456351017
Energy: 0.7631442678119768
Energy: 0.8417512456351017
Energy: 0.7631442678109385
Energy: 0.733068682856828
Energy: 0.7312413855896793
Energy: 0.7330686828557899
Energy: 0.7312413855896793
Energy: 0.7330686828578662
Energy: 0.7312413855896793
Energy: 0.8603690394402568
Energy: 0.8720098808434116
Energy: 0.8603690394392186
Energy: 0.8720098808423733
Energy: 0.8603690394371424
Energy: 0.8720098808434116
Energy: 0.6869499139923194
Energy: 0.8662767843761587
Energy: 0.6869499139923194
Energy: 0.866276784377197
Energy: 0.6869499139912812
Energy: 0.866276784377197
Energy: 0.8367656368806036
Energy: 0.8159115711307772
Energy: 0.8367656368806036
Energy: 0.8159115711307772
Energy: 0.8367656368795653
Energy: 0.8159115711307772
Energy: 0.778310898518082
Energy: 0.8356912701783636
Energy: 0.778310898518082
Energy: 0.8356912701783636
Energy: 0.778310898518082
Energy: 0.8356912701783636
Energy: 0.8289853213123977
Energy: 0.7280720557903853
Energy: 0.8289853213123977
Energy: 0.7280720557903853
Energy: 0.8289853213134359
Energy: 0.7280720557914234
Energy: 0.68698214186494
Energy: 0.8078407550336898
Energy: 0.6869821418659783
Energy: 0.8078407550347281
Energy: 0.6869821418659783
Energy: 0.8078407550336898
Energy: 0.8312663771794027
Energy: 0.7313639689754803
Energy: 0.8312663771794027
Energy: 0.7313639689754803
Energy: 0.8312663771804408
Energy: 0.7313639689754803
Energy: 0.7842660666768917
Energy: 0.7354693906542805
Energy: 0.7842660666758535
Energy: 0.7354693906542805
Energy: 0.7842660666768917
Energy: 0.7354693906542805
Energy: 0.7742114456604833
Energy: 0.7178100385968399
Energy: 0.7742114456604833
Energy: 0.7178100385978781
Energy: 0.7742114456604833
Energy: 0.7178100385978781
Energy: 0.760656322384834
Energy: 0.7314573183604052
Energy: 0.7606563223837958
Energy: 0.731457318359367
Energy: 0.7606563223796431
Energy: 0.7314573183604052
Energy: 0.6868662223644815
Energy: 0.8367969134648015
Energy: 0.6868662223644815
Energy: 0.8367969134648015
Energy: 0.6868662223634434
Energy: 0.8367969134648015
Energy: 0.7843839662939057
Energy: 0.8363913231008542
Energy: 0.7843839662939057
Energy: 0.8363913231008542
Energy: 0.7843839662939057
Energy: 0.8363913231008542
Energy: 0.7768284749953145
Energy: 0.712913941413188
Energy: 0.7768284749963528
Energy: 0.7129139414152643
Energy: 0.7768284749963528
Energy: 0.7129139414152643
Energy: 0.7770732637032383
Energy: 0.8333850455532059
Energy: 0.7770732637053147
Energy: 0.8333850455532059
Energy: 0.7770732637032383
Energy: 0.8333850455532059
Energy: 0.7832075373529489
Energy: 0.7850938302926894
Energy: 0.7832075373519106
Energy: 0.785093830295804
Energy: 0.7832075373529489
Energy: 0.7850938302906131

minimum gb energy = 0.6868662223634434 eV
minimum distance =  2.3051920326719 Angstroms
sigma value = 17


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

Energy: 0.7616923539315423
Energy: 0.6837743362353004
Energy: 0.761692353932745
Energy: 0.6837743362353004
Energy: 0.7616923539335468
Energy: 0.6837743362348995
Energy: 0.6927534529364269
Energy: 0.6803884726602483
Energy: 0.6927534529356252
Energy: 0.680388472662253
Energy: 0.6927534529384316
Energy: 0.680388472661852
Energy: 0.721843965652686
Energy: 0.7288460855936215
Energy: 0.7218439656538888
Energy: 0.7288460855928197
Energy: 0.7218439656498797
Energy: 0.7288460855928197
Energy: 0.6415752680341484
Energy: 0.742741172082873
Energy: 0.6415752680361528
Energy: 0.7379902431210513
Energy: 0.6415752680341484
Energy: 0.7427411720844768
Energy: 0.6901879828846297
Energy: 0.6610531361971627
Energy: 0.690187982883427
Energy: 0.6610531361971627
Energy: 0.6901879828842288
Energy: 0.6610531361971627
Energy: 0.7385644180511618
Energy: 0.696871123998324
Energy: 0.7385644180523646
Energy: 0.696871123998324
Energy: 0.7385644180511618
Energy: 0.696871123998324
Energy: 0.6952386070703376
Energy: 0.6994950193785693
Energy: 0.6952386070679687
Energy: 0.6994950193777675
Energy: 0.6952386070707386
Energy: 0.6994950193785693
Energy: 0.7121140771478286
Energy: 0.7347292897445545
Energy: 0.7121140771482295
Energy: 0.7347292897425499
Energy: 0.7121140771470268
Energy: 0.7347292897477619
Energy: 0.7197443868135489
Energy: 0.7364682826820336
Energy: 0.7197443868123462
Energy: 0.7364682826812319
Energy: 0.7197443868135489
Energy: 0.7364682826816327
Energy: 0.6950284410905447
Energy: 0.6268081866031611
Energy: 0.6950284410925492
Energy: 0.6268081866039629
Energy: 0.6950284410917474
Energy: 0.6268081866031611
Energy: 0.6413407028428035
Energy: 0.724524735155706
Energy: 0.6413407028411999
Energy: 0.7245247351565078
Energy: 0.6413407028420017
Energy: 0.7245247351565078
Energy: 0.7173912577620454
Energy: 0.6813779285485738
Energy: 0.7173912577584373
Energy: 0.6813779285481729
Energy: 0.7173912576962964
Energy: 0.6813779285481729
Energy: 0.7060947474529501
Energy: 0.6806301791202043
Energy: 0.706094747453351
Energy: 0.680630179121006
Energy: 0.7060947474541528
Energy: 0.6806301791202043
Energy: 0.7016595720425651
Energy: 0.6852078472053944
Energy: 0.7016595720429659
Energy: 0.6852078472049934
Energy: 0.7016595720421642
Energy: 0.6852078472057953
Energy: 0.7297971842677213
Energy: 0.68251410038274
Energy: 0.729797184268924
Energy: 0.682514100381938
Energy: 0.7297971842661178
Energy: 0.6825141003831409
Energy: 0.6412295034096412
Energy: 0.7538486351834484
Energy: 0.6412295034124476
Energy: 0.723642119285709
Energy: 0.6412295034108438
Energy: 0.7236421192853081
Energy: 0.7119767146382571
Energy: 0.7310733985363477
Energy: 0.7119767146362527
Energy: 0.7310733985363477
Energy: 0.7119767146382571
Energy: 0.7310733985367486
Energy: 0.7617190344023996
Energy: 0.722180693567153
Energy: 0.7617190344023996
Energy: 0.722180693567554
Energy: 0.7617190343987914
Energy: 0.7221806935679549
Energy: 0.7119736894772719
Energy: 0.7202205209730864
Energy: 0.7119736894780738
Energy: 0.7202205209726855
Energy: 0.7119736894776729
Energy: 0.7202205209730864
Energy: 0.7111468139659793
Energy: 0.6809565778538307
Energy: 0.7111468139667811
Energy: 0.7297396530278234
Energy: 0.7111468139651775
Energy: 0.7297396530278234
Energy: 0.7118979637694992
Energy: 0.7203232673706935
Energy: 0.7118979637682965
Energy: 0.7203232673714953
Energy: 0.7118979637694992
Energy: 0.7203232673706935
Energy: 0.7616576815652509
Energy: 0.721973618533843
Energy: 0.7616576815652509
Energy: 0.721973618533843
Energy: 0.7616576815640481
Energy: 0.7219736185330411
Energy: 0.7119646494023673
Energy: 0.7309782280261493
Energy: 0.7119646494031691
Energy: 0.7309782280257484
Energy: 0.7119646494027682
Energy: 0.7309782280257484
Energy: 0.6410341665109085
Energy: 0.7816834288061308
Energy: 0.6410341665117103
Energy: 0.7816834288061308
Energy: 0.641034166512913
Energy: 0.7816834288065315
Energy: 0.7297056652323101
Energy: 0.6826273295052318
Energy: 0.7297056652323101
Energy: 0.6826273295052318
Energy: 0.729705665233112
Energy: 0.6826273295048308
Energy: 0.7015968268251785
Energy: 0.6850490080848999
Energy: 0.7015968268247776
Energy: 0.6850490080865036
Energy: 0.7015968268251785
Energy: 0.6850490080869045
Energy: 0.7059750433392638
Energy: 0.6809349554213521
Energy: 0.7059750433388629
Energy: 0.6809349554209511
Energy: 0.7059750433388629
Energy: 0.6809349554209511
Energy: 0.7174496279930798
Energy: 0.681419880752664
Energy: 0.7174496279622462
Energy: 0.6814198807522631
Energy: 0.7174496279149389
Energy: 0.681419880752664
Energy: 0.6413289937155489
Energy: 0.7246201384352233
Energy: 0.641328993714346
Energy: 0.7246201384348224
Energy: 0.641328993715148
Energy: 0.7246201384348224
Energy: 0.6950007116060353
Energy: 0.6931791190614921
Energy: 0.6950007116040307
Energy: 0.679238971178456
Energy: 0.6950007116064362
Energy: 0.7326662779012976
Energy: 0.7197743688575382
Energy: 0.736673744554456
Energy: 0.7197743688603446
Energy: 0.736673744554456
Energy: 0.7197743688575382
Energy: 0.7366737445540551
Energy: 0.7121454707875077
Energy: 0.7347420156093105
Energy: 0.7121454707871068
Energy: 0.7347420156101123
Energy: 0.7121454707851023
Energy: 0.7347420156044996
Energy: 0.6952449705637511
Energy: 0.6993551528212546
Energy: 0.6952449705633503
Energy: 0.6993551528208536
Energy: 0.695244970564152
Energy: 0.6993551528208536
Energy: 0.738583614437744
Energy: 0.6750935468109931
Energy: 0.7385836144389467
Energy: 0.6891816177258319
Energy: 0.7385836144369422
Energy: 0.675093546811394
Energy: 0.690270398254651
Energy: 0.6610721790741422
Energy: 0.6902703982538492
Energy: 0.6610721790757459
Energy: 0.6902703982530473
Energy: 0.6610721790717368
Energy: 0.6415628432877659
Energy: 0.758380068466292
Energy: 0.6415628432869641
Energy: 0.7453044428862636
Energy: 0.6415628432885677
Energy: 0.7583800684610803
Energy: 0.7218893670683102
Energy: 0.728714398042025
Energy: 0.7218893670630984
Energy: 0.7287143980428267
Energy: 0.721889367060292
Energy: 0.7287143980424258
Energy: 0.6927516103450623
Energy: 0.6805663918528063
Energy: 0.6927516103442605
Energy: 0.6805663918524054
Energy: 0.6927516103426566
Energy: 0.6805663918524054
Energy: 0.7616923539343488
Energy: 0.6837743362361022
Energy: 0.7616923539331459
Energy: 0.6837743362365031
Energy: 0.7616923539331459
Energy: 0.683774336236904
Energy: 0.6927534529396343
Energy: 0.6689700152597448
Energy: 0.6927534529364269
Energy: 0.6689700152597448
Energy: 0.6927534529396343
Energy: 0.6689700152597448
Energy: 0.7218439656550916
Energy: 0.7288460855900134
Energy: 0.7218439656510826
Energy: 0.7288460855900134
Energy: 0.7218439656494787
Energy: 0.7288460855896125
Energy: 0.6415752680325447
Energy: 0.7517183286217045
Energy: 0.641575268030941
Energy: 0.7517183286188981
Energy: 0.6415752680325447
Energy: 0.7517183286213036
Energy: 0.6901879828870352
Energy: 0.6610531361967618
Energy: 0.6901879828854314
Energy: 0.6610531361971627
Energy: 0.6901879828874361
Energy: 0.66105313619596

minimum gb energy = 0.6268081866031611 eV
minimum distance =  2.36830814259813 Angstroms
sigma value = 57


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

Energy: 0.6989293712675355
Energy: 0.6303881298326456
Energy: 0.6989293712662299
Energy: 0.6303881298319928
Energy: 0.6989293712668827
Energy: 0.6303881298319928
Energy: 0.6311009454779519
Energy: 0.6213191953413207
Energy: 0.6311009454779519
Energy: 0.6213191953406679
Energy: 0.6311009454831741
Energy: 0.6213191953413207
Energy: 0.6780776582584352
Energy: 0.674805338791219
Energy: 0.6780776582584352
Energy: 0.6748053387918717
Energy: 0.6780776582610463
Energy: 0.674805338791219
Energy: 0.6012941136379436
Energy: 0.6803612076016307
Energy: 0.6012941136391899
Energy: 0.6803612075983667
Energy: 0.6012941136391899
Energy: 0.680361207597714
Energy: 0.6329193293407142
Energy: 0.5805721103453628
Energy: 0.6329193293394086
Energy: 0.5805721103453628
Energy: 0.6329193293381624
Energy: 0.5805721103453628
Energy: 0.6919695370410388
Energy: 0.6218574204795236
Energy: 0.691969537040386
Energy: 0.6218574204808291
Energy: 0.6919695370390805
Energy: 0.6218574204801764
Energy: 0.5947796249106138
Energy: 0.6712287468906347
Energy: 0.5947796249119193
Energy: 0.6712287468893292
Energy: 0.5947796249138776
Energy: 0.6712287468893292
Energy: 0.6510434088930148
Energy: 0.6519866368384755
Energy: 0.6510434088193107
Energy: 0.6519866368404337
Energy: 0.6510434087064398
Energy: 0.6519866368417393
Energy: 0.6303615343571031
Energy: 0.623230468671663
Energy: 0.6303615343557974
Energy: 0.623230468671663
Energy: 0.6303615343557974
Energy: 0.6232304686722565
Energy: 0.6366203161217013
Energy: 0.6433329098252868
Energy: 0.6366203161210486
Energy: 0.6433329098239813
Energy: 0.6366203161210486
Energy: 0.6433329098246341
Energy: 0.590429797255586
Energy: 0.7096096706433221
Energy: 0.5904297972562387
Energy: 0.7096096706426693
Energy: 0.5904297972542805
Energy: 0.7096096706439748
Energy: 0.660720027070893
Energy: 0.5945341625266062
Energy: 0.6607200270715458
Energy: 0.5945341625259535
Energy: 0.6607200270695874
Energy: 0.5945341625259535
Energy: 0.6352982902575555
Energy: 0.681689644007457
Energy: 0.6352982902575555
Energy: 0.6816896440048459
Energy: 0.6352982902614721
Energy: 0.6816896440068042
Energy: 0.6018086980266257
Energy: 0.6677490348366601
Energy: 0.6018086980259729
Energy: 0.6677490348392713
Energy: 0.601808698028584
Energy: 0.667749034834049
Energy: 0.7085256626362183
Energy: 0.6350923058624824
Energy: 0.7085256626362183
Energy: 0.6350923058631353
Energy: 0.7085256626349127
Energy: 0.6350923058624824
Energy: 0.6333662100430435
Energy: 0.6294663261970973
Energy: 0.6333662100423907
Energy: 0.6294663261970973
Energy: 0.633366210044349
Energy: 0.62946632619775
Energy: 0.6561049312850135
Energy: 0.7151960597250795
Energy: 0.6561049312850135
Energy: 0.715196059723774
Energy: 0.6561049312856662
Energy: 0.7151960597244268
Energy: 0.664852432164536
Energy: 0.6355167145949173
Energy: 0.6648524321658416
Energy: 0.6355167145949173
Energy: 0.664852432164536
Energy: 0.6355167145949173
Energy: 0.601923996633272
Energy: 0.6760780666663584
Energy: 0.6019239966319664
Energy: 0.6760780666670111
Energy: 0.6019239966313136
Energy: 0.6760780666670111
Energy: 0.6025003747244293
Energy: 0.6936893187114842
Energy: 0.602500374722471
Energy: 0.6936893187101786
Energy: 0.6025003747231238
Energy: 0.6936893187114842
Energy: 0.6867095947518109
Energy: 0.6658417429194164
Energy: 0.6867095947550748
Energy: 0.6658417429187637
Energy: 0.6867095947563804
Energy: 0.6658417429194164
Energy: 0.5903232063104312
Energy: 0.6757623877681866
Energy: 0.5903232063104312
Energy: 0.6757623877681866
Energy: 0.5903232063117367
Energy: 0.6757623877681866
Energy: 0.6550901842079742
Energy: 0.6607045568915902
Energy: 0.6550901842086269
Energy: 0.6607045568915902
Energy: 0.6550901842099325
Energy: 0.660704556892243
Energy: 0.6504117021466888
Energy: 0.8262545516617781
Energy: 0.6504117021453832
Energy: 0.8262545516611253
Energy: 0.6504117021428315
Energy: 0.826254551659879
Energy: 0.6500609812905779
Energy: 0.8014123110497473
Energy: 0.650060981287314
Energy: 0.8014123110504001
Energy: 0.6500609812879667
Energy: 0.8014123110497473
Energy: 0.6333734321786556
Energy: 0.6597996830783791
Energy: 0.6333734321832251
Energy: 0.6597996830783791
Energy: 0.6333734321825722
Energy: 0.6597996830783791
Energy: 0.5983460263403225
Energy: 0.675740281459446
Energy: 0.5983460263422807
Energy: 0.6757402814587932
Energy: 0.5983460263403225
Energy: 0.6757402814587932

minimum gb energy = 0.5805721103453628 eV
minimum distance =  2.34470581323354 Angstroms
sigma value = 43


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

Energy: 0.6130371752878091
Energy: 0.5709575097606027
Energy: 0.6130371752882847
Energy: 0.5709575097610782
Energy: 0.6130371752878091
Energy: 0.5709575097610782
Energy: 0.6257177829590554
Energy: 0.6246163765683361
Energy: 0.6257177829600066
Energy: 0.6246163765688119
Energy: 0.6257177829581042
Energy: 0.6246163765683361
Energy: 0.6357259472154252
Energy: 0.6274954550264132
Energy: 0.6357259472216082
Energy: 0.6274954550259376
Energy: 0.6357259472173278
Energy: 0.6274954550264132
Energy: 0.5819739375682659
Energy: 0.5911060301190167
Energy: 0.5819739375696927
Energy: 0.5911060301199679
Energy: 0.5819739375687415
Energy: 0.5911060301190167
Energy: 0.6180021238560534
Energy: 0.5826336851604592
Energy: 0.6180021238508215
Energy: 0.582633685159508
Energy: 0.6180021238560534
Energy: 0.5826336851599837
Energy: 0.616458860639047
Energy: 0.56194650458886
Energy: 0.6164588606385712
Energy: 0.5619465045879087
Energy: 0.616458860639047
Energy: 0.5619465045883844
Energy: 0.5652888112418062
Energy: 0.5850643921119952
Energy: 0.5652888112422818
Energy: 0.585064392117227
Energy: 0.5652888112427574
Energy: 0.5850643921134221
Energy: 0.7549135062060413
Energy: 0.5380873985682492
Energy: 0.7549135062069924
Energy: 0.5380873985682492
Energy: 0.7549135062079436
Energy: 0.5380873985682492
Energy: 0.5612887871493006
Energy: 0.5527828878658377
Energy: 0.561288787148825
Energy: 0.5527828878653622
Energy: 0.5612887871497763
Energy: 0.5527828878648865
Energy: 0.56531667887591
Energy: 0.5550904673586515
Energy: 0.56531667887591
Energy: 0.5550904673577003
Energy: 0.5653166788763856
Energy: 0.5550904673567489
Energy: 0.6801098429314794
Energy: 0.6071226507385358
Energy: 0.6801098429300524
Energy: 0.6071226507385358
Energy: 0.6801098429305281
Energy: 0.60712265073806
Energy: 0.5329151795249782
Energy: 0.5539394117662736
Energy: 0.5329151795245027
Energy: 0.553939411765798
Energy: 0.5329151795245027
Energy: 0.5539394117662736
Energy: 0.5657733581689436
Energy: 0.526194895175289
Energy: 0.5657733581703704
Energy: 0.526194895175289
Energy: 0.5657733581698948
Energy: 0.5261948951757645
Energy: 0.6238247036239626
Energy: 0.6082473463801193
Energy: 0.6238247036253894
Energy: 0.6082473463801193
Energy: 0.6238247036239626
Energy: 0.6082473463796437
Energy: 0.5536140602934956
Energy: 0.5523270764686917
Energy: 0.5536140602934956
Energy: 0.5523270764691672
Energy: 0.5536140602944468
Energy: 0.5523270764686917
Energy: 0.589489441414523
Energy: 0.5732284808415976
Energy: 0.5894894414126206
Energy: 0.5732284808425487
Energy: 0.5894894414149987
Energy: 0.5732284808487318
Energy: 0.5679775340597838
Energy: 0.598120313017038
Energy: 0.5679775340593082
Energy: 0.5981203130175138
Energy: 0.5679775340588326
Energy: 0.598120313017038
Energy: 0.5703757282517424
Energy: 0.5521546077480222
Energy: 0.5703757282517424
Energy: 0.5521546077470708
Energy: 0.5703757282512668
Energy: 0.5521546077475464
Energy: 0.532308019842558
Energy: 0.6192829288674337
Energy: 0.5323080198420824
Energy: 0.6192829288674337
Energy: 0.5323080198435092
Energy: 0.6192829288679095
Energy: 0.5882268112784972
Energy: 0.6079267461433039
Energy: 0.5882268112789728
Energy: 0.6079267461428283
Energy: 0.5882268112794484
Energy: 0.6079267461428283
Energy: 0.6121733829377652
Energy: 0.5823073788728896
Energy: 0.6121733829387164
Energy: 0.5823073788738409
Energy: 0.6121733829410944
Energy: 0.5823073788747921
Energy: 0.6356787202611742
Energy: 0.570483779383899
Energy: 0.635678720260223
Energy: 0.570483779383899
Energy: 0.6356787202611742
Energy: 0.5704837793834235
Energy: 0.5871296751241973
Energy: 0.6161389852695274
Energy: 0.5871296751280022
Energy: 0.6161389852690518
Energy: 0.5871296751280022
Energy: 0.6161389852695274
Energy: 0.5828257541327548
Energy: 0.5669485025635786
Energy: 0.5828257541322792
Energy: 0.566948502563103
Energy: 0.582825754131328
Energy: 0.5669485025640543
Energy: 0.5880869733530325
Energy: 0.5390629919073106
Energy: 0.5880869733539837
Energy: 0.5390629919077862
Energy: 0.5880869733520814
Energy: 0.5390629919077862
Energy: 0.5482720046768095
Energy: 0.5958821694175587
Energy: 0.5482720046777608
Energy: 0.5958821694180342
Energy: 0.5482720046772852
Energy: 0.5958821694161318
Energy: 0.5915197992417094
Energy: 0.5464610966729576
Energy: 0.5915197992455143
Energy: 0.546461096672482
Energy: 0.59151979924599
Energy: 0.546461096672482
Energy: 0.5535931180352902
Energy: 0.5989200378372331
Energy: 0.5535931180348145
Energy: 0.5989200378377088
Energy: 0.5535931180352902
Energy: 0.5989200378372331
Energy: 0.5468003148043038
Energy: 0.5627453934053596
Energy: 0.5468003148028769
Energy: 0.5627453934048839
Energy: 0.5468003148033526
Energy: 0.5627453934044083
Energy: 0.5502541190300011
Energy: 0.5388372933723968
Energy: 0.5502541190271474
Energy: 0.5388372933738238
Energy: 0.5502541190280985
Energy: 0.5388372933742993
Energy: 0.5063364928826266
Energy: 0.7538967164741402
Energy: 0.5063364928821511
Energy: 0.7538967164741402
Energy: 0.5063364928826266
Energy: 0.7538967164741402
Energy: 0.5471022134565917
Energy: 0.5418781016464181
Energy: 0.5471022134580185
Energy: 0.5418781016464181
Energy: 0.5471022134570671
Energy: 0.5418781016464181
Energy: 0.530588917605799
Energy: 0.6036345506640373
Energy: 0.5305889176038965
Energy: 0.6036345506640373
Energy: 0.5305889176038965
Energy: 0.6036345506640373
Energy: 0.5595376932449942
Energy: 0.607861433002236
Energy: 0.5595376932445186
Energy: 0.6078614330027117
Energy: 0.5595376932454699
Energy: 0.6078614330041385
Energy: 0.5706259243829623
Energy: 0.5236916907797652
Energy: 0.5706259243829623
Energy: 0.523691690778814
Energy: 0.5706259243839136
Energy: 0.5236916907797652
Energy: 0.48789266979094786
Energy: 0.6027230570116752
Energy: 0.48789266979047224
Energy: 0.6027230570116752
Energy: 0.48789266979142354
Energy: 0.6027230570121508

minimum gb energy = 0.48789266979047224 eV
minimum distance =  2.30101962902206 Angstroms
sigma value = 81


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

Energy: 0.03580776549298161
Energy: 0.06582328844022922
Energy: 0.03580776549280289
Energy: 0.06582328843760794
Energy: 0.0358077654933192
Energy: 0.0658232884374292
Energy: 0.5632859734067962
Energy: 0.036723568284937204
Energy: 0.5632859734064387
Energy: 0.03672357215188381
Energy: 0.563285973406975
Energy: 0.0367235976788191
Energy: 0.5632860909033676
Energy: 0.036591293049204825
Energy: 0.5632860909024939
Energy: 0.03659128087227877
Energy: 0.5632860909026726
Energy: 0.03659127989759883
Energy: 0.03580776549298161
Energy: 0.06582328843778665
Energy: 0.03580776549314047
Energy: 0.06582328843812425
Energy: 0.0358077654933192
Energy: 0.06582328843812425
Energy: 0.5632859734059225
Energy: 0.03672359539355787
Energy: 0.563285973406975
Energy: 0.03672361189087257
Energy: 0.5632859734055651
Energy: 0.036723589085542636
Energy: 0.5632860909035463
Energy: 0.036591301615235855
Energy: 0.5632860909038839
Energy: 0.03659127106640133
Energy: 0.5632860909040627
Energy: 0.03659130469615538
Energy: 0.03580776549280289
Energy: 0.06582328843794552
Energy: 0.03580776549280289
Energy: 0.06582328843778665
Energy: 0.03580776549314047
Energy: 0.06582328843760794
Energy: 0.5632859734074913
Energy: 0.036723660778432504
Energy: 0.5632859734059225
Energy: 0.03672366554197662
Energy: 0.5632859734073125
Energy: 0.03672368018965931
Energy: 0.5632860909044201
Energy: 0.036591268600172366
Energy: 0.5632860909033676
Energy: 0.03659128461644215
Energy: 0.5632860909042413
Energy: 0.036591279835601544
Energy: 0.03580776549244544
Energy: 0.06582328843794552
Energy: 0.03580776549262416
Energy: 0.06582328843848169
Energy: 0.03580776549298161
Energy: 0.06582328843760794

minimum gb energy = 0.03580776549244544 eV
minimum distance =  2.54863129740145 Angstroms
sigma value = 3


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

Energy: 0.5642448806354197
Energy: 0.4722026118523317
Energy: 0.5642448806380345
Energy: 0.4722026118539005
Energy: 0.5642448806375114
Energy: 0.4722026118533776
Energy: 0.46368179391597075
Energy: 0.5183489986796274
Energy: 0.46368179391492487
Energy: 0.5183489986796274
Energy: 0.46368179391544784
Energy: 0.5183489986796274
Energy: 0.5240748905226982
Energy: 0.5169653220548966
Energy: 0.5240748905221754
Energy: 0.5169653220554195
Energy: 0.5240748905221754
Energy: 0.5169653220548966
Energy: 0.5138942621542165
Energy: 0.508367890094723
Energy: 0.5138942621563084
Energy: 0.5083678900952462
Energy: 0.5138942621542165
Energy: 0.5083678900952462
Energy: 0.4505713655429105
Energy: 0.5203948666699708
Energy: 0.4505713655434335
Energy: 0.5203948666689249
Energy: 0.45057136554395644
Energy: 0.5203948666694478
Energy: 0.5274920651115462
Energy: 0.5223242204054384
Energy: 0.5274920651120691
Energy: 0.5223242204054384
Energy: 0.5274920651115462
Energy: 0.5223242204054384
Energy: 0.5201218893104385
Energy: 0.5141660119517681
Energy: 0.5201218893088696
Energy: 0.5141660119528141
Energy: 0.5201218893114844
Energy: 0.5141660119522911
Energy: 0.44419080731417787
Energy: 0.522270078471
Energy: 0.4441908073147008
Energy: 0.522270078471
Energy: 0.4441908073152237
Energy: 0.522270078471
Energy: 0.5356972286137109
Energy: 0.5262757600697896
Energy: 0.5356972286137109
Energy: 0.5262757600697896
Energy: 0.5356972286137109
Energy: 0.5262757600692667
Energy: 0.5035577936604608
Energy: 0.48655713814401214
Energy: 0.503557793659415
Energy: 0.48655713814348917
Energy: 0.503557793659938
Energy: 0.48655713814348917
Energy: 0.4781885726202559
Energy: 0.5218184148966913
Energy: 0.4781885726197329
Energy: 0.5218184148972145
Energy: 0.4781885726218248
Energy: 0.5218184148972145
Energy: 0.5504017823912452
Energy: 0.555167661823455
Energy: 0.5504017823907221
Energy: 0.555167661822932
Energy: 0.550401782391768
Energy: 0.5551676618224091
Energy: 0.5233247613792634
Energy: 0.4562946169070514
Energy: 0.5233247613797863
Energy: 0.4562946169070514
Energy: 0.5233247613782176
Energy: 0.4562946169070514
Energy: 0.5007171572696869
Energy: 0.5237688140770593
Energy: 0.5007171572691641
Energy: 0.5237688140775822
Energy: 0.500717157268641
Energy: 0.5237688140770593
Energy: 0.40377972013186675
Energy: 0.5398446927589602
Energy: 0.4037797201302979
Energy: 0.5398446927594832
Energy: 0.40377972013291263
Energy: 0.5398446927579144
Energy: 0.5208712847546284
Energy: 0.44817714918299106
Energy: 0.5208712847556743
Energy: 0.44817714918246804
Energy: 0.5208712847541054
Energy: 0.44817714918246804
Energy: 0.4205315245443192
Energy: 0.5597005724122714
Energy: 0.420531524545365
Energy: 0.5597005724122714
Energy: 0.420531524545365
Energy: 0.5597005724127944
Energy: 0.5201148526945645
Energy: 0.5101859782818605
Energy: 0.5201148526956103
Energy: 0.5101859782829063
Energy: 0.5201148526945645
Energy: 0.5101859782818605
Energy: 0.5176623203707003
Energy: 0.618897240520981
Energy: 0.517662320372792
Energy: 0.618897240521504
Energy: 0.5176623203712232
Energy: 0.6188972405204581
Energy: 0.4105340639628061
Energy: 0.5004657910058586
Energy: 0.4105340639628061
Energy: 0.5004657910053357
Energy: 0.4105340639612373
Energy: 0.5004657910063817
Energy: 0.544803195059969
Energy: 0.5107553353096744
Energy: 0.5448031950604918
Energy: 0.5107553353107204
Energy: 0.544803195059969
Energy: 0.5107553353101972
Energy: 0.5382230400215752
Energy: 0.5012132803184896
Energy: 0.5382230400210521
Energy: 0.5012132803190124
Energy: 0.5382230400200063
Energy: 0.5012132803184896
Energy: 0.4121272665466101
Energy: 0.5018864901976209
Energy: 0.41212726642899383
Energy: 0.5018864901981439
Energy: 0.4121272661770505
Energy: 0.5018864901981439
Energy: 0.5282457128405692
Energy: 0.44530200820151067
Energy: 0.5282457128416149
Energy: 0.44530200820203364
Energy: 0.5282457128416149
Energy: 0.44530200820203364
Energy: 0.5183553702492593
Energy: 0.5225449666009963
Energy: 0.5183553702492593
Energy: 0.5225449665999502
Energy: 0.5183553702492593
Energy: 0.5225449666004732
Energy: 0.5144726881526959
Energy: 0.5154349154615063
Energy: 0.5144726881537417
Energy: 0.5154349154620294
Energy: 0.5144726881526959
Energy: 0.5154349154620294
Energy: 0.59942233139989
Energy: 0.4441110390438208
Energy: 0.59942233139989
Energy: 0.4441110390432978
Energy: 0.5994223314004129
Energy: 0.4441110390432978
Energy: 0.521002163856693
Energy: 0.5387256353250917
Energy: 0.5210021638572159
Energy: 0.5387256353250917
Energy: 0.521002163856693
Energy: 0.5387256353256147
Energy: 0.5051992339791297
Energy: 0.5208719508907946
Energy: 0.5051992339780838
Energy: 0.5208719508907946
Energy: 0.5051992339796526
Energy: 0.5208719508907946
Energy: 0.5886764664995984
Energy: 0.47824702812104203
Energy: 0.5886764664995984
Energy: 0.47824702812104203
Energy: 0.5886764665001213
Energy: 0.47824702812051906
Energy: 0.5572769759611236
Energy: 0.537699214995896
Energy: 0.5572769759611236
Energy: 0.5376992149964189
Energy: 0.5572769759616465
Energy: 0.537699214995896
Energy: 0.5592477730464679
Energy: 0.5097403953247492
Energy: 0.5592477730469908
Energy: 0.5097403953242262
Energy: 0.5592477730459449
Energy: 0.5097403953247492
Energy: 0.5352270440685594
Energy: 0.5213376762922257
Energy: 0.5352270440701283
Energy: 0.5213376762922257
Energy: 0.5352270440701283
Energy: 0.5213376762922257

minimum gb energy = 0.4037797201302979 eV
minimum distance =  2.37304184595564 Angstroms
sigma value = 67


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

Energy: 0.712670815449787
Energy: 0.6499132894939285
Energy: 0.7126708154490419
Energy: 0.6499132894939285
Energy: 0.7126708154482968
Energy: 0.6499132894931834
Energy: 0.6482672066665398
Energy: 0.6525302868486336
Energy: 0.6482672066657947
Energy: 0.6525302868486336
Energy: 0.648267206667285
Energy: 0.6525302868486336
Energy: 0.6768474522796146
Energy: 0.6494107948964077
Energy: 0.6768474522781243
Energy: 0.6494107948956966
Energy: 0.6768474522788694
Energy: 0.6494107948964077
Energy: 0.6811833964752414
Energy: 0.6530587979055884
Energy: 0.6811833964744962
Energy: 0.6530587978959015
Energy: 0.6811833964752414
Energy: 0.6530587979055884
Energy: 0.5751705174687282
Energy: 0.6266962102801732
Energy: 0.575170517467983
Energy: 0.6266962102809184
Energy: 0.5751705174687282
Energy: 0.6266962102801732
Energy: 0.6783461800314063
Energy: 0.6649274618223765
Energy: 0.6783461800321514
Energy: 0.6649274618223765
Energy: 0.6783461800306612
Energy: 0.6649274618216313
Energy: 0.6771569898011721
Energy: 0.6290728256802185
Energy: 0.6771569897989368
Energy: 0.6290728256794733
Energy: 0.6771569898011721
Energy: 0.6290728256794733
Energy: 0.6354429310781543
Energy: 0.6251305072999098
Energy: 0.6354429310796446
Energy: 0.6251305072999098
Energy: 0.6354429310796446
Energy: 0.6251305072999098
Energy: 0.6992815505842628
Energy: 0.7055187092047829
Energy: 0.6992815505850078
Energy: 0.7055187092047829
Energy: 0.6992815505850078
Energy: 0.7055187092047829
Energy: 0.6580158048633145
Energy: 0.5879770257742374
Energy: 0.6580158048618581
Energy: 0.5879770257742374
Energy: 0.6580158048618581
Energy: 0.5879770257749825
Energy: 0.6533080721708958
Energy: 0.6667072583770224
Energy: 0.6533080721701506
Energy: 0.6667072583762772
Energy: 0.653308072171641
Energy: 0.6667072583770224
Energy: 0.6332167834013502
Energy: 0.6682168744323724
Energy: 0.6332167833983695
Energy: 0.6682168744316274
Energy: 0.6332167833998599
Energy: 0.6682168744323724
Energy: 0.6577452175033828
Energy: 0.6235446258008104
Energy: 0.6577452175033828
Energy: 0.6235446258000652
Energy: 0.6577452175026376
Energy: 0.6235446258008104
Energy: 0.6387845726643245
Energy: 0.6815668300792609
Energy: 0.6387845726643245
Energy: 0.6815668300792609
Energy: 0.6387845726650696
Energy: 0.6815668300792609
Energy: 0.6458821836469674
Energy: 0.638243932664449
Energy: 0.6458821836454769
Energy: 0.6382439326651942
Energy: 0.6458821836447318
Energy: 0.6382439326651942
Energy: 0.6410061544453386
Energy: 0.6514676798478848
Energy: 0.6410061544445933
Energy: 0.6514676798471396
Energy: 0.6410061544453386
Energy: 0.6514676798478848
Energy: 0.6819412183622148
Energy: 0.6782906262050441
Energy: 0.6819412183629598
Energy: 0.6782906262050441
Energy: 0.6819412183622148
Energy: 0.6782906262050441
Energy: 0.6617361668858648
Energy: 0.6244840644792294
Energy: 0.6617361668866101
Energy: 0.6244840644792294
Energy: 0.6617361668866101
Energy: 0.6244840644792294
Energy: 0.6604150939900616
Energy: 0.681467601337467
Energy: 0.6604150939893164
Energy: 0.6814676013382123
Energy: 0.6604150939893164
Energy: 0.6814676013389575
Energy: 0.7711296787715977
Energy: 0.6532264064750063
Energy: 0.7711296787723428
Energy: 0.6532264064750063
Energy: 0.7711296787715977
Energy: 0.6532264064750063
Energy: 0.6906469103872759
Energy: 0.6280233876998728
Energy: 0.6906469103850406
Energy: 0.6280233876998728
Energy: 0.6906469103865307
Energy: 0.6280233876998728
Energy: 0.6800187260715518
Energy: 0.7310911106968739
Energy: 0.6800187260693162
Energy: 0.7310911106983641
Energy: 0.6800187260715518
Energy: 0.731091110697619
Energy: 0.6946119211975409
Energy: 0.6414286889279122
Energy: 0.6946119211975409
Energy: 0.6414286889286573
Energy: 0.6946119211975409
Energy: 0.6414286889279122

minimum gb energy = 0.575170517467983 eV
minimum distance =  2.38723521369586 Angstroms
sigma value = 33


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

Energy: 0.7978981111749553
Energy: 0.7164757226317154
Energy: 0.7978981111735373
Energy: 0.7164757226317154
Energy: 0.7978981111735373
Energy: 0.7164757226312427
Energy: 0.7186204688830096
Energy: 0.7355467169278461
Energy: 0.7186204688858459
Energy: 0.7355467169283189
Energy: 0.7186204688844278
Energy: 0.7355467169283189
Energy: 0.7680898771350996
Energy: 0.7461313679416981
Energy: 0.7680898771336816
Energy: 0.7461313679426435
Energy: 0.7680898771341542
Energy: 0.7461313679416981
Energy: 0.7679942218595978
Energy: 0.7478765686125465
Energy: 0.7679942218600705
Energy: 0.7478765686120736
Energy: 0.7679942218600705
Energy: 0.7478765686120736
Energy: 0.7210456474666447
Energy: 0.7352153519799149
Energy: 0.7210456474642812
Energy: 0.7352153519799149
Energy: 0.7210456474671174
Energy: 0.7352153519803877
Energy: 0.815759291800491
Energy: 0.804809517498503
Energy: 0.8157592918033273
Energy: 0.8048095174989758
Energy: 0.8157592917976548
Energy: 0.8048095174980304
Energy: 0.7206898838668236
Energy: 0.706597136744908
Energy: 0.7206898838644602
Energy: 0.7065971367434899
Energy: 0.7206898838649328
Energy: 0.706597136744908
Energy: 0.7635529623986392
Energy: 0.7575497868118327
Energy: 0.7635529623953303
Energy: 0.75754978681136
Energy: 0.7635529623967483
Energy: 0.7575497868108871
Energy: 0.7226144483766406
Energy: 0.773675797588419
Energy: 0.722614448376168
Energy: 0.773675797588419
Energy: 0.7226144483766406
Energy: 0.7736757975888917
Energy: 0.783139636317881
Energy: 0.7243004405673676
Energy: 0.7831396363169356
Energy: 0.7243004405673676
Energy: 0.7831396363174083
Energy: 0.7243004405668949
Energy: 0.7528309789375669
Energy: 0.7440601199822336
Energy: 0.7528309789380396
Energy: 0.7440601199817609
Energy: 0.7528309789380396
Energy: 0.7440601199817609
Energy: 0.7213933774897745
Energy: 0.7283141895294101
Energy: 0.7213933774916653
Energy: 0.7283141895289372
Energy: 0.721393377488829
Energy: 0.7283141895289372
Energy: 0.7916043570645444
Energy: 0.7244844140574724
Energy: 0.7916043570654897
Energy: 0.7244844140574724
Energy: 0.7916043570654897
Energy: 0.7244844140574724
Energy: 0.7232879447959342
Energy: 0.751313291471267
Energy: 0.7232879447940435
Energy: 0.7513132914707943
Energy: 0.7232879447959342
Energy: 0.751313291471267
Energy: 0.7443959322545226
Energy: 0.7347833431651538
Energy: 0.7443959322535771
Energy: 0.7347833431660993
Energy: 0.7443959322535771
Energy: 0.7347833431651538
Energy: 0.7631944078055822
Energy: 0.7662649160191252
Energy: 0.7631944078051095
Energy: 0.7662649160205433
Energy: 0.7631944078060549
Energy: 0.766264916021016
Energy: 0.672204920916027
Energy: 0.7490352139968653
Energy: 0.6722049209198087
Energy: 0.7490352139963926
Energy: 0.6722049209174451
Energy: 0.7490352139968653
Energy: 0.7907132461086489
Energy: 0.8152765349904652
Energy: 0.7907132461091215
Energy: 0.8152765349909379
Energy: 0.7907132461081762
Energy: 0.8152765349904652
Energy: 0.7135789313694632
Energy: 0.7818280053560607
Energy: 0.7135789313685178
Energy: 0.7818280053560607
Energy: 0.7135789313689905
Energy: 0.7818280053574785
Energy: 0.8458423762900822
Energy: 0.7489977430431293
Energy: 0.8458423762886641
Energy: 0.7489977430426565
Energy: 0.8458423762900822
Energy: 0.7489977430426565
Energy: 0.7605944517519676
Energy: 0.7704904432080184
Energy: 0.7605944517533858
Energy: 0.7704904432080184
Energy: 0.7605944517538585
Energy: 0.7704904432080184
Energy: 0.7508253475370323
Energy: 0.7097112746138545
Energy: 0.7508253475370323
Energy: 0.7097112746133818
Energy: 0.7508253475370323
Energy: 0.7097112746138545
Energy: 0.7565056683173729
Energy: 0.7437606981665874
Energy: 0.7565056683173729
Energy: 0.7437606981665874
Energy: 0.7565056683159548
Energy: 0.7437606981675328
Energy: 0.7717117600590021
Energy: 0.7217984169280871
Energy: 0.7717117600604203
Energy: 0.7217984169280871
Energy: 0.7717117600594748
Energy: 0.7217984169280871
Energy: 0.7197573285040431
Energy: 0.724727325102511
Energy: 0.7197573285045158
Energy: 0.724727325102511
Energy: 0.7197573285059338
Energy: 0.724727325102511
Energy: 0.7521194260558061
Energy: 0.7623306971685888
Energy: 0.7521194260572243
Energy: 0.7623306971685888
Energy: 0.7521194260548607
Energy: 0.7623306971685888
Energy: 0.7208390266169129
Energy: 0.7087905668759319
Energy: 0.720839026613604
Energy: 0.7087905668754592
Energy: 0.7208390266154948
Energy: 0.7087905668759319
Energy: 0.7618079507772859
Energy: 0.8118269552876746
Energy: 0.761807950778704
Energy: 0.8118269552881473
Energy: 0.7618079507768132
Energy: 0.8118269552881473
Energy: 0.7289019696531319
Energy: 0.7353994191675749
Energy: 0.7289019696536047
Energy: 0.7353994191666294
Energy: 0.7289019696588044
Energy: 0.7353994191671022
Energy: 0.7138236809310834
Energy: 0.706619948346976
Energy: 0.7138236809320287
Energy: 0.7066199483493395
Energy: 0.7138236809325015
Energy: 0.7066199483479215
Energy: 0.8146936102363619
Energy: 0.8029261455102521
Energy: 0.8146936102377801
Energy: 0.8029261455102521
Energy: 0.8146936102354165
Energy: 0.8029261455102521
Energy: 0.7228976007456044
Energy: 0.7356765149493866
Energy: 0.7228976007456044
Energy: 0.73567651495175
Energy: 0.7228976007456044
Energy: 0.7356765149498593
Energy: 0.7684342157928806
Energy: 0.76723728463945
Energy: 0.7684342157928806
Energy: 0.7672372846366137
Energy: 0.7684342157928806
Energy: 0.7672372846333048
Energy: 0.7454534556177421
Energy: 0.7353015602432145
Energy: 0.745453455616324
Energy: 0.7353015602427418
Energy: 0.7454534556172694
Energy: 0.7353015602432145
Energy: 0.7218541044554001
Energy: 0.7482818831962802
Energy: 0.7218541044558728
Energy: 0.7482818831962802
Energy: 0.7218541044558728
Energy: 0.7482818831962802
Energy: 0.7794946943169384
Energy: 0.7180502173462792
Energy: 0.7794946943150476
Energy: 0.7180502173458064
Energy: 0.7794946943155203
Energy: 0.7180502173462792
Energy: 0.7232261942565347
Energy: 0.7391657048630569
Energy: 0.7232261942570074
Energy: 0.7391657048630569
Energy: 0.7232261942579529
Energy: 0.7391657048630569

minimum gb energy = 0.672204920916027 eV
minimum distance =  2.36582559946953 Angstroms
sigma value = 41


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

Energy: 0.9140699873618846
Energy: 0.8928139287470851
Energy: 0.914069987360594
Energy: 0.8928139287470851
Energy: 0.9140699873618846
Energy: 0.8928139287470851
Energy: 0.8506171398464502
Energy: 0.8713626171632023
Energy: 0.8506171398464502
Energy: 0.8713626171632023
Energy: 0.8506171398464502
Energy: 0.8713626171632023
Energy: 0.9988582101332727
Energy: 0.8672856637199168
Energy: 0.9559167690722287
Energy: 0.8672856637199168
Energy: 0.9559167690722287
Energy: 0.8672856637199168
Energy: 0.8958772803046878
Energy: 0.9157022128901933
Energy: 0.8958772803046878
Energy: 0.9157022128901933
Energy: 0.8958772803059784
Energy: 0.9157022128914839
Energy: 0.8503978326928979
Energy: 0.8893948191468823
Energy: 0.8503978326928979
Energy: 0.8893948191468823
Energy: 0.8503978326967697
Energy: 0.8893948191468823
Energy: 0.9508389619004404
Energy: 0.9232777921047245
Energy: 0.9508389619030216
Energy: 0.9232777921060151
Energy: 0.950838961901731
Energy: 0.9232777921073058
Energy: 0.8944666582917433
Energy: 0.8250232840062998
Energy: 0.894466658293034
Energy: 0.8250232840062998
Energy: 0.8944666582917433
Energy: 0.8250232840062998
Energy: 0.9006134184839958
Energy: 0.8711003869046738
Energy: 0.9006134184814145
Energy: 0.8711003869046738
Energy: 0.9006134184827052
Energy: 0.8711003869046738
Energy: 0.8545714312861041
Energy: 0.8510718214414914
Energy: 0.8545714312861041
Energy: 0.8510718214414914
Energy: 0.8545714312861041
Energy: 0.8510718214414914
Energy: 0.8941638137856652
Energy: 0.8676728990763363
Energy: 0.8941638137856652
Energy: 0.8676728990763363
Energy: 0.8941638137856652
Energy: 0.8676728990763363
Energy: 0.8427150658176635
Energy: 0.8673571610500176
Energy: 0.842715065816373
Energy: 0.8673571610513082
Energy: 0.8427150658176635
Energy: 0.8673571610513082
Energy: 0.8900823450650869
Energy: 0.8696527084572866
Energy: 0.8900823450663774
Energy: 0.8696527084572866
Energy: 0.8900823450650869
Energy: 0.8696527084572866
Energy: 0.9105206114671731
Energy: 0.9149695505235328
Energy: 0.9105206114684636
Energy: 0.914969550526114
Energy: 0.9105206114671731
Energy: 0.9149695505248234
Energy: 0.8515531463921286
Energy: 0.8708274744111819
Energy: 0.8515531463947099
Energy: 0.8708274744111819
Energy: 0.8515531463934193
Energy: 0.8708274744111819

minimum gb energy = 0.8250232840062998 eV
minimum distance =  2.32702465554463 Angstroms
sigma value = 11


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

Energy: 1.0608310995742174
Energy: 1.0547527387514408
Energy: 1.0608310995736505
Energy: 1.0547527387514408
Energy: 1.0608310995747845
Energy: 1.0547527387514408
Energy: 0.9614880163872322
Energy: 0.9916411765066828
Energy: 0.9614880163877992
Energy: 0.9916411765061159
Energy: 0.9614880163872322
Energy: 0.9916411765061159
Energy: 1.021301270852212
Energy: 0.9897463876340653
Energy: 1.0213012708527531
Energy: 0.9897463876334983
Energy: 1.0213012708493772
Energy: 0.9897463876340653
Energy: 1.0121940039236565
Energy: 0.9620567745933877
Energy: 1.0121940039236565
Energy: 0.9620567745928209
Energy: 1.0121940039242237
Energy: 0.9620567745933877
Energy: 1.0223772027769162
Energy: 0.9761838535985785
Energy: 1.0223772027774833
Energy: 0.9761838535980115
Energy: 1.0223772027769162
Energy: 0.9761838535985785
Energy: 0.992855944954556
Energy: 1.0089197535121925
Energy: 0.9928559449534222
Energy: 1.0089197535116254
Energy: 0.9928559449534222
Energy: 1.0089197535110583
Energy: 1.0093183274221376
Energy: 0.9932816273986023
Energy: 1.0093183274221376
Energy: 0.9932816273997361
Energy: 1.0093183274221376
Energy: 0.9932816273986023
Energy: 0.9899900580388854
Energy: 1.0125207718976363
Energy: 0.9899900580383185
Energy: 1.0125207718976363
Energy: 0.9899900580377514
Energy: 1.0125207718976363
Energy: 1.009467218203376
Energy: 1.006569554903215
Energy: 1.009467218202809
Energy: 1.006569554903215
Energy: 1.009467218202809
Energy: 1.006569554903215
Energy: 0.9888669747627299
Energy: 1.0100097681552698
Energy: 0.9888669747621628
Energy: 1.0100097681552698
Energy: 0.9888669747627299
Energy: 1.0100097681558367
Energy: 0.9709819829202713
Energy: 0.9938356422439936
Energy: 0.9709819829214053
Energy: 0.9938356422439936
Energy: 0.9709819829202713
Energy: 0.9938356422445604
Energy: 1.0057720149852563
Energy: 1.0097305661398834
Energy: 1.0057720149863902
Energy: 1.0097305661393166
Energy: 1.0057720149858231
Energy: 1.0097305661393166
Energy: 1.0116421025287847
Energy: 0.986643789527219
Energy: 1.0116421025293518
Energy: 0.986643789527219
Energy: 1.0116421025287847
Energy: 0.986643789527786
Energy: 1.0073911050622104
Energy: 1.0172284375936023
Energy: 1.0073911050627775
Energy: 1.0172284375941691
Energy: 1.0073911050627775
Energy: 1.0172284375941691
Energy: 0.9804725700349199
Energy: 1.0080643770681328
Energy: 0.980472570036028
Energy: 1.0080643770681328
Energy: 0.9804725700354611
Energy: 1.0080643770687
Energy: 1.009686862493319
Energy: 0.9929655540868059
Energy: 1.0096868624938862
Energy: 0.9929655540913418
Energy: 1.009686862493319
Energy: 0.9929655540924757
Energy: 0.9645507717914945
Energy: 0.9912098650976596
Energy: 0.9645507717920614
Energy: 0.9912098650965258
Energy: 0.9645507717920614
Energy: 0.9912098650976596
Energy: 1.0219383795991837
Energy: 1.0284318130971501
Energy: 1.0219383795997508
Energy: 1.0284318130965833
Energy: 1.0219383796003176
Energy: 1.0284318130971501
Energy: 0.9878600321297456
Energy: 0.952344565440454
Energy: 0.9878600321303127
Energy: 0.9523445654398869
Energy: 0.9878600321303127
Energy: 0.952344565440454
Energy: 0.9990331002100565
Energy: 0.9934890783102013
Energy: 0.9990331002100565
Energy: 0.9934890783102013
Energy: 0.9990331002111904
Energy: 0.9934890783102013
Energy: 0.9898233162809118
Energy: 0.9805134769676781
Energy: 0.9898233162809118
Energy: 0.9805134769676781
Energy: 0.9898233162814787
Energy: 0.980513476967111
Energy: 1.0529373849357444
Energy: 1.030752407088138
Energy: 1.0529373849357444
Energy: 1.030752407088138
Energy: 1.0529373849357444
Energy: 1.030752407088138
Energy: 0.9956874695573718
Energy: 0.9908837901099734
Energy: 0.9956874695573718
Energy: 0.9908837901099734
Energy: 0.9956874695573718
Energy: 0.9908837901099734
Energy: 1.035264024313274
Energy: 0.9959528120790616
Energy: 1.0352640243127071
Energy: 0.9959528120790616
Energy: 1.0352640243127071
Energy: 0.9959528120790616
Energy: 0.9916303803213283
Energy: 0.9945325437121447
Energy: 0.9916303803201942
Energy: 0.9945325437121447
Energy: 0.9916303803207613
Energy: 0.9945325437121447
Energy: 0.9819697559229651
Energy: 0.9914933948347794
Energy: 0.981969755923532
Energy: 0.9914933948347794
Energy: 0.9819697559229651
Energy: 0.9914933948347794
Energy: 0.988968628781469
Energy: 1.0289922700707843
Energy: 0.988968628781469
Energy: 1.0289922700685166
Energy: 0.9889686287820358
Energy: 1.0289922700662486
Energy: 1.011506526526249
Energy: 0.9815301276158386
Energy: 1.0115065265268162
Energy: 0.9815301276158386
Energy: 1.011506526526249
Energy: 0.9815301276164057
Energy: 1.0112308722474528
Energy: 1.0132512362078743
Energy: 1.0112308722468855
Energy: 1.0132512362078743
Energy: 1.0112308722474528
Energy: 1.0132512362078743
Energy: 0.9883850891506855
Energy: 0.9560117368566754
Energy: 0.9883850891495516
Energy: 0.9560117368561085
Energy: 0.9883850891501186
Energy: 0.9560117368561085
Energy: 0.9835228811575781
Energy: 1.0344911084670365
Energy: 0.9835228811575781
Energy: 1.0344911084664952
Energy: 0.983522881158145
Energy: 1.0344911084670365

minimum gb energy = 0.9523445654398869 eV
minimum distance =  2.23781886037318 Angstroms
sigma value = 57


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

Energy: 0.9704779025888043
Energy: 0.9854614048745783
Energy: 0.9704779025877952
Energy: 0.9854614048745783
Energy: 0.9704779025888043
Energy: 0.9854614048745783
Energy: 1.029702931256352
Energy: 1.0887655021565827
Energy: 1.0297029312553432
Energy: 1.0887655021575915
Energy: 1.029702931256352
Energy: 1.0887655021565827
Energy: 1.0393928209166214
Energy: 0.9662630337431424
Energy: 1.0393928209176304
Energy: 0.9662630337431424
Energy: 1.0393928209176304
Energy: 0.9662630337431424
Energy: 0.9718708702748685
Energy: 0.9758432992643604
Energy: 0.9718708702758776
Energy: 0.9758432992653695
Energy: 0.9718708702758776
Energy: 0.9758432992653695
Energy: 1.0394078120021886
Energy: 0.9662739596816605
Energy: 1.0394078120031975
Energy: 0.9662739596816605
Energy: 1.0394078120031975
Energy: 0.9662739596806517
Energy: 1.0296199385972356
Energy: 0.9561180748600634
Energy: 1.0296199385972356
Energy: 0.9561180748600634
Energy: 1.0296199385982445
Energy: 0.9561180748610724
Energy: 0.9704779025877952
Energy: 0.9854614048725604
Energy: 0.9704779025877952
Energy: 0.9854614048725604
Energy: 0.9704779025877952
Energy: 0.9854614048725604
Energy: 1.0297029312593788
Energy: 1.0887655021586007
Energy: 1.0297029312593788
Energy: 1.0887655021586007
Energy: 1.0297029312593788
Energy: 1.0887655021575915
Energy: 1.0393928209176304
Energy: 0.9662630337461692
Energy: 1.0393928209176304
Energy: 0.9662630337461692
Energy: 1.0393928209176304
Energy: 0.9662630337461692
Energy: 0.9718708702708329
Energy: 0.9639906591222145
Energy: 0.9718708702718417
Energy: 0.9639906591222145
Energy: 0.9718708702708329
Energy: 0.9639906591222145
Energy: 1.0394078120031975
Energy: 0.9662739596816605
Energy: 1.0394078120031975
Energy: 0.9662739596816605
Energy: 1.0394078120031975
Energy: 0.9662739596816605
Energy: 1.0296199385972356
Energy: 0.9561180748610724
Energy: 1.0296199385962268
Energy: 0.9561180748630903
Energy: 1.0296199385962268
Energy: 0.9561180748600634
Energy: 0.9704779025888043
Energy: 0.9854614048745783
Energy: 0.9704779025888043
Energy: 0.9854614048745783
Energy: 0.9704779025888043
Energy: 0.9854614048745783
Energy: 1.029702931256352
Energy: 1.0887655021565827
Energy: 1.029702931256352
Energy: 1.0887655021565827
Energy: 1.029702931256352
Energy: 1.0887655021575915
Energy: 1.0393928209166214
Energy: 0.9662630337431424
Energy: 1.0393928209176304
Energy: 0.9662630337421333
Energy: 1.0393928209176304
Energy: 0.9662630337431424
Energy: 0.9718708702748685
Energy: 0.9639906591212055
Energy: 0.9718708702758776
Energy: 0.9639906591212055
Energy: 0.9718708702758776
Energy: 0.9639906591201965
Energy: 1.0394078120031975
Energy: 0.9662739596816605
Energy: 1.0394078120021886
Energy: 0.9662739596816605
Energy: 1.0394078120031975
Energy: 0.9662739596816605

minimum gb energy = 0.9561180748600634 eV
minimum distance =  2.29593556717216 Angstroms
sigma value = 9


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

Energy: 1.059556784765053
Energy: 1.0264110390249193
Energy: 1.0595567847667005
Energy: 1.0264110390240955
Energy: 1.059556784765877
Energy: 1.0264110390249193
Energy: 1.0550991414441415
Energy: 1.0232793463792926
Energy: 1.0550991414466129
Energy: 1.0232793463792926
Energy: 1.0550991414466129
Energy: 1.0232793463801162
Energy: 1.0577623132668048
Energy: 1.0303165136128225
Energy: 1.0577623132668048
Energy: 1.0303165136128225
Energy: 1.0577623132684524
Energy: 1.0303165136128225
Energy: 1.0098895023141914
Energy: 1.1171151847527818
Energy: 1.0098895023141914
Energy: 1.1171151847527818
Energy: 1.0098895023141914
Energy: 1.1171151847527818
Energy: 1.0505231275826918
Energy: 1.0279971247141353
Energy: 1.0505231275826918
Energy: 1.0279971247141353
Energy: 1.0505231275826918
Energy: 1.0279971247141353
Energy: 1.0570294080418523
Energy: 1.0308484175076917
Energy: 1.0570294080410285
Energy: 1.0308484175076917
Energy: 1.0570294080418523
Energy: 1.0308484175076917
Energy: 1.0043085355797834
Energy: 1.0680273936038607
Energy: 1.0043085355797834
Energy: 1.0680273936046845
Energy: 1.0043085355797834
Energy: 1.0680273936046845
Energy: 1.023866008859918
Energy: 1.0778583315110557
Energy: 1.0238660088607419
Energy: 1.0778583315118795
Energy: 1.0238660088590943
Energy: 1.0778583315110557
Energy: 1.1108408136415044
Energy: 1.0289798856333752
Energy: 1.1108408136406807
Energy: 1.028979885634199
Energy: 1.1108408136415044
Energy: 1.0289798856333752
Energy: 1.0128483546109803
Energy: 1.0538297029712
Energy: 1.0128483546118041
Energy: 1.0538297029703763
Energy: 1.0128483546109803
Energy: 1.0538297029703763
Energy: 1.0202136202572147
Energy: 1.0661404853580452
Energy: 1.0202136202572147
Energy: 1.066140485358869
Energy: 1.0202136202572147
Energy: 1.066140485358869
Energy: 1.108258995129178
Energy: 1.0338676226678873
Energy: 1.1082589951267068
Energy: 1.0338676226678873
Energy: 1.1082589951275306
Energy: 1.0338676226678873
Energy: 1.012768414283618
Energy: 1.0724570100259951
Energy: 1.0127684142819704
Energy: 1.072457010026819
Energy: 1.0127684142819704
Energy: 1.072457010026819
Energy: 1.054298381975092
Energy: 1.0521404741809317
Energy: 1.0542983819759157
Energy: 1.0521404741809317
Energy: 1.0542983819742682
Energy: 1.0521404741809317
Energy: 1.1083452908253337
Energy: 1.0281906865649717
Energy: 1.1083452908245097
Energy: 1.0281906865649717
Energy: 1.1083452908261575
Energy: 1.0281906865649717
Energy: 1.048668215398536
Energy: 1.05161896240419
Energy: 1.0486682153993598
Energy: 1.0516189624058379
Energy: 1.0486682153993598
Energy: 1.0516189624058379
Energy: 1.0487179154697834
Energy: 1.0671337552527445
Energy: 1.0487179154697834
Energy: 1.0671337552535682
Energy: 1.0487179154697834
Energy: 1.0671337552535682
Energy: 1.1587761906942144
Energy: 1.0311820281076605
Energy: 1.1587761906942144
Energy: 1.0311820281076605
Energy: 1.1587761906942144
Energy: 1.0311820281076605
Energy: 1.0117418404933591
Energy: 1.058472122609906
Energy: 1.0117418404925356
Energy: 1.058472122609906
Energy: 1.0117418404917118
Energy: 1.058472122609906
Energy: 1.0246105842939073
Energy: 1.0217001748828722
Energy: 1.0246105842939073
Energy: 1.0217001748828722
Energy: 1.0246105842939073
Energy: 1.0217001748820485
Energy: 1.112478121456079
Energy: 1.032929596425489
Energy: 1.1124781214569028
Energy: 1.032929596425489
Energy: 1.1124781214552553
Energy: 1.032929596425489

minimum gb energy = 1.0043085355797834 eV
minimum distance =  2.27771015020031 Angstroms
sigma value = 27


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

Energy: 1.0448751867007537
Energy: 1.0172731001689577
Energy: 1.0448751867000594
Energy: 1.0172731001675688
Energy: 1.0448751867007537
Energy: 1.0172731001668744
Energy: 1.0239983691509558
Energy: 1.0167792836837972
Energy: 1.0239983691509558
Energy: 1.0167792836865748
Energy: 1.0239983691502612
Energy: 1.0167792836865748
Energy: 1.0442812006424127
Energy: 0.9773637188498445
Energy: 1.0442812006403293
Energy: 0.977363718850539
Energy: 1.0442812006396351
Energy: 0.977363718850539
Energy: 0.982236203774167
Energy: 1.004856935971462
Energy: 0.9822362037720839
Energy: 1.0048569359721564
Energy: 0.9822362037713894
Energy: 1.0048569359721564
Energy: 1.018617329223921
Energy: 0.987564438646068
Energy: 1.018617329223921
Energy: 0.9875644386467625
Energy: 1.018617329223921
Energy: 0.9875644386467625
Energy: 0.9874239349858724
Energy: 0.9918194878554403
Energy: 0.9874239349858724
Energy: 0.9918194878547457
Energy: 0.9874239349865668
Energy: 0.9918194878547457
Energy: 0.9938348834693906
Energy: 1.0530861630045145
Energy: 0.9938348834693906
Energy: 1.0530861630045145
Energy: 0.993834883470085
Energy: 1.0530861630045145
Energy: 1.045503985593869
Energy: 1.0416280100683935
Energy: 1.0455039855924801
Energy: 1.0416280100683935
Energy: 1.045503985593869
Energy: 1.041628010067699
Energy: 1.0243828610540682
Energy: 0.9917238730316065
Energy: 1.0243828610533736
Energy: 0.991723873034384
Energy: 1.0243828610547627
Energy: 0.9917238730350786
Energy: 0.9821407061627675
Energy: 1.0281651568229342
Energy: 0.9821407061627675
Energy: 1.0281651568229342
Energy: 0.9821407061613786
Energy: 1.0281651568222394
Energy: 0.982471011735287
Energy: 1.0171271945484144
Energy: 0.982471011735287
Energy: 1.017127194549109
Energy: 0.9824710117345924
Energy: 1.0171271945477203
Energy: 1.0518309775364079
Energy: 0.994817051280974
Energy: 1.0518309775364079
Energy: 0.994817051280974
Energy: 1.0518309775364079
Energy: 0.9948170512802795
Energy: 1.0617609199136169
Energy: 1.0237000932230884
Energy: 1.061760919912228
Energy: 1.0237000932230884
Energy: 1.061760919912922
Energy: 1.0237000932230884
Energy: 0.9893737955830464
Energy: 1.016120252054315
Energy: 0.9893737955816576
Energy: 1.0161202520536208
Energy: 0.9893737955830464
Energy: 1.016120252054315
Energy: 0.9892651911938625
Energy: 0.9914836118788178
Energy: 0.9892651911945569
Energy: 0.9914836118781233
Energy: 0.9892651911931681
Energy: 0.9914836118781233
Energy: 1.0184220737298049
Energy: 0.9559313932154452
Energy: 1.0184220737291105
Energy: 0.9559313932154452
Energy: 1.0184220737277216
Energy: 0.9559313932147508
Energy: 0.9823465010761805
Energy: 1.0514486382510964
Energy: 0.9823465010754862
Energy: 1.051448638250402
Energy: 0.982346501076875
Energy: 1.051448638250402
Energy: 1.0061940072299649
Energy: 0.9766776594915366
Energy: 1.0061940072278817
Energy: 0.9766776594915366
Energy: 1.006194007228576
Energy: 0.976677659492231
Energy: 1.0054878462417525
Energy: 0.9902490862877729
Energy: 1.0054878462417525
Energy: 0.9902490862877729
Energy: 1.005487846241058
Energy: 0.9902490862884674
Energy: 1.044875186701448
Energy: 1.0172731001675688
Energy: 1.0448751867000594
Energy: 1.0172731001668744
Energy: 1.044875186701448
Energy: 1.0172731001661799
Energy: 1.0239983691509558
Energy: 1.0167792836844918
Energy: 1.0239983691523444
Energy: 1.0167792836865748
Energy: 1.02399836915165
Energy: 1.0167792836865748
Energy: 1.044281200641024
Energy: 0.9773637188491502
Energy: 1.0442812006403293
Energy: 0.9773637188491502
Energy: 1.0442812006403293
Energy: 0.9773637188491502
Energy: 0.9822362037706951
Energy: 1.004856935974934
Energy: 0.9822362037720839
Energy: 1.0048569359756285
Energy: 0.9822362037706951
Energy: 1.004856935974934
Energy: 1.018617329223921
Energy: 0.9875644386508973
Energy: 1.018617329223921
Energy: 0.9875644386502028
Energy: 1.018617329223921
Energy: 0.9875644386508973
Energy: 0.9874239349858724
Energy: 0.9918194878589122
Energy: 0.9874239349872612
Energy: 0.9918194878589122
Energy: 0.9874239349872612
Energy: 0.9918194878589122

minimum gb energy = 0.9559313932147508 eV
minimum distance =  2.31481483538273 Angstroms
sigma value = 19


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

Energy: 0.9906708686851754
Energy: 1.1073382503013123
Energy: 0.9906708686857749
Energy: 1.1073382503013123
Energy: 0.9906708686863743
Energy: 1.1073382503013123
Energy: 1.0126099878246795
Energy: 0.9579604606638585
Energy: 1.0126099878240804
Energy: 0.9579604606638585
Energy: 1.0126099878252788
Energy: 0.9579604606638585
Energy: 1.081446740056093
Energy: 0.9341185985751448
Energy: 1.0315953324016234
Energy: 0.9341185985751448
Energy: 1.0315953323722802
Energy: 0.9341185985751448
Energy: 0.9452401075720084
Energy: 1.0152949402990368
Energy: 0.9452401075720084
Energy: 1.0152949402984375
Energy: 0.9452401075720084
Energy: 1.0152949402990368
Energy: 0.9848144313854217
Energy: 1.0048309654079735
Energy: 0.9848144313842229
Energy: 1.0048309654073742
Energy: 0.9848144313860211
Energy: 1.0048309654073742
Energy: 1.0162891517388133
Energy: 0.9583751743698931
Energy: 1.0162891517388133
Energy: 0.9583751743698931
Energy: 1.0162891517388133
Energy: 0.9583751743698931
Energy: 0.932927812523796
Energy: 1.0839873221483785
Energy: 0.932927812523796
Energy: 1.083987322147779
Energy: 0.9329278125231966
Energy: 1.083987322147779
Energy: 0.9596567985620449
Energy: 1.0862094149357844
Energy: 0.9596567985626442
Energy: 1.0862094149339863
Energy: 0.9596567985632437
Energy: 1.0862094149339863
Energy: 1.0462518424067042
Energy: 0.933690552960009
Energy: 1.0462518424049059
Energy: 0.9336905529594095
Energy: 1.0462518424061047
Energy: 0.9336905529594095
Energy: 0.9694170936116508
Energy: 0.9906264765595859
Energy: 0.9694170936104521
Energy: 0.9906264765595859
Energy: 0.9694170936116508
Energy: 0.9906264765595859
Energy: 0.9403310002676528
Energy: 1.1153634420476932
Energy: 0.940331000266454
Energy: 1.1153634420476932
Energy: 0.9403310002670533
Energy: 1.1153634420482927
Energy: 1.0269311301401338
Energy: 0.9332691829069324
Energy: 1.0269311301407331
Energy: 0.9332691829069324
Energy: 1.0269311301401338
Energy: 0.9332691829069324
Energy: 0.954638700050816
Energy: 0.9644884451580265
Energy: 0.954638700050816
Energy: 0.9644884451580265
Energy: 0.9546387000520147
Energy: 0.9644884451580265
Energy: 0.9548293750179522
Energy: 1.0119746408443573
Energy: 0.9548293750173529
Energy: 1.0119746408431582
Energy: 0.9548293750179522
Energy: 1.0119746408431582
Energy: 1.0137369078747918
Energy: 0.9327069374773976
Energy: 1.0137369078795866
Energy: 0.9327069374773976
Energy: 1.0137369078789875
Energy: 0.9327069374773976
Energy: 1.0362277037773295
Energy: 0.9324753257742385
Energy: 1.0362277037773295
Energy: 0.9324753257748379
Energy: 1.0362277037755314
Energy: 0.9324753257742385
Energy: 0.9426942785489404
Energy: 1.0304836778949622
Energy: 0.9426942785495399
Energy: 1.0304836778961612
Energy: 0.9426942785495399
Energy: 1.0304836778955617
Energy: 0.9872746204787047
Energy: 0.982753833343335
Energy: 0.9872746204799037
Energy: 0.982753833343335
Energy: 0.9872746204793043
Energy: 0.982753833343335
Energy: 1.0316040234011483
Energy: 0.9597256308367601
Energy: 1.031604023400549
Energy: 0.9597256308367601
Energy: 1.0316040234011483
Energy: 0.9597256308373593
Energy: 0.9426459098927411
Energy: 1.0372143129242932
Energy: 0.9426459098927411
Energy: 1.0372143129242932
Energy: 0.9426459098933405
Energy: 1.0372143129242932
Energy: 0.9258553325825231
Energy: 1.023839291757117
Energy: 0.9258553325831226
Energy: 1.0238392917565176
Energy: 0.9258553325837219
Energy: 1.0238392917565176
Energy: 1.085623698933
Energy: 0.9421715591398718
Energy: 1.0856236989341987
Energy: 0.9421715591398718
Energy: 1.0856236989324006
Energy: 0.9421715591398718
Energy: 1.000480255375067
Energy: 0.9796428664031347
Energy: 1.0004802553738683
Energy: 0.9796428664037341
Energy: 1.0004802553744676
Energy: 0.9796428664061317
Energy: 0.9848548809370715
Energy: 1.0680794605324142
Energy: 0.9848548809364721
Energy: 1.0680794605324142
Energy: 0.9848548809370715
Energy: 1.0680794605318147
Energy: 1.0238592269889966
Energy: 0.9345890062973083
Energy: 1.0238592269883973
Energy: 0.9345890062973083
Energy: 1.0238592269877977
Energy: 0.9345890062973083
Energy: 0.9764364916626169
Energy: 0.9543919803451338
Energy: 0.9764364916632163
Energy: 0.9543919803445344
Energy: 0.9764364916626169
Energy: 0.9543919803445344
Energy: 0.9329790853371286
Energy: 1.0102089284564537
Energy: 0.932979085337728
Energy: 1.0102089284570532
Energy: 0.9329790853371286
Energy: 1.0102089284546558
Energy: 1.0181999613282657
Energy: 0.9603926825008324
Energy: 1.0181999613276662
Energy: 0.9603926825008324
Energy: 1.0181999613276662
Energy: 0.9603926825008324
Energy: 1.029935026343956
Energy: 0.9603894308550173
Energy: 1.0299350263433564
Energy: 0.9603894308544179
Energy: 1.029935026343956
Energy: 0.9603894308550173

minimum gb energy = 0.9258553325825231 eV
minimum distance =  2.2582083568059 Angstroms
sigma value = 101


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

Energy: 0.9229934100376892
Energy: 1.0149682293747362
Energy: 0.922993410038216
Energy: 1.0149682293736824
Energy: 0.922993410038216
Energy: 1.0149682293742093
Energy: 0.9814242655404829
Energy: 0.8994729930630084
Energy: 0.981424265539956
Energy: 0.8994729930624816
Energy: 0.9814242655404829
Energy: 0.8994729930624816
Energy: 0.9897004508823288
Energy: 0.8959910392971673
Energy: 0.9897004508812751
Energy: 0.8959910392966404
Energy: 0.9897004508828556
Energy: 0.8959910392971673
Energy: 0.8795981345831198
Energy: 0.974082103048793
Energy: 0.8795981345831198
Energy: 0.9444304405994396
Energy: 0.8795981345836466
Energy: 0.9444304405983858
Energy: 0.910791411999842
Energy: 0.9493798575011352
Energy: 0.9107914120014229
Energy: 0.949379857502189
Energy: 0.9107914119987885
Energy: 0.9493798575011352
Energy: 0.9876686211695487
Energy: 0.8961117373283422
Energy: 0.9876686211700755
Energy: 0.8961117373283422
Energy: 0.9876686211700755
Energy: 0.8961117373288691
Energy: 0.8974070579858838
Energy: 0.9685832374183752
Energy: 0.8974070579858838
Energy: 0.968583237419429
Energy: 0.8974070579853568
Energy: 0.9685832374189022
Energy: 0.8788926205286686
Energy: 0.9960811089067607
Energy: 0.8788926205291956
Energy: 0.9960811089062338
Energy: 0.8788926205270879
Energy: 0.9960811089057069
Energy: 0.9865162022687473
Energy: 0.892178489872487
Energy: 0.9865162022687473
Energy: 0.8921784898719602
Energy: 0.9865162022676937
Energy: 0.892178489872487
Energy: 0.9543483051701875
Energy: 0.929501047563927
Energy: 0.9543483051707146
Energy: 0.9362848339091058
Energy: 0.95434830516808
Energy: 0.9362848339096328
Energy: 0.8751889445277625
Energy: 1.110062892994479
Energy: 0.8751889445282893
Energy: 1.110062892994479
Energy: 0.8751889445277625
Energy: 1.110062892993952
Energy: 0.9677131459139402
Energy: 0.8984995918408795
Energy: 0.9677131459134132
Energy: 0.8984995918408795
Energy: 0.9677131459097249
Energy: 0.8984995918408795
Energy: 0.980782490844043
Energy: 0.8959379210250143
Energy: 0.9807824908450966
Energy: 0.8959379210244874
Energy: 0.9807824908445698
Energy: 0.8959379210244874
Energy: 0.922713708709502
Energy: 1.015912004275616
Energy: 0.9227137087084482
Energy: 1.015912004275616
Energy: 0.9227137087100289
Energy: 1.015912004275616
Energy: 0.9222201479194213
Energy: 0.9457580837737785
Energy: 0.9222201479188944
Energy: 0.9457580837732515
Energy: 0.9222201479220558
Energy: 0.9457580837732515
Energy: 0.98933512131256
Energy: 0.8999526062835336
Energy: 0.9893351213130867
Energy: 0.8999526062835336
Energy: 0.98933512131256
Energy: 0.8999526062840606
Energy: 0.8787635442029652
Energy: 0.9535502445361734
Energy: 0.8787635442029652
Energy: 0.9535502445367003
Energy: 0.8787635442034921
Energy: 0.9535502445388079
Energy: 0.8749384964966332
Energy: 0.9446580355525787
Energy: 0.8749384964961062
Energy: 0.9446580355531055
Energy: 0.8749384964966332
Energy: 0.9446580355525787
Energy: 0.9863414233024514
Energy: 0.892319533990095
Energy: 0.9863414233035053
Energy: 0.892319533990622
Energy: 0.9863414233029781
Energy: 0.892319533990095
Energy: 0.8953447826862083
Energy: 0.9229931197238009
Energy: 0.895344782683574
Energy: 0.9229931197238009
Energy: 0.8953447826856815
Energy: 0.9229931197238009
Energy: 0.8789958372996635
Energy: 1.107871228003807
Energy: 0.8789958373012442
Energy: 1.107871228004861
Energy: 0.8789958372996635
Energy: 1.107871228005388
Energy: 1.1314079529603207
Energy: 0.8915258643790402
Energy: 1.1314079529597938
Energy: 0.8915258643790402
Energy: 1.1314079529608476
Energy: 0.8915258643790402
Energy: 0.9895318162540568
Energy: 0.8933534515211788
Energy: 0.989531816253003
Energy: 0.8933534515211788
Energy: 0.9895318162514223
Energy: 0.8933534515211788
Energy: 0.8798414718787514
Energy: 1.0191014361846304
Energy: 0.879841471880859
Energy: 1.0191014361856845
Energy: 0.8798414718787514
Energy: 1.019101436187792
Energy: 0.9692461253404736
Energy: 0.9250297177013064
Energy: 0.9692461253373124
Energy: 0.9250297177018332
Energy: 0.9692461253410007
Energy: 0.9250297177018332
Energy: 0.980553301739969
Energy: 0.8999384892193532
Energy: 0.9805533017394421
Energy: 0.8999384892193532
Energy: 0.9805533017404959
Energy: 0.8999384892193532
Energy: 0.921661196049136
Energy: 1.028977314537017
Energy: 0.921661196049136
Energy: 1.0289773145375438
Energy: 0.921661196049136
Energy: 1.028977314537017
Energy: 0.922906825730111
Energy: 0.9447463259087117
Energy: 0.9229068257316917
Energy: 0.9447463259092385
Energy: 0.9229068257332723
Energy: 0.9447463259092385
Energy: 1.0194424261464115
Energy: 0.8942776503440473
Energy: 1.0194424261469384
Energy: 0.8942776503440473
Energy: 1.0194424261474655
Energy: 0.8942776503445741
Energy: 0.8748888818778066
Energy: 0.9535283060604155
Energy: 0.8748888818793873
Energy: 0.9535283060614693
Energy: 0.8748888818788604
Energy: 0.9535283060598886
Energy: 0.878733215947751
Energy: 0.9987408410570283
Energy: 0.8787332159472242
Energy: 0.9987408410596628
Energy: 0.8787332159472242
Energy: 0.9987408410580821
Energy: 1.0520375999190545
Energy: 0.8915378764817993
Energy: 1.0520375999185276
Energy: 0.8915378764817993
Energy: 1.0520375999185276
Energy: 0.8915378764817993
Energy: 1.0107743356916123
Energy: 0.8929225227564334
Energy: 1.010774335692666
Energy: 0.8929225227559064
Energy: 1.0107743356916123
Energy: 0.8929225227559064

minimum gb energy = 0.8748888818778066 eV
minimum distance =  2.28480578401948 Angstroms
sigma value = 33


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

Energy: 0.014713670138822932
Energy: 0.7240171735261403
Energy: 0.014713670138822932
Energy: 0.7240171735265537
Energy: 0.014713670138822932
Energy: 0.7240171735261403
Energy: 0.015401130382790916
Energy: 0.2644909162982318
Energy: 0.015401130382790916
Energy: 0.2644909162982318
Energy: 0.015401130382790916
Energy: 0.2644909162986695
Energy: 1.3062161833442865
Energy: 0.26400674734009355
Energy: 1.757437298319599
Energy: 0.26400674734094476
Energy: 0.7239130993489818
Energy: 0.26400674734094476
Energy: 0.015401130383204379
Energy: 0.2644909162986695
Energy: 0.015401130383204379
Energy: 0.2644909162982318
Energy: 0.015401130383204379
Energy: 0.264490916299083

minimum gb energy = 0.014713670138822932 eV
minimum distance =  2.55725171507409 Angstroms
sigma value = 1