Model name: model_name=EMT_Asap_MetalGlass_BaileySchiotzJacobsen_2004_CuMg__MO_228059236215_001
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=3.587871603667736
cohesive_energy=3.5216851723143447
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: -5.69299980837746e-26 eV

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

Energy: 0.013828111169277952
Energy: 0.7710035929829092
Energy: 0.013828111169277952
Energy: 0.7710035929829092
Energy: 0.013828111169277952
Energy: 0.7710035929831922
Energy: 0.7710035929831922
Energy: 0.7908044757957315
Energy: 0.7710035929831922
Energy: 0.7908044757960498
Energy: 0.7710035929831922
Energy: 0.7908044757957315
Energy: 0.013828111169277952
Energy: 0.7710035929831922
Energy: 0.013828111169277952
Energy: 0.7710035929829092
Energy: 0.013828111169277952
Energy: 0.7710035929831922
Energy: 0.7710035929831922
Energy: 0.7908044757960498
Energy: 0.7710035929831922
Energy: 0.7908044757957315
Energy: 0.7710035929831922
Energy: 0.7908044757960498
Energy: 0.013828111169277952
Energy: 0.7710035929829092
Energy: 0.013828111169277952
Energy: 0.7710035929829092
Energy: 0.013828111169277952
Energy: 0.7710035929829092
Energy: 0.7710035929831922
Energy: 0.7908044757957315
Energy: 0.7710035929831922
Energy: 0.7908044757960498
Energy: 0.7710035929831922
Energy: 0.7908044757957315

minimum gb energy = 0.013828111169277952 eV
minimum distance =  2.38639304293108 Angstroms
sigma value = 1


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

Energy: 0.9481386442314679
Energy: 0.8964035826677927
Energy: 0.9481386442314679
Energy: 0.8964035826677927
Energy: 0.9481386442322345
Energy: 0.8964035826677927
Energy: 1.027300531423746
Energy: 0.8338924781372662
Energy: 1.027300531423746
Energy: 0.8338924781372662
Energy: 1.027300531423746
Energy: 0.8338924781372662
Energy: 0.9461170008174553
Energy: 0.945662623989995
Energy: 0.9461170008174553
Energy: 0.9456626239907615
Energy: 0.9461170008174553
Energy: 0.9456626239907615
Energy: 0.9985760882895807
Energy: 0.878005961702547
Energy: 0.9985760882895807
Energy: 0.878005961702547
Energy: 0.9985760882895807
Energy: 0.878005961702547
Energy: 0.9052249452514497
Energy: 0.9516381983934005
Energy: 0.9052249452514497
Energy: 0.9516381983941667
Energy: 0.9052249452514497
Energy: 0.9516381983934005
Energy: 0.9491815805124003
Energy: 0.8529965367565899
Energy: 0.9491815805124003
Energy: 0.8529965367565899
Energy: 0.9491815805124003
Energy: 0.8529965367565899
Energy: 0.923535645634542
Energy: 0.9326268680430514
Energy: 0.9000333565688158
Energy: 0.9326268680430514
Energy: 0.9000333565688158
Energy: 0.9326268680430514
Energy: 0.8749067346445432
Energy: 1.003278569093735
Energy: 0.8749067346445432
Energy: 1.003278569093735
Energy: 0.8749067346445432
Energy: 1.003278569093735
Energy: 0.970034438677983
Energy: 0.9398449178434309
Energy: 0.970034438677983
Energy: 0.9398449178434309
Energy: 0.970034438677983
Energy: 0.9398449178434309
Energy: 0.8232318466765091
Energy: 0.992662678542893
Energy: 0.8232318466765091
Energy: 0.992662678542893
Energy: 0.8232318466765091
Energy: 0.992662678542893
Energy: 0.9452943871907847
Energy: 0.8526978045461594
Energy: 0.9452943871907847
Energy: 0.8526978045461594
Energy: 0.9452943871900185
Energy: 0.8526978045461594
Energy: 0.8078082040042823
Energy: 0.8985554642117468
Energy: 0.8078082040042823
Energy: 0.8985554583502322
Energy: 0.8078082040042823
Energy: 0.89855544385576
Energy: 1.05419844579943
Energy: 0.8000554621742723
Energy: 1.05419844579943
Energy: 0.8000554621742723
Energy: 1.05419844579943
Energy: 0.8000554621742723
Energy: 0.8655210795718528
Energy: 0.8849383311705797
Energy: 0.8655210795718528
Energy: 0.8849383311698135
Energy: 0.8655210795710864
Energy: 0.8849383311698135
Energy: 1.0566282491265946
Energy: 0.8346886200252925
Energy: 1.0566282491265946
Energy: 0.8346886200252925
Energy: 1.0566282491265946
Energy: 0.8346886200252925
Energy: 1.0549912129864825
Energy: 0.9520520140806983
Energy: 1.0549912129864825
Energy: 0.9520520140806983
Energy: 1.0549912129864825
Energy: 0.9520520140806983
Energy: 0.9244758093463422
Energy: 0.9204148324100577
Energy: 0.9244758093463422
Energy: 0.9204148324100577
Energy: 0.9244758093463422
Energy: 0.9204148324100577
Energy: 0.9247625310612294
Energy: 0.8797308731758332
Energy: 0.9247625310612294
Energy: 0.8797308731758332
Energy: 0.9247625310612294
Energy: 0.8797308731758332
Energy: 0.9155007615555147
Energy: 0.8777634246382088
Energy: 0.9155007615555147
Energy: 0.8777634246382088
Energy: 0.9155007615555147
Energy: 0.8777634246382088
Energy: 0.9546490171542993
Energy: 0.853055885177157
Energy: 0.9546490171542993
Energy: 0.853055885177157
Energy: 0.9546490171535329
Energy: 0.853055885177157
Energy: 0.8433737597778884
Energy: 1.0067672398871663
Energy: 0.8433737597778884
Energy: 1.0067672398871663
Energy: 0.8433737597778884
Energy: 1.0067672398879328
Energy: 0.9564133398044895
Energy: 0.9346655058363688
Energy: 0.9564133398044895
Energy: 0.9346655058371351
Energy: 0.9564133398044895
Energy: 0.9346655058371351
Energy: 0.8204161132768059
Energy: 1.0103789275922175
Energy: 0.8204161132768059
Energy: 1.0103789275914512
Energy: 0.8204161132768059
Energy: 1.0103789275914512

minimum gb energy = 0.8000554621742723 eV
minimum distance =  2.29857380676931 Angstroms
sigma value = 33


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

Energy: 0.9481431632100362
Energy: 0.9874695594406696
Energy: 0.9481431632100362
Energy: 0.9874695594402337
Energy: 0.9481431632100362
Energy: 0.9874695594402337
Energy: 0.95530919311366
Energy: 0.8838444871883311
Energy: 0.95530919311366
Energy: 0.8838444871883311
Energy: 0.95530919311366
Energy: 0.8838444871883311
Energy: 0.8064369419138296
Energy: 0.8849362565331045
Energy: 0.8064369419138296
Energy: 0.8849362565331045
Energy: 0.8064369419133937
Energy: 0.8849362565331045
Energy: 0.9684784561777305
Energy: 0.9698675581872452
Energy: 0.9684784561777305
Energy: 0.9698675581863735
Energy: 0.9684784561777305
Energy: 0.9698675581876811
Energy: 0.8837214349277173
Energy: 0.9215852108909516
Energy: 0.8837214349277173
Energy: 0.9215852108909516
Energy: 0.8837214349272815
Energy: 0.9215852108909516
Energy: 0.8845705909879599
Energy: 0.80436163124798
Energy: 0.8845705909879599
Energy: 0.804361631248416
Energy: 0.8845705909879599
Energy: 0.80436163124798
Energy: 0.9880421883815557
Energy: 0.9482232287113584
Energy: 0.9880421883815557
Energy: 0.9482232287117943
Energy: 0.9880421883811198
Energy: 0.9482232287117943
Energy: 0.8013731978505109
Energy: 0.9488170520424438
Energy: 0.8013731978500749
Energy: 0.9488170520424438
Energy: 0.8013731978500749
Energy: 0.9488170520424438
Energy: 0.845920123379662
Energy: 0.8059510585117811
Energy: 0.845920123379662
Energy: 0.8059510585117811
Energy: 0.845920123379662
Energy: 0.8059510585113453
Energy: 0.7977681937043294
Energy: 0.8926705943830241
Energy: 0.797768193704765
Energy: 0.8926705943834601
Energy: 0.7977681937043294
Energy: 0.8926705943834601
Energy: 0.891750418191478
Energy: 0.7939870769061899
Energy: 0.8917504181910421
Energy: 0.7939870769061899
Energy: 0.891750418191478
Energy: 0.7939870769061899
Energy: 0.8040018869349906
Energy: 0.8436578559362216
Energy: 0.8040018869349906
Energy: 0.8436578559362216
Energy: 0.8040018869354266
Energy: 0.8436578559362216
Energy: 0.9492332143451404
Energy: 0.7997951034814818
Energy: 0.9492332143451404
Energy: 0.7997951034814818
Energy: 0.9492332143451404
Energy: 0.7997951034814818
Energy: 0.956752084158403
Energy: 0.9925169279849029
Energy: 0.956752084158403
Energy: 0.9925169279853386
Energy: 0.956752084158403
Energy: 0.9925169279849029
Energy: 0.8908821931160535
Energy: 0.8860201184352403
Energy: 0.8908821931160535
Energy: 0.8860201184348043
Energy: 0.8908821931160535
Energy: 0.8860201184348043
Energy: 0.8043809151170993
Energy: 0.8861387371018054
Energy: 0.8043809151170993
Energy: 0.8861387371018054
Energy: 0.8043809151170993
Energy: 0.8861387371018054
Energy: 0.9752314349286108
Energy: 0.9704625772899477
Energy: 0.9752314349286108
Energy: 0.9704625772899477
Energy: 0.9752314349286108
Energy: 0.9704625772899477
Energy: 0.8851684422544089
Energy: 0.8041818314474736
Energy: 0.8851684422544089
Energy: 0.8041818314474736
Energy: 0.885168442253973
Energy: 0.8041818314474736
Energy: 0.8875255281517561
Energy: 0.8911718853991731
Energy: 0.8875255281517561
Energy: 0.8911718853996092
Energy: 0.8875255281517561
Energy: 0.8911718853991731
Energy: 0.9886830869999114
Energy: 0.9506237594171153
Energy: 0.9886830869999114
Energy: 0.9506237594171153
Energy: 0.9886830869999114
Energy: 0.9506237594166792
Energy: 0.7994957538215658
Energy: 0.9487401381445486
Energy: 0.7994957538215658
Energy: 0.9487401381441126
Energy: 0.7994957538215658
Energy: 0.9487401381445486
Energy: 0.8849120156175487
Energy: 0.8061134356141271
Energy: 0.8849120156175487
Energy: 0.8061134356141271
Energy: 0.8849120156175487
Energy: 0.8061134356141271
Energy: 0.792323841062482
Energy: 0.8936082266973429
Energy: 0.792323841062482
Energy: 0.8936082266973429
Energy: 0.792323841062482
Energy: 0.8936082266973429
Energy: 0.8912845380892834
Energy: 0.8828559391844308
Energy: 0.8912845380897194
Energy: 0.8828559391844308
Energy: 0.8912845380892834
Energy: 0.8828559391848666
Energy: 0.8063687120720073
Energy: 0.8816185036535658
Energy: 0.8063687120720073
Energy: 0.8816185036535658
Energy: 0.8063687120720073
Energy: 0.8816185036535658
Energy: 0.948269343449254
Energy: 0.9669782732057733
Energy: 0.948269343449254
Energy: 0.9669782732053376
Energy: 0.948269343449254
Energy: 0.9669782732053376
Energy: 0.9485393428247717
Energy: 0.9668762122088727
Energy: 0.9485393428247717
Energy: 0.9668762122093085
Energy: 0.9485393428247717
Energy: 0.9668762122088727
Energy: 0.8063797991904459
Energy: 0.881447546917943
Energy: 0.8063797991904459
Energy: 0.881447546917943
Energy: 0.8063797991904459
Energy: 0.881447546917943
Energy: 0.8911854190581499
Energy: 0.8828632469259015
Energy: 0.8911854190581499
Energy: 0.8828632469259015
Energy: 0.8911854190581499
Energy: 0.8828632469259015
Energy: 0.7923174484032877
Energy: 0.8939062825442399
Energy: 0.7923174484032877
Energy: 0.8939062825446759
Energy: 0.7923174484032877
Energy: 0.8939062825446759
Energy: 0.8847596216027915
Energy: 0.8060755722642837
Energy: 0.8847596216027915
Energy: 0.8060755722642837
Energy: 0.8847596216027915
Energy: 0.8060755722642837
Energy: 0.7996041245956966
Energy: 0.948945147687459
Energy: 0.7996041245961324
Energy: 0.948945147687895
Energy: 0.7996041245956966
Energy: 0.948945147687459
Energy: 0.9886977733911232
Energy: 0.9506409584666123
Energy: 0.9886977733911232
Energy: 0.9506409584666123
Energy: 0.9886977733911232
Energy: 0.9506409584666123
Energy: 0.8875090459130063
Energy: 0.8910272085028248
Energy: 0.8875090459130063
Energy: 0.8910272085032607
Energy: 0.8875090459125704
Energy: 0.8910272085028248
Energy: 0.8853893077642778
Energy: 0.8044172367360606
Energy: 0.8853893077647135
Energy: 0.8044172367360606
Energy: 0.8853893077647135
Energy: 0.8044172367360606
Energy: 0.9751790826529101
Energy: 0.9704973801078692
Energy: 0.9751790826529101
Energy: 0.9704973801078692
Energy: 0.9751790826529101
Energy: 0.9704973801078692
Energy: 0.8043167996509629
Energy: 0.8859909649617943
Energy: 0.8043167996509629
Energy: 0.8859909649622302
Energy: 0.8043167996513986
Energy: 0.8859909649617943
Energy: 0.8908206347950047
Energy: 0.8860518944033885
Energy: 0.8908206347945687
Energy: 0.8860518944033885
Energy: 0.8908206347950047
Energy: 0.8860518944033885
Energy: 0.956802507646066
Energy: 0.9925261239367059
Energy: 0.956802507646066
Energy: 0.9925261239367059
Energy: 0.956802507646066
Energy: 0.9925261239367059
Energy: 0.9500767485882892
Energy: 0.7997724920142729
Energy: 0.950076748588725
Energy: 0.7997724920142729
Energy: 0.950076748588725
Energy: 0.7997724920142729
Energy: 0.8040001467244181
Energy: 0.8436015244792865
Energy: 0.8040001467239823
Energy: 0.8436015244792865
Energy: 0.8040001467244181
Energy: 0.8436015244792865

minimum gb energy = 0.7923174484032877 eV
minimum distance =  2.38934656864762 Angstroms
sigma value = 51


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

Energy: 0.9300540722100105
Energy: 0.945079533639412
Energy: 0.9300540722100105
Energy: 0.945079533639412
Energy: 0.9300540722100105
Energy: 0.945079533639412
Energy: 0.9989373647482884
Energy: 0.8878387519361015
Energy: 0.9989373647482884
Energy: 0.8878387519361015
Energy: 0.9989373647482884
Energy: 0.8878387519361015
Energy: 0.8942717920178606
Energy: 0.9357447522216846
Energy: 0.8942717920188705
Energy: 0.9357447522216846
Energy: 0.8942717920178606
Energy: 0.9357447522216846
Energy: 0.9279032356323239
Energy: 0.8232290341484112
Energy: 0.9279032356323239
Energy: 0.8232290341484112
Energy: 0.9279032356323239
Energy: 0.8232290341484112
Energy: 0.9417693805739564
Energy: 0.9032810222498996
Energy: 0.9417693805739564
Energy: 0.9032810222498996
Energy: 0.9417693805739564
Energy: 0.9032810222498996
Energy: 0.9426480860328925
Energy: 0.9032288203864557
Energy: 0.9426480860328925
Energy: 0.9032288203864557
Energy: 0.9426480860328925
Energy: 0.9032288203864557
Energy: 0.8991523750806418
Energy: 0.9031256244495797
Energy: 0.8991523750806418
Energy: 0.9031256244495797
Energy: 0.8991523750806418
Energy: 0.9031256244495797
Energy: 0.8589980435028279
Energy: 0.9037716493779184
Energy: 0.8589980435028279
Energy: 0.9037716493779184
Energy: 0.8589980435028279
Energy: 0.9037716493779184
Energy: 1.0630773785296788
Energy: 0.8196112702229095
Energy: 1.0630773785296788
Energy: 0.8196112702229095
Energy: 1.0630773785296788
Energy: 0.8196112702229095
Energy: 0.8387023895350675
Energy: 0.9524550969363516
Energy: 0.8387023895350675
Energy: 0.9524550969353418
Energy: 0.8387023895350675
Energy: 0.9524550969323119
Energy: 0.9803275527334652
Energy: 0.8198008195428591
Energy: 0.9803275527334652
Energy: 0.8198008195428591
Energy: 0.9803275527334652
Energy: 0.8198008195428591
Energy: 0.9320648739691816
Energy: 0.9468892799310376
Energy: 0.9320648739691816
Energy: 0.9468892799310376
Energy: 0.9320648739691816
Energy: 0.9468892799310376
Energy: 0.9963829196981157
Energy: 0.8880464476477614
Energy: 0.9963829196981157
Energy: 0.8880464476477614
Energy: 0.9963829196981157
Energy: 0.8880464476477614
Energy: 0.89424595286678
Energy: 0.8710771818396095
Energy: 0.89424595286678
Energy: 0.8710771818396095
Energy: 0.89424595286678
Energy: 0.8710771818396095
Energy: 0.9284709219915929
Energy: 0.9352624428763899
Energy: 0.9284709219915929
Energy: 0.9352624428763899
Energy: 0.9284709219915929
Energy: 0.9352624428763899
Energy: 0.9415732312584012
Energy: 0.9031549687715801
Energy: 0.9415732312584012
Energy: 0.9031549687715801
Energy: 0.9415732312584012
Energy: 0.9031549687715801
Energy: 0.9434992674548799
Energy: 0.9746594920460945
Energy: 0.9434992674548799
Energy: 0.9746594920460945
Energy: 0.9434992674548799
Energy: 0.9746594920460945
Energy: 0.9291356663666093
Energy: 0.9074556573927033
Energy: 0.9291356663666093
Energy: 0.9074556573927033
Energy: 0.9291356663666093
Energy: 0.9074556573927033

minimum gb energy = 0.8196112702229095 eV
minimum distance =  2.29278593146067 Angstroms
sigma value = 19


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

Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160716214
Energy: 0.8149564103376583
Energy: 0.7515455442128423
Energy: 0.8149564103376583
Energy: 0.7515455442128423
Energy: 0.8149564103382574
Energy: 0.7515455442122432
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.7515805722537023
Energy: 0.9360030388023212
Energy: 0.7515805722537023
Energy: 0.9360030388023212
Energy: 0.7515805722537023
Energy: 0.9360030388023212
Energy: 0.8652715578038501
Energy: 0.9374172482539703
Energy: 0.865271557803251
Energy: 0.9374172482539703
Energy: 0.8652715578038501
Energy: 0.9374172482539703
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.8149564103382574
Energy: 0.7515455442122432
Energy: 0.8149564103376583
Energy: 0.7515455442122432
Energy: 0.8149564103376583
Energy: 0.7515455442128423
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.7515805722543014
Energy: 0.9360030388029202
Energy: 0.7515805722543014
Energy: 0.9360030388023212
Energy: 0.7515805722543014
Energy: 0.9360030388029202
Energy: 0.865271557803251
Energy: 0.9374172482539703
Energy: 0.8652715578038501
Energy: 0.9374172482539703
Energy: 0.8652715578038501
Energy: 0.9374172482539703
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.8149564103376583
Energy: 0.7515455442122432
Energy: 0.8149564103376583
Energy: 0.7515455442128423
Energy: 0.8149564103376583
Energy: 0.7515455442122432
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7696508200502238
Energy: 0.7753837269952155
Energy: 0.7695978731626898
Energy: 0.775357653061711
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.7695978731626898
Energy: 0.77535765306231
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.8149349554084955
Energy: 0.7515311872212432
Energy: 0.7515805722543014
Energy: 0.9360030388023212
Energy: 0.7515805722537023
Energy: 0.9360030388023212
Energy: 0.7515805722543014
Energy: 0.9360030388023212
Energy: 0.865271557803251
Energy: 0.9374172482539703
Energy: 0.865271557803251
Energy: 0.9374172482539703
Energy: 0.8652715578038501
Energy: 0.9374172482539703
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.7775002023107528
Energy: 0.7954395469508359
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.866063811927127
Energy: 0.9376287043601208
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160710223
Energy: 0.7516162908186002
Energy: 0.9348052160710223

minimum gb energy = 0.7515311872212432 eV
minimum distance =  2.30446526876799 Angstroms
sigma value = 27


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

Energy: 0.7638807505699591
Energy: 0.7433892371787584
Energy: 0.7638807505699591
Energy: 0.7433892371787584
Energy: 0.7638807505699591
Energy: 0.7433892371787584
Energy: 0.876452827665288
Energy: 0.7684899181237204
Energy: 0.876452827665288
Energy: 0.7684899181237204
Energy: 0.876452827665288
Energy: 0.7684899181237204
Energy: 0.7738555497103863
Energy: 0.8494293854452134
Energy: 0.7738555497103863
Energy: 0.8494293854452134
Energy: 0.7738555497103863
Energy: 0.8494293854452134
Energy: 0.8584448232498847
Energy: 0.7223738099857414
Energy: 0.8584448232498847
Energy: 0.7223738099857414
Energy: 0.8584448232498847
Energy: 0.7223738099857414
Energy: 0.8567284770584584
Energy: 0.7225149416023147
Energy: 0.8567284770584584
Energy: 0.7225149416023147
Energy: 0.8567284770584584
Energy: 0.7225149416023147
Energy: 0.8682429636041366
Energy: 0.9024570048871939
Energy: 0.8682429636041366
Energy: 0.9024570048871939
Energy: 0.8682429636041366
Energy: 0.9024570048871939
Energy: 0.8116205367314776
Energy: 0.7713785322838714
Energy: 0.8116205367314776
Energy: 0.7713785322838714
Energy: 0.8116205367314776
Energy: 0.7713785322838714
Energy: 0.7601852866994337
Energy: 0.7471186871012598
Energy: 0.7601852866994337
Energy: 0.7471186871012598
Energy: 0.7601852866994337
Energy: 0.7471186871012598
Energy: 0.8730495540981617
Energy: 0.7737444453196239
Energy: 0.8730495540981617
Energy: 0.7737444451876199
Energy: 0.8730495540981617
Energy: 0.7737444451304226
Energy: 0.836336955878685
Energy: 0.8680403660392183
Energy: 0.836336955878685
Energy: 0.8680403660392183
Energy: 0.836336955878685
Energy: 0.8680403660392183
Energy: 0.8640696010539075
Energy: 0.7230152640009504
Energy: 0.8640696010539075
Energy: 0.7230152640009504
Energy: 0.7440048582070959
Energy: 0.7230152640009504
Energy: 0.9010439199599549
Energy: 0.8236187050565336
Energy: 0.9010439199599549
Energy: 0.8236187050565336
Energy: 0.9010439199599549
Energy: 0.8236187050565336

minimum gb energy = 0.7223738099857414 eV
minimum distance =  2.2857163725922 Angstroms
sigma value = 9


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

Energy: 0.7581270342274288
Energy: 0.7310076265098223
Energy: 0.7581270342270164
Energy: 0.7310076265102347
Energy: 0.7581270342274288
Energy: 0.7310076265102347
Energy: 0.7240557499757293
Energy: 0.7588249172697
Energy: 0.7240557499951081
Energy: 0.7272379017928197
Energy: 0.724055750003767
Energy: 0.7272379017928197
Energy: 0.6707470651961642
Energy: 0.7400580547560566
Energy: 0.6707470651965766
Energy: 0.7400580547560566
Energy: 0.6707470651965766
Energy: 0.7400580547564688
Energy: 0.6872077744271347
Energy: 0.660274930692148
Energy: 0.6872077744271347
Energy: 0.660274930692148
Energy: 0.6872077744271347
Energy: 0.660274930692148
Energy: 0.7357862805197422
Energy: 0.7133950281835065
Energy: 0.7357862805197422
Energy: 0.7133950281835065
Energy: 0.7357862805197422
Energy: 0.7133950281839189
Energy: 0.7440368021526065
Energy: 0.778972916743916
Energy: 0.7440368021526065
Energy: 0.7330179485961963
Energy: 0.7440368021521941
Energy: 0.7330179485961963
Energy: 0.6992884849986645
Energy: 0.7672993930504506
Energy: 0.6992884849986645
Energy: 0.7672993930504506
Energy: 0.6992884849986645
Energy: 0.7672993930504506
Energy: 0.6470443032565759
Energy: 0.7404402211456855
Energy: 0.6470443032565759
Energy: 0.7404402211452732
Energy: 0.6470443032565759
Energy: 0.7404402211452732
Energy: 0.7421512328087964
Energy: 0.7128626003982721
Energy: 0.7421512328112327
Energy: 0.7128626003982721
Energy: 0.7421512328092086
Energy: 0.7128626003982721
Energy: 0.7366848270738088
Energy: 0.7945122751691682
Energy: 0.7366848270733963
Energy: 0.7945122751683438
Energy: 0.7366848270733963
Energy: 0.7945122751691682
Energy: 0.685609309816223
Energy: 0.6658437882006538
Energy: 0.685609309816223
Energy: 0.6658437882006538
Energy: 0.6856093098166354
Energy: 0.6658437882006538
Energy: 0.7021289452163442
Energy: 0.734100865484188
Energy: 0.7021289452159318
Energy: 0.734100865484188
Energy: 0.7021289452159318
Energy: 0.734100865484188
Energy: 0.7201261137324435
Energy: 0.7195821591342236
Energy: 0.7201261137324435
Energy: 0.7195821591342236
Energy: 0.7201261137324435
Energy: 0.7195821591342236
Energy: 0.7544172298130076
Energy: 0.6805129938893084
Energy: 0.7544172298130076
Energy: 0.6805129938893084
Energy: 0.7544172298130076
Energy: 0.6805129938897206
Energy: 0.6720428637237197
Energy: 0.7354838284972263
Energy: 0.6720428637237197
Energy: 0.7354838284972263
Energy: 0.6720428637237197
Energy: 0.7354838284972263
Energy: 0.6770547197529846
Energy: 0.7003050680886457
Energy: 0.6770547197529846
Energy: 0.7003050680886457
Energy: 0.6770547197529846
Energy: 0.7003050680886457
Energy: 0.8675633386631394
Energy: 0.6609099573581294
Energy: 0.8675633386631394
Energy: 0.6609099573581294
Energy: 0.8675633386631394
Energy: 0.6609099573581294
Energy: 0.6814036260641217
Energy: 0.7096403734364944
Energy: 0.6814036260641217
Energy: 0.7096403734364944
Energy: 0.6814036260641217
Energy: 0.7096403734364944
Energy: 0.6440410966036425
Energy: 0.8751917789518666
Energy: 0.6440410966040548
Energy: 0.8751917789518666
Energy: 0.6440410966040548
Energy: 0.8751917789514544
Energy: 0.7929719263236458
Energy: 0.658789251617745
Energy: 0.7929719263236458
Energy: 0.6587892516198066
Energy: 0.7929719263236458
Energy: 0.6587892516189819
Energy: 0.6440340410713544
Energy: 0.8744862625624483
Energy: 0.6440340410713544
Energy: 0.8744862625628606
Energy: 0.6440340410717666
Energy: 0.8744862625624483
Energy: 0.6819805998734421
Energy: 0.7096573352951039
Energy: 0.6819805998734421
Energy: 0.7096573352951039
Energy: 0.6819805998734421
Energy: 0.7096573352951039
Energy: 0.867397890062537
Energy: 0.6607006015926358
Energy: 0.867397890062537
Energy: 0.6607006015922234
Energy: 0.867397890062537
Energy: 0.6607006015922234
Energy: 0.6770649324341481
Energy: 0.7415765676274191
Energy: 0.6770649324345605
Energy: 0.7415765676274191
Energy: 0.6770649324345605
Energy: 0.7415765676274191
Energy: 0.672032163886781
Energy: 0.735481271978224
Energy: 0.672032163886781
Energy: 0.735481271978224
Energy: 0.672032163886781
Energy: 0.735481271978224
Energy: 0.7544301398642167
Energy: 0.7369160689529072
Energy: 0.7544301398642167
Energy: 0.7369160689533195
Energy: 0.7544301398642167
Energy: 0.7369160689533195
Energy: 0.7202359627747911
Energy: 0.7192903289324137
Energy: 0.7202359627747911
Energy: 0.7192903289320014
Energy: 0.7202359627747911
Energy: 0.7192903289324137
Energy: 0.7021204152942152
Energy: 0.71369591413466
Energy: 0.7021204152942152
Energy: 0.71369591413466
Energy: 0.7021204152942152
Energy: 0.71369591413466
Energy: 0.6865757905556303
Energy: 0.6657322462248595
Energy: 0.6865757905560426
Energy: 0.6657322462248595
Energy: 0.6865757905556303
Energy: 0.6657322462248595
Energy: 0.736672292636814
Energy: 0.6937906947140804
Energy: 0.736672292636814
Energy: 0.6937906947140804
Energy: 0.736672292636814
Energy: 0.6937906947140804
Energy: 0.7426060529562584
Energy: 0.7130804093429397
Energy: 0.7426060529562584
Energy: 0.7130804093433519
Energy: 0.7426060529562584
Energy: 0.7130804093429397
Energy: 0.64705558930528
Energy: 0.7403952270008165
Energy: 0.64705558930528
Energy: 0.7403952270004416
Energy: 0.64705558930528
Energy: 0.7403952270008165
Energy: 0.6993975361247328
Energy: 0.7674143310361389
Energy: 0.6993975361247328
Energy: 0.7674143310361389
Energy: 0.6993975361247328
Energy: 0.7674143310361389
Energy: 0.7439662790857491
Energy: 0.725890870566589
Energy: 0.7439662790857491
Energy: 0.725890870566589
Energy: 0.7439662790857491
Energy: 0.7258908705661766
Energy: 0.7358294369273726
Energy: 0.7134929320223956
Energy: 0.7358294369273726
Energy: 0.7134929320223956
Energy: 0.7358294369273726
Energy: 0.7134929320228081
Energy: 0.6871191303188503
Energy: 0.660351673712781
Energy: 0.6871191303188503
Energy: 0.6603516737131933
Energy: 0.6871191303188503
Energy: 0.660351673712781
Energy: 0.6707364243551996
Energy: 0.7400332200219999
Energy: 0.6707364243551996
Energy: 0.7400332200219999
Energy: 0.670736424355612
Energy: 0.7400332200219999
Energy: 0.7241257283040784
Energy: 0.6598336785674076
Energy: 0.7241257283036661
Energy: 0.6598336785674076
Energy: 0.7241257283040784
Energy: 0.6598336785669952
Energy: 0.7581270342274288
Energy: 0.7310076265102347
Energy: 0.7581270342274288
Energy: 0.7310076265102347
Energy: 0.7581270342274288
Energy: 0.7310076265102347
Energy: 0.7240557499184544
Energy: 0.705126744067907
Energy: 0.7240557499064972
Energy: 0.705126744067907
Energy: 0.7240557499221653
Energy: 0.705126744067907
Energy: 0.6707470651965766
Energy: 0.7400580547560566
Energy: 0.6707470651965766
Energy: 0.7400580547564688
Energy: 0.6707470651965766
Energy: 0.7400580547564688
Energy: 0.6872077744271347
Energy: 0.660274930692148
Energy: 0.6872077744271347
Energy: 0.660274930692148
Energy: 0.6872077744271347
Energy: 0.660274930692148
Energy: 0.7357862805197422
Energy: 0.7133950281835065
Energy: 0.7357862805197422
Energy: 0.7133950281835065
Energy: 0.7357862805197422
Energy: 0.7133950281835065

minimum gb energy = 0.6440340410713544 eV
minimum distance =  2.34053670164214 Angstroms
sigma value = 57


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

Energy: 0.5597505553399387
Energy: 0.526241828171962
Energy: 0.32996466340534636
Energy: 0.526241828171962
Energy: 0.5597505553399387
Energy: 0.526241828171962
Energy: 0.6089172882315005
Energy: 0.5185762445581564
Energy: 0.6089172882315005
Energy: 0.5184708216023448
Energy: 0.6089172882305619
Energy: 0.5185762445581564
Energy: 0.5602559600700509
Energy: 0.5987107517531107
Energy: 0.5602559600700509
Energy: 0.5839058706491723
Energy: 0.5602559600700509
Energy: 0.5987107517531107
Energy: 0.5281617395137334
Energy: 0.4446080661383754
Energy: 0.5281617395137334
Energy: 0.3296722925086759
Energy: 0.5281617395137334
Energy: 0.4446080661383754
Energy: 0.412243360830207
Energy: 0.6101973560725508
Energy: 0.412243360830207
Energy: 0.6101973560725508
Energy: 0.412243360830207
Energy: 0.6101973560725508
Energy: 0.32978193474836276
Energy: 0.5596726710834279
Energy: 0.3297819347474242
Energy: 0.5596726710834279
Energy: 0.3297819347474242
Energy: 0.5596726710834279
Energy: 0.32976483031145143
Energy: 0.3677148668093447
Energy: 0.32976483031145143
Energy: 0.3677148668093447
Energy: 0.32976483031145143
Energy: 0.3677148668093447
Energy: 0.6092174804667887
Energy: 0.41809797107516106
Energy: 0.6092174804667887
Energy: 0.41809797107516106
Energy: 0.6092174804667887
Energy: 0.41809797107516106
Energy: 0.5285182719759286
Energy: 0.32963361877397673
Energy: 0.5285182719759286
Energy: 0.44459794258590263
Energy: 0.5285182719759286
Energy: 0.32963361877397673
Energy: 0.36848766789120346
Energy: 0.6349977123637212
Energy: 0.36848766789120346
Energy: 0.6349977123646597
Energy: 0.36848766789120346
Energy: 0.6349977123646597
Energy: 0.412213416189823
Energy: 0.5195920420577697
Energy: 0.412213416189823
Energy: 0.5195920420577697
Energy: 0.412213416189823
Energy: 0.5195920420587082
Energy: 0.5597505553399387
Energy: 0.526241828171962
Energy: 0.32996466340534636
Energy: 0.526241828171962
Energy: 0.5597505553399387
Energy: 0.526241828171962
Energy: 0.6089172882315005
Energy: 0.5185762445581564
Energy: 0.6089172882315005
Energy: 0.5184708216014061
Energy: 0.6089172882315005
Energy: 0.5185762445581564
Energy: 0.5602559600700509
Energy: 0.5987107517531107
Energy: 0.5602559600700509
Energy: 0.5839058699567945
Energy: 0.5602559600700509
Energy: 0.5987107517531107
Energy: 0.5281617395137334
Energy: 0.4446080661383754
Energy: 0.5281617395137334
Energy: 0.3296722925086759
Energy: 0.5281617395137334
Energy: 0.4446080661383754
Energy: 0.412243360830207
Energy: 0.6101973560716123
Energy: 0.412243360830207
Energy: 0.6101973560725508
Energy: 0.412243360830207
Energy: 0.6101973560716123
Energy: 0.3297819347474242
Energy: 0.5596726710834279
Energy: 0.32978193474836276
Energy: 0.5596726710834279
Energy: 0.32978193474836276
Energy: 0.5596726710834279
Energy: 0.32976483031145143
Energy: 0.3677148668093447
Energy: 0.32976483031239
Energy: 0.3677148668093447
Energy: 0.32976483031239
Energy: 0.3677148668093447
Energy: 0.6092174804667887
Energy: 0.41809797107516106
Energy: 0.6092174804667887
Energy: 0.41809797107516106
Energy: 0.6092174804667887
Energy: 0.41809797107516106

minimum gb energy = 0.32963361877397673 eV
minimum distance =  2.43423302861617 Angstroms
sigma value = 11


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

Energy: 0.584604579549948
Energy: 0.722877873593844
Energy: 0.5846045795492605
Energy: 0.722877873593844
Energy: 0.5846045795492605
Energy: 0.722877873593844
Energy: 0.7267806905103495
Energy: 0.6210347567372438
Energy: 0.726780690509662
Energy: 0.6210347567372438
Energy: 0.726780690509662
Energy: 0.6210347567372438
Energy: 0.7624496642733942
Energy: 0.8170242847149588
Energy: 0.7312810772250593
Energy: 0.8170242847149588
Energy: 0.7312810772250593
Energy: 0.8170242847149588
Energy: 0.7803786311504014
Energy: 0.5479129344123548
Energy: 0.7803786311504014
Energy: 0.5479129344123548
Energy: 0.7803786311504014
Energy: 0.5479129344123548
Energy: 0.6939264413132951
Energy: 0.5312936125069965
Energy: 0.6939264413132951
Energy: 0.5312936125069965
Energy: 0.6939264413132951
Energy: 0.5312936125069965
Energy: 0.6513759092972732
Energy: 0.5415760542440518
Energy: 0.6513759092972732
Energy: 0.5415760542440518
Energy: 0.6513759092972732
Energy: 0.5415760542440518
Energy: 0.5190121514251751
Energy: 0.5730704171015821
Energy: 0.5190121514251751
Energy: 0.5730704171015821
Energy: 0.5190121514251751
Energy: 0.5730704171015821
Energy: 0.7192553465010968
Energy: 0.5058788547003392
Energy: 0.7192553465010968
Energy: 0.5058788547003392
Energy: 0.7192553465010968
Energy: 0.5058788547003392
Energy: 0.7181815089801048
Energy: 0.5100134699457882
Energy: 0.7181815089801048
Energy: 0.5100134699457882
Energy: 0.7181815089801048
Energy: 0.5100134699457882
Energy: 0.5151882219006704
Energy: 0.7717570656227187
Energy: 0.5151882219006704
Energy: 0.7717570656227187
Energy: 0.5151882219006704
Energy: 0.7717570656220312
Energy: 0.6711987112626819
Energy: 0.6611996362112972
Energy: 0.6711987112626819
Energy: 0.6611996362112972
Energy: 0.6711987112626819
Energy: 0.6611996362112972
Energy: 0.5510092576645262
Energy: 0.5336212360889356
Energy: 0.5510092576631512
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Energy: 0.5510092576638388
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Energy: 0.7323551357085483
Energy: 0.5530857007624738
Energy: 0.7323551357085483
Energy: 0.5530857007617862
Energy: 0.7323551357078608
Energy: 0.5530857007617862
Energy: 0.7174868433191895
Energy: 0.7954135547183043
Energy: 0.7174868433191895
Energy: 0.7954135547183043
Energy: 0.7174868433191895
Energy: 0.7954135547183043
Energy: 0.7399426208599684
Energy: 0.6195395877480737
Energy: 0.7399426208592809
Energy: 0.6195395877480737
Energy: 0.7399426208599684
Energy: 0.6195395877480737
Energy: 0.5617633566717324
Energy: 0.7186818650789044
Energy: 0.5617633566717324
Energy: 0.7186818650789044
Energy: 0.5617633566717324
Energy: 0.7186818650789044
Energy: 0.6307335238492432
Energy: 0.6158415474109445
Energy: 0.6307335238492432
Energy: 0.6158415474109445
Energy: 0.6307335238492432
Energy: 0.615841547410257
Energy: 0.8962921694277133
Energy: 0.6876683319150446
Energy: 0.8962921694277133
Energy: 0.6876683319157322
Energy: 0.8962921694277133
Energy: 0.6876683319150446
Energy: 0.6631266848305967
Energy: 0.5439948893740019
Energy: 0.6631266848305967
Energy: 0.5439948893740019
Energy: 0.6631266848305967
Energy: 0.5439948893740019
Energy: 0.5502103825995204
Energy: 0.6330575391948143
Energy: 0.5502103826008954
Energy: 0.6330575391948143
Energy: 0.5502103825988327
Energy: 0.6330575391948143
Energy: 0.5172892385375647
Energy: 0.5446260691559872
Energy: 0.5172892385375647
Energy: 0.5446260691559872
Energy: 0.5172892385375647
Energy: 0.5446260691559872
Energy: 0.5491742120637481
Energy: 0.5728896535118649
Energy: 0.5491742120644355
Energy: 0.5728896535125525
Energy: 0.5491742120637481
Energy: 0.5728896535125525
Energy: 0.723397562839225
Energy: 0.6337673063372751
Energy: 0.723397562839225
Energy: 0.6337673063372751
Energy: 0.723397562839225
Energy: 0.6337673063372751
Energy: 0.6442389841709947
Energy: 0.5413995695549401
Energy: 0.6442389841709947
Energy: 0.5413995695549401
Energy: 0.6442389841716822
Energy: 0.5413995695549401
Energy: 0.5171745472353768
Energy: 0.7711439869158737
Energy: 0.5171745472353768
Energy: 0.7711439869158737
Energy: 0.5171745472346894
Energy: 0.7711439869151862
Energy: 1.0098703011070258
Energy: 0.6602961905468147
Energy: 1.0098703011063384
Energy: 0.6602961905461272
Energy: 1.0098703011063384
Energy: 0.6602961905461272

minimum gb energy = 0.5058788547003392 eV
minimum distance =  2.34549677369926 Angstroms
sigma value = 41


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

Energy: 0.6605396806065648
Energy: 0.5928941330055255
Energy: 0.6605396806071067
Energy: 0.5928941330060674
Energy: 0.6605396806071067
Energy: 0.5928941330060674
Energy: 0.7796007274715642
Energy: 0.7313618552777494
Energy: 0.7796007274715642
Energy: 0.7313618552777494
Energy: 0.7796007274715642
Energy: 0.7313618552772075
Energy: 0.6884163308903477
Energy: 0.6780742747164434
Energy: 0.6884163308903477
Energy: 0.6780742747164434
Energy: 0.6884163308903477
Energy: 0.6780742747159016
Energy: 0.6143035528952093
Energy: 0.5743952309707767
Energy: 0.6143035528952093
Energy: 0.5743952309707767
Energy: 0.6143035528952093
Energy: 0.5743952309713185
Energy: 0.5698875607197925
Energy: 0.619112004253743
Energy: 0.5698875607197925
Energy: 0.619112004253743
Energy: 0.5698875607197925
Energy: 0.619112004253743
Energy: 0.7522175176502888
Energy: 0.7402100036187811
Energy: 0.7522175176502888
Energy: 0.7402100036187811
Energy: 0.7522175176502888
Energy: 0.7402100036187811
Energy: 0.5715001408881555
Energy: 0.8462030339015797
Energy: 0.5715001408881555
Energy: 0.8462030339010377
Energy: 0.5715001408881555
Energy: 0.8462030339015797
Energy: 0.5533282528343224
Energy: 0.5742923629443564
Energy: 0.5533282528343224
Energy: 0.5742923629448982
Energy: 0.5533282528343224
Energy: 0.5742923629448982
Energy: 0.5801400003918358
Energy: 0.6128710773253078
Energy: 0.5801400003918358
Energy: 0.6128710773253078
Energy: 0.5801400003918358
Energy: 0.612871077324766
Energy: 0.6071684532157866
Energy: 0.6250787656735373
Energy: 0.6071684532163285
Energy: 0.6250787656735373
Energy: 0.6071684532163285
Energy: 0.6250787656735373
Energy: 0.6110517482226522
Energy: 0.6330498199059484
Energy: 0.6110517482226522
Energy: 0.6330498199059484
Energy: 0.6110517482226522
Energy: 0.6330498199059484
Energy: 0.5482962604551944
Energy: 0.8050259883587879
Energy: 0.5482962604551944
Energy: 0.7173697905762061
Energy: 0.5482962604551944
Energy: 0.7173697905762061
Energy: 0.5529895892347927
Energy: 0.5725792129266166
Energy: 0.5529895892347927
Energy: 0.5725792129271585
Energy: 0.5529895892347927
Energy: 0.5725792129266166
Energy: 0.5400958317817613
Energy: 0.6257535534742185
Energy: 0.5400958317817613
Energy: 0.6257535534742185
Energy: 0.5400958317817613
Energy: 0.6257535534742185
Energy: 0.7499706843469673
Energy: 0.7379778090105055
Energy: 0.7499706843469673
Energy: 0.7379778090105055
Energy: 0.7499706843469673
Energy: 0.7379778090105055
Energy: 0.533351264525871
Energy: 0.7389489438664087
Energy: 0.533351264525871
Energy: 0.7389489438664087
Energy: 0.533351264525871
Energy: 0.7389489438669506
Energy: 0.5607967699002508
Energy: 0.5725249001914452
Energy: 0.5607967699002508
Energy: 0.5725249001914452
Energy: 0.5607967699002508
Energy: 0.5725249001914452
Energy: 0.575321289705886
Energy: 0.6784698419781133
Energy: 0.5753212897053442
Energy: 0.6784698419781133
Energy: 0.575321289705886
Energy: 0.6784698419781133
Energy: 0.6236276861556211
Energy: 0.7280735695834623
Energy: 0.6236276861556211
Energy: 0.7280735695834623
Energy: 0.6236276861556211
Energy: 0.7280735695834623
Energy: 0.6081764594155116
Energy: 0.7426321233973715
Energy: 0.6081764594155116
Energy: 0.7426321233968296
Energy: 0.6081764594155116
Energy: 0.7910162984114558
Energy: 0.5619803759736273
Energy: 0.6306464302489396
Energy: 0.5619803759736273
Energy: 0.6306464302483977
Energy: 0.5619803759730854
Energy: 0.6306464302494815
Energy: 0.5892597273127238
Energy: 0.8070688576940025
Energy: 0.5892597273084133
Energy: 0.8070688576940025
Energy: 0.5892597273062457
Energy: 0.8070688576940025
Energy: 0.6144625385239337
Energy: 0.5765416815708643
Energy: 0.6144625385239337
Energy: 0.5765416815708643
Energy: 0.6144625385239337
Energy: 0.5765416815708643
Energy: 0.5329853704439357
Energy: 0.7563984097144625
Energy: 0.5329853704439357
Energy: 0.7563984097144625
Energy: 0.5329853704439357
Energy: 0.7871816122958154
Energy: 0.534101553971526
Energy: 0.7561211756121073
Energy: 0.534101553971526
Energy: 0.7561211756115653
Energy: 0.534101553971526
Energy: 0.7561211756115653
Energy: 0.5704456963323745
Energy: 0.5721774546092805
Energy: 0.5704456963323745
Energy: 0.5721774546098225
Energy: 0.5704456963323745
Energy: 0.5721774546092805
Energy: 0.563503350455818
Energy: 0.5766786234492154
Energy: 0.563503350455818
Energy: 0.5766786234492154
Energy: 0.563503350455818
Energy: 0.5766786234492154
Energy: 0.5793775652901614
Energy: 0.6297240605285953
Energy: 0.5793775652901614
Energy: 0.6297240605291372
Energy: 0.5793775652901614
Energy: 0.6657011640245345
Energy: 0.6074789530238169
Energy: 0.7344128695232913
Energy: 0.607478953023275
Energy: 0.7344128695238333
Energy: 0.607478953023275
Energy: 0.7344128695232913
Energy: 0.6676737622263553
Energy: 0.5349826847116353
Energy: 0.6676737622268971
Energy: 0.5349826847110936
Energy: 0.6676737622263553
Energy: 0.5349826847116353
Energy: 0.5582901552545648
Energy: 0.714182079966498
Energy: 0.5582901552545648
Energy: 0.714182079966498
Energy: 0.5582901552545648
Energy: 0.714182079966498
Energy: 0.5846313909106872
Energy: 0.6053663332238363
Energy: 0.5846313909106872
Energy: 0.6053663332238363
Energy: 0.5846313909106872
Energy: 0.6053663332238363
Energy: 0.5338396285756062
Energy: 0.5848778715215673
Energy: 0.5338396285756062
Energy: 0.5848778715221092
Energy: 0.5338396285756062
Energy: 0.5848778715226512

minimum gb energy = 0.5329853704439357 eV
minimum distance =  2.37215486585754 Angstroms
sigma value = 33


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

Energy: 0.6771145274103254
Energy: 0.6098599134082895
Energy: 0.6771145274103254
Energy: 0.6098599134082895
Energy: 0.6771145274103254
Energy: 0.6098599134086699
Energy: 0.672508476527252
Energy: 0.5806620430241538
Energy: 0.6725084765268716
Energy: 0.5806620430241538
Energy: 0.672508476527252
Energy: 0.5806620430241538
Energy: 0.6163520380085833
Energy: 0.6934291902733116
Energy: 0.6163520380085833
Energy: 0.6934291902733116
Energy: 0.6163520380085833
Energy: 0.6934291902733116
Energy: 0.6156904100804959
Energy: 0.5969401235038406
Energy: 0.6156904100804959
Energy: 0.5969401235038406
Energy: 0.6156904100804959
Energy: 0.5969401235034603
Energy: 0.6186475188647355
Energy: 0.6552320531253899
Energy: 0.6186475188647355
Energy: 0.6552320531101777
Energy: 0.6186475188647355
Energy: 0.6552320530964866
Energy: 0.8560447669705036
Energy: 0.6137808249170267
Energy: 0.8560447669708839
Energy: 0.6137808249170267
Energy: 0.8560447669705036
Energy: 0.6137808249170267
Energy: 0.6023238955417253
Energy: 0.6607943804032247
Energy: 0.6023238955421055
Energy: 0.6607943804032247
Energy: 0.6023238955417253
Energy: 0.6607943804032247
Energy: 0.6367670390774162
Energy: 0.6344784840648239
Energy: 0.6367670390774162
Energy: 0.6344784840648239
Energy: 0.6367670390777965
Energy: 0.6344784840648239
Energy: 0.7060457530905306
Energy: 0.6342714412314147
Energy: 0.7060457530905306
Energy: 0.6342714412317949
Energy: 0.7060457530905306
Energy: 0.6342714412317949
Energy: 0.898722450562587
Energy: 0.5987528376557295
Energy: 0.898722450562587
Energy: 0.5987528376557295
Energy: 0.898722450562587
Energy: 0.5987528376553493
Energy: 0.6372914826553088
Energy: 0.6344339059300995
Energy: 0.6372914826553088
Energy: 0.6344339059300995
Energy: 0.6372914826553088
Energy: 0.6344339059300995
Energy: 0.6196764591878261
Energy: 0.5972054854651004
Energy: 0.619676459187446
Energy: 0.5972054854651004
Energy: 0.6196764591885868
Energy: 0.5972054854651004
Energy: 0.6338370258476643
Energy: 0.7073639829386345
Energy: 0.6338370258476643
Energy: 0.7073639829401557
Energy: 0.6338370258472841
Energy: 0.7073639829390147
Energy: 0.6550346910588926
Energy: 0.6455316350838446
Energy: 0.6550346910592729
Energy: 0.6455316350838446
Energy: 0.6550346910592729
Energy: 0.6455316350838446
Energy: 0.6431556641305267
Energy: 0.5993826305401808
Energy: 0.6431556641305267
Energy: 0.5993826305401808
Energy: 0.643155664130907
Energy: 0.5993826305401808
Energy: 0.6195962161017535
Energy: 0.8602527858871754
Energy: 0.6195962161017535
Energy: 0.8602527858871754
Energy: 0.6195962161017535
Energy: 0.8602527858875557
Energy: 0.6533711217343383
Energy: 0.5840325228446998
Energy: 0.6533711217286684
Energy: 0.5840325228446998
Energy: 0.6533711217294289
Energy: 0.5840325228446998
Energy: 0.5916930867557599
Energy: 0.6156029107544664
Energy: 0.5916930867553797
Energy: 0.6156029107544664
Energy: 0.5916930867553797
Energy: 0.6156029107544664
Energy: 0.6977001618060317
Energy: 0.6149973475452992
Energy: 0.6977001618060317
Energy: 0.6149973475452992
Energy: 0.6977001618060317
Energy: 0.6149973475449191
Energy: 0.646238512512125
Energy: 0.6193378967673662
Energy: 0.6462385124794188
Energy: 0.6193378967673662
Energy: 0.6462385124083361
Energy: 0.6193378967673662
Energy: 0.5853729185842752
Energy: 0.6446190994236581
Energy: 0.5853729185842752
Energy: 0.6446190994236581
Energy: 0.5853729185842752
Energy: 0.6446190994236581
Energy: 0.576134053332484
Energy: 0.6731287337390726
Energy: 0.576134053332484
Energy: 0.6731287337390726
Energy: 0.5761340533328643
Energy: 0.6731287337386922
Energy: 0.6438937274476996
Energy: 0.5671204104622034
Energy: 0.6438937274476996
Energy: 0.5671204104625839
Energy: 0.6438937274476996
Energy: 0.5671204104622034
Energy: 0.583793957470973
Energy: 0.6500210737188463
Energy: 0.5837939574705926
Energy: 0.6500210737188463
Energy: 0.5837939574705926
Energy: 0.6500210737184661
Energy: 0.629002319499439
Energy: 0.5839278116271605
Energy: 0.629002319499439
Energy: 0.5839278116271605
Energy: 0.629002319499439
Energy: 0.5839278116271605
Energy: 0.6090927357475256
Energy: 0.8526004027274163
Energy: 0.6090927357475256
Energy: 0.8526004027277966
Energy: 0.6090927357475256
Energy: 0.8526004027277966
Energy: 0.6704014498369109
Energy: 0.6062179508118213
Energy: 0.6704014498376715
Energy: 0.6062179508122016
Energy: 0.6704014498369109
Energy: 0.6062179508118213
Energy: 0.6439123331305263
Energy: 0.584218963459982
Energy: 0.6439123331297657
Energy: 0.584218963459982
Energy: 0.6439123331305263
Energy: 0.5842189634603623
Energy: 0.6356884999486041
Energy: 0.7073778131159331
Energy: 0.6356884999489842
Energy: 0.7073778131159331
Energy: 0.6356884999486041
Energy: 0.7073778131159331
Energy: 0.5949562116508077
Energy: 0.8948946587329827
Energy: 0.5949562116508077
Energy: 0.8948946587329827
Energy: 0.5949562116508077
Energy: 0.8948946587329827
Energy: 0.6128812036128175
Energy: 0.587524763798272
Energy: 0.6128812036131979
Energy: 0.587524763798272
Energy: 0.6128812036128175
Energy: 0.587524763798272
Energy: 0.5834332935592013
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Energy: 0.5834332935592013
Energy: 0.6223100188209021
Energy: 0.5834332935592013
Energy: 0.6223100188049293
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Energy: 0.6040504566534135
Energy: 0.6471740314988103
Energy: 0.6040504566534135
Energy: 0.6471740314988103
Energy: 0.6040504566537939
Energy: 0.6404225672003645
Energy: 0.6484817255921943
Energy: 0.6404225672003645
Energy: 0.6484817255925746
Energy: 0.6404225672003645
Energy: 0.6484817255921943
Energy: 0.6403714900861975
Energy: 0.6484859463436335
Energy: 0.6403714900861975
Energy: 0.6484859463440138
Energy: 0.6403714900854369
Energy: 0.6484859463440138
Energy: 0.6469507353379579
Energy: 0.6040458219042946
Energy: 0.6469507353246473
Energy: 0.6040458219042946
Energy: 0.6469507352166749
Energy: 0.6040458219042946
Energy: 0.5834139760257941
Energy: 0.6220555502160058
Energy: 0.5834139760257941
Energy: 0.6220555502194286
Energy: 0.5834139760257941
Energy: 0.6220555502190481
Energy: 0.6128318308424209
Energy: 0.5875781107582942
Energy: 0.6128318308420405
Energy: 0.5875781107579139
Energy: 0.6128318308424209
Energy: 0.5875781107579139
Energy: 0.5949556105622268
Energy: 0.8948078726731701
Energy: 0.5949556105622268
Energy: 0.8948078726731701
Energy: 0.5949556105622268
Energy: 0.8948078726731701
Energy: 0.6356722451918335
Energy: 0.707217010218556
Energy: 0.6356722451918335
Energy: 0.707217010218556
Energy: 0.6356722451918335
Energy: 0.707217010218556
Energy: 0.6439246550249876
Energy: 0.5843824884259521
Energy: 0.6439246550246072
Energy: 0.5843824884259521
Energy: 0.6439246550249876
Energy: 0.5843824884255717
Energy: 0.6702225455635729
Energy: 0.6063228329146005
Energy: 0.6702225455635729
Energy: 0.6063228329149808
Energy: 0.6702225455635729
Energy: 0.6063228329146005
Energy: 0.6092111887015853
Energy: 0.8524701402754198
Energy: 0.6092111887015853
Energy: 0.8524701402754198
Energy: 0.6092111887015853
Energy: 0.8524701402754198
Energy: 0.6290927651269784
Energy: 0.5839244010343221
Energy: 0.6290927651273587
Energy: 0.5839244010343221
Energy: 0.6290927651269784
Energy: 0.5839244010343221
Energy: 0.5837783474725414
Energy: 0.6476250690500649
Energy: 0.5837783474725414
Energy: 0.6476250690508255
Energy: 0.5837783474725414
Energy: 0.6476250690504451
Energy: 0.6439293953069698
Energy: 0.5672117409159662
Energy: 0.6439293953073502
Energy: 0.5672117409159662
Energy: 0.6439293953073502
Energy: 0.5672117409159662
Energy: 0.5756901544204581
Energy: 0.6729103237328316
Energy: 0.5756901544204581
Energy: 0.672910323732071
Energy: 0.5756901544204581
Energy: 0.6729103237328316

minimum gb energy = 0.5671204104622034 eV
minimum distance =  2.36553447546813 Angstroms
sigma value = 67


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

Energy: 0.7169104471843886
Energy: 0.6474995175676181
Energy: 0.7169104471843886
Energy: 0.6474995175676181
Energy: 0.7169104471843886
Energy: 0.6474995175676181
Energy: 0.6766910184701597
Energy: 0.5893332008491653
Energy: 0.6766910184701597
Energy: 0.5893332008491653
Energy: 0.6766910184701597
Energy: 0.5893332008491653
Energy: 0.6381230695438908
Energy: 0.7667128128700925
Energy: 0.9067697731413862
Energy: 0.7667128128700925
Energy: 0.6620537406508042
Energy: 0.7667128128700925
Energy: 0.6764653379845651
Energy: 0.589331866591378
Energy: 0.6764653379848251
Energy: 0.589331866591378
Energy: 0.6764653379845651
Energy: 0.5893318665911181
Energy: 0.7169104471843886
Energy: 0.6474995175676181
Energy: 0.7169104471843886
Energy: 0.6474995175676181
Energy: 0.7169104471843886
Energy: 0.6474995175676181
Energy: 0.6766910184701597
Energy: 0.5893332008491653
Energy: 0.6766910184701597
Energy: 0.5893332008491653
Energy: 0.6766910184701597
Energy: 0.5893332008491653
Energy: 0.6387186249537901
Energy: 0.7667128128700925
Energy: 0.6387186249537901
Energy: 0.7667128128700925
Energy: 0.8874078257672269
Energy: 0.7667128128700925

minimum gb energy = 0.5893318665911181 eV
minimum distance =  2.37416541776251 Angstroms
sigma value = 3


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

Energy: 0.8332655147579784
Energy: 0.7631548602085464
Energy: 0.8332655147582929
Energy: 0.7631548602085464
Energy: 0.8332655147579784
Energy: 0.7631548602085464
Energy: 0.7487243583898099
Energy: 0.6877438664930852
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Energy: 0.8163383644298876
Energy: 0.852397807863166
Energy: 0.8163383644302021
Energy: 0.852397807862097
Energy: 0.8163383644298876
Energy: 0.8523978078624742
Energy: 0.7764464204975289
Energy: 0.7414076275234798
Energy: 0.7764464204978434
Energy: 0.7677368353710327
Energy: 0.7764464204975289
Energy: 0.7363142993654755
Energy: 0.7696112181225355
Energy: 0.7704921228868732
Energy: 0.7696112181225355
Energy: 0.7704921228871877
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Energy: 0.7253435729549004
Energy: 0.7237545735157713
Energy: 0.7253435729549004
Energy: 0.7237545735150797
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Energy: 0.7540386777511734
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Energy: 0.7540386777508589
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Energy: 0.7109515216145396
Energy: 0.7889123118212563
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Energy: 0.7109515216141622
Energy: 0.773061391669745
Energy: 0.754664187696924
Energy: 0.7570591018591913
Energy: 0.754664187696924
Energy: 0.7570591018588141
Energy: 0.7546641876966095
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Energy: 0.7581836995447288
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Energy: 0.7462821705487547
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Energy: 0.7462821705484404
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Energy: 0.7462821705487547
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Energy: 0.7128666343984195
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Energy: 0.7846497812590985
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Energy: 0.7846497812590985
Energy: 0.7997045884058595
Energy: 0.7221174636970055
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Energy: 0.7221174636970055
Energy: 0.7997045884058595
Energy: 0.72211746369732
Energy: 0.7615868097106867
Energy: 0.8228892166974355
Energy: 0.7615868097113785
Energy: 0.8228892166974355
Energy: 0.7615868097106867
Energy: 0.8228892166971211
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Energy: 0.7808140080065473
Energy: 0.7702565125104864
Energy: 0.7808140080068618
Energy: 0.770256512517404
Energy: 0.7808140080068618
Energy: 0.7562391459999694
Energy: 0.7209719342227352
Energy: 0.7562391459992778
Energy: 0.7209719342227352
Energy: 0.756239145999655
Energy: 0.7209719342227352
Energy: 0.7820818001000196
Energy: 0.689573334719309
Energy: 0.7820818000917185
Energy: 0.6895733347196863
Energy: 0.7820818000412197
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Energy: 0.7732787911121602
Energy: 0.8236276419515471
Energy: 0.7732787911117829
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Energy: 0.7732787911117829
Energy: 0.8236276419519244
Energy: 0.7699770863542875
Energy: 0.7963024558250653
Energy: 0.7699770863539732
Energy: 0.7963024558257572
Energy: 0.7699770863542875
Energy: 0.7963024558257572
Energy: 0.712944675306433
Energy: 0.7445444126801413
Energy: 0.712944675306433
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Energy: 0.7129446753068104
Energy: 0.7445444126797639
Energy: 0.802880870515994
Energy: 0.7253197412863764
Energy: 0.802880870515994
Energy: 0.7253197412860619
Energy: 0.8028808705156169
Energy: 0.7253197412863764
Energy: 0.7261389125784639
Energy: 0.7974882673762471
Energy: 0.7261389125781493
Energy: 0.7974882673765615
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Energy: 0.7743641835660153
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Energy: 0.7743641835660153
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Energy: 0.7210588101787491
Energy: 0.7301725923790106
Energy: 0.7210588101783717
Energy: 0.7301725923793251
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Energy: 0.7301725923793251
Energy: 0.7773981105212326
Energy: 0.7250692464228793
Energy: 0.7773981104604204
Energy: 0.7250692464239484
Energy: 0.7773981103864017
Energy: 0.7250692464228793
Energy: 0.7293826841315268
Energy: 0.7488004135453069
Energy: 0.7293826841315268
Energy: 0.7488004135449294
Energy: 0.7293826841319041
Energy: 0.7488004135446149
Energy: 0.7435147800222854
Energy: 0.7790952938835952
Energy: 0.7435147800119091
Energy: 0.7790952938835952
Energy: 0.7435147800185121
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Energy: 0.7819282957215141
Energy: 0.7010890051009004
Energy: 0.7819282957211998
Energy: 0.7010890051009004
Energy: 0.7819282957215141
Energy: 0.7010890051009004
Energy: 0.7630566193600503
Energy: 0.6893575148604444
Energy: 0.7630566193603648
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Energy: 0.7630566193600503
Energy: 0.6893575148604444
Energy: 0.7534798393195209
Energy: 0.7251704496236697
Energy: 0.7534798393191436
Energy: 0.7251704496243615
Energy: 0.7534798393184517
Energy: 0.7251704496243615
Energy: 0.7437737147884513
Energy: 0.7229361447650313
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Energy: 0.7229361447646541
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Energy: 0.7617622909052865
Energy: 0.6873066926488219
Energy: 0.7617622909052865
Energy: 0.6873066926488219
Energy: 0.7617622909056009
Energy: 0.6873066926488219
Energy: 0.7721422748304307
Energy: 0.7802312577752115
Energy: 0.7721422748300534
Energy: 0.780231257775526
Energy: 0.7721422748300534
Energy: 0.7802312577759033
Energy: 0.8502117076180622
Energy: 0.7698041042953253
Energy: 0.8502117076184397
Energy: 0.769804104294948
Energy: 0.8502117076177478
Energy: 0.769804104294948
Energy: 0.7003933369464619
Energy: 0.7471435108967666
Energy: 0.7003933369464619
Energy: 0.7471435108964521
Energy: 0.7003933369467763
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Energy: 0.7635186623193475
Energy: 0.7238413648600084
Energy: 0.7635186623193475
Energy: 0.7238413648603228
Energy: 0.763518662319662
Energy: 0.723841364859631
Energy: 0.7205272793146066
Energy: 0.8304871430872971
Energy: 0.7205272793146066
Energy: 0.8304871430869197
Energy: 0.7205272793146066
Energy: 0.8304871430872971
Energy: 0.7785057875743465
Energy: 0.7605526450852405
Energy: 0.7785057875743465
Energy: 0.7605526450852405
Energy: 0.7785057875743465
Energy: 0.7605526450852405
Energy: 0.6945363077447294
Energy: 0.7982162453112043
Energy: 0.6945363077443523
Energy: 0.7982162453115814
Energy: 0.6945363077450439
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Energy: 0.8040803998359126
Energy: 0.7238977544748734
Energy: 0.804080399831762
Energy: 0.7238977545010974
Energy: 0.8040803998238383
Energy: 0.7238977544523596
Energy: 0.7149269172626193
Energy: 0.8435468197494995
Energy: 0.7149269172626193
Energy: 0.8435468197491851
Energy: 0.7149269172629965
Energy: 0.8435468197494995
Energy: 0.8572156452218839
Energy: 0.7163777963341108
Energy: 0.8572156452218839
Energy: 0.7163777963341108
Energy: 0.8572156452218839
Energy: 0.7163777963337333
Energy: 0.7063832790461704
Energy: 0.781585172291914
Energy: 0.706383279045856
Energy: 0.781585172291914
Energy: 0.706383279045856
Energy: 0.781585172291914
Energy: 0.7834915737630307
Energy: 0.6874246995562708
Energy: 0.7834915737630307
Energy: 0.6874246995562708
Energy: 0.7834915737630307
Energy: 0.6874246995555792
Energy: 0.7550004586940801
Energy: 0.77379684879634
Energy: 0.7550004586933883
Energy: 0.77379684879634
Energy: 0.7550004586940801
Energy: 0.77379684879634
Energy: 0.7977252958123401
Energy: 0.7056670445018554
Energy: 0.7977252958123401
Energy: 0.7056670445018554
Energy: 0.7977252958123401
Energy: 0.7056670445018554
Energy: 0.7436284504536066
Energy: 0.7249618956523753
Energy: 0.7436284504536066
Energy: 0.724961913035961
Energy: 0.7436284504536066
Energy: 0.7249618952164383
Energy: 0.8003146244372233
Energy: 0.7220330058633452
Energy: 0.8003146244372233
Energy: 0.7220330058633452
Energy: 0.8003146244372233
Energy: 0.7220330058633452
Energy: 0.7150040814550171
Energy: 0.7700788189106493
Energy: 0.7150040814550171
Energy: 0.7700788189106493
Energy: 0.7150040814553317
Energy: 0.7700788189106493
Energy: 0.747399619855581
Energy: 0.722546709081386
Energy: 0.7473996198545119
Energy: 0.7225467090810086
Energy: 0.7473996198545119
Energy: 0.722546709081386
Energy: 0.7657469468623234
Energy: 0.7230478501019173
Energy: 0.765746946863015
Energy: 0.7230478501019173
Energy: 0.7657469468623234
Energy: 0.7230478501019173

minimum gb energy = 0.6873066926488219 eV
minimum distance =  2.34238342344999 Angstroms
sigma value = 81


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

Energy: 0.8154471351378927
Energy: 0.7673888688497085
Energy: 0.8154471351378927
Energy: 0.7673888688497085
Energy: 0.8154471351378927
Energy: 0.7673888688497085
Energy: 0.7368381476751871
Energy: 0.7075138734081445
Energy: 0.7368381476751871
Energy: 0.7075138734081445
Energy: 0.7368381476751871
Energy: 0.7075138734081445
Energy: 0.7864379589881503
Energy: 0.6713410432930584
Energy: 0.7864379589881503
Energy: 0.6713410432925837
Energy: 0.7864379589881503
Energy: 0.6713410432930584
Energy: 0.744035163369744
Energy: 0.7493205202845385
Energy: 0.744035163369744
Energy: 0.7493205202845385
Energy: 0.744035163369744
Energy: 0.7493205202845385
Energy: 0.7089623742431972
Energy: 0.7238374442940475
Energy: 0.7089623742431972
Energy: 0.7238374442940475
Energy: 0.708962374243672
Energy: 0.7238374442940475
Energy: 0.711285176303141
Energy: 0.6711166855240047
Energy: 0.711285176303141
Energy: 0.6711166855240047
Energy: 0.711285176303141
Energy: 0.6711166855240047
Energy: 0.6754017014002088
Energy: 0.6703080775958603
Energy: 0.6754017014002088
Energy: 0.6703080775958603
Energy: 0.6754017014002088
Energy: 0.6703080775958603
Energy: 0.7141247730062141
Energy: 0.7685328822884535
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Energy: 0.7685328822884535
Energy: 0.7141247730062141
Energy: 0.7685328822884535
Energy: 0.8477185569253782
Energy: 0.7718489129358262
Energy: 0.8477185569253782
Energy: 0.7718489129353515
Energy: 0.8477185569253782
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Energy: 0.7495837415529252
Energy: 0.8047722206088878
Energy: 0.7495837415529252
Energy: 0.8047722206031911
Energy: 0.7495837415529252
Energy: 0.8047722206079383
Energy: 0.7244385774875166
Energy: 0.7054737135362203
Energy: 0.7244385774875166
Energy: 0.7054737135362203
Energy: 0.7244385774879912
Energy: 0.7054737135362203
Energy: 0.6702352874749951
Energy: 0.7006558442674479
Energy: 0.6702352874745203
Energy: 0.7006558442674479
Energy: 0.6702352874745203
Energy: 0.7006558442674479
Energy: 0.7395562421620661
Energy: 0.7074214080226647
Energy: 0.7395562421620661
Energy: 0.7074214080226647
Energy: 0.7395562421620661
Energy: 0.7074214080226647
Energy: 0.7726830761587675
Energy: 0.6710185899124695
Energy: 0.7726830761587675
Energy: 0.6710185899129443
Energy: 0.7726830761587675
Energy: 0.6710185899119948
Energy: 0.8143036101535014
Energy: 0.6642776601502705
Energy: 0.814303610153976
Energy: 0.6642776601502705
Energy: 0.8143036101487542
Energy: 0.6642776601502705
Energy: 0.7146783004071707
Energy: 0.6696935768536832
Energy: 0.7146783004071707
Energy: 0.6696935768536832
Energy: 0.7146783004071707
Energy: 0.6696935768536832
Energy: 0.7843270938144977
Energy: 0.6706564711914361
Energy: 0.7843270938144977
Energy: 0.6706564711909614
Energy: 0.784327093814023
Energy: 0.6706564711909614
Energy: 0.6596715497613834
Energy: 0.7959168637721524
Energy: 0.6596715497609087
Energy: 0.7959168637721524
Energy: 0.6596715497613834
Energy: 0.7959168637721524
Energy: 0.6709339598265787
Energy: 0.7612347270626753
Energy: 0.6709339598256292
Energy: 0.7612347270626753
Energy: 0.6709339598270534
Energy: 0.7612347270626753
Energy: 0.7480596394337455
Energy: 0.867780923031817
Energy: 0.7480596394337455
Energy: 0.867780923031817
Energy: 0.7480596394342203
Energy: 0.867780923031817
Energy: 0.6701588480812196
Energy: 0.7061564170152657
Energy: 0.6701588480812196
Energy: 0.7061564170152657
Energy: 0.6701588480812196
Energy: 0.7061564170152657
Energy: 0.7137815461246974
Energy: 0.7049262654638825
Energy: 0.7137815461242226
Energy: 0.7049262654638825
Energy: 0.7137815461242226
Energy: 0.7049262654638825
Energy: 0.7141597343550099
Energy: 0.6618802226100333
Energy: 0.7141597343550099
Energy: 0.6618802226100333
Energy: 0.7141597343550099
Energy: 0.6618802226100333
Energy: 0.8235389688127216
Energy: 0.7094761566889278
Energy: 0.8235389688127216
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Energy: 0.7094761566889278
Energy: 0.771372833567926
Energy: 0.8440681588024208
Energy: 0.7713728335674512
Energy: 0.8440681588024208
Energy: 0.771372833567926
Energy: 0.8440681588024208
Energy: 0.8201958314371418
Energy: 0.8437418315105721
Energy: 0.8201958314376164
Energy: 0.8437418315105721
Energy: 0.8201958314371418
Energy: 0.8437418315105721
Energy: 0.659624347646484
Energy: 0.7432425424899438
Energy: 0.6596243476469588
Energy: 0.7432425424899438
Energy: 0.6596243476469588
Energy: 0.7432425424899438
Energy: 0.6944074191583545
Energy: 0.6705363745089264
Energy: 0.6944074191583545
Energy: 0.6705363745089264
Energy: 0.6944074191578797
Energy: 0.6705363745089264
Energy: 0.7117964419645092
Energy: 0.7372549538783509
Energy: 0.7117964419645092
Energy: 0.7372549538783509
Energy: 0.7117964419645092
Energy: 0.7372549538783509
Energy: 0.6713856951309968
Energy: 0.6654569228872095
Energy: 0.6713856951314714
Energy: 0.6654569228872095
Energy: 0.6713856951314714
Energy: 0.6654569228872095
Energy: 0.7495760221162417
Energy: 0.8108002989676516
Energy: 0.7495760221162417
Energy: 0.8108002989676516
Energy: 0.7495760221162417
Energy: 0.8108002989671769
Energy: 0.6697671069864233
Energy: 0.7097553823426808
Energy: 0.6697671069864233
Energy: 0.7097553823426808
Energy: 0.6697671069864233
Energy: 0.7097553823426808
Energy: 0.6699879073258806
Energy: 0.6905437605399241
Energy: 0.669987907325406
Energy: 0.6905437605399241
Energy: 0.669987907325406
Energy: 0.6905437605394493
Energy: 0.6801818119177617
Energy: 0.674455470729457
Energy: 0.680181811917287
Energy: 0.674455470729457
Energy: 0.6801818119177617
Energy: 0.674455470729457
Energy: 0.7097644921486409
Energy: 0.937349785120625
Energy: 0.7097644921486409
Energy: 0.937349785120625
Energy: 0.7097644921486409
Energy: 0.937349785120625
Energy: 0.8757536508277252
Energy: 0.7483842494852239
Energy: 0.8757536508277252
Energy: 0.7483842494852239
Energy: 0.8757536508277252
Energy: 0.7483842494852239
Energy: 0.7120289244662612
Energy: 0.6715409184765043
Energy: 0.7120289244662612
Energy: 0.6715409184760296
Energy: 0.7120289244662612
Energy: 0.6715409184760296
Energy: 0.7045983021112897
Energy: 0.6699834617525572
Energy: 0.7045983021112897
Energy: 0.6699834617530319
Energy: 0.7045983021112897
Energy: 0.6699834617530319

minimum gb energy = 0.659624347646484 eV
minimum distance =  2.39733945575998 Angstroms
sigma value = 43


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

Energy: 0.9054295272142627
Energy: 0.6909517100382392
Energy: 0.9054295272142627
Energy: 0.6909517100382392
Energy: 0.9054295272142627
Energy: 0.6909517100382392
Energy: 0.7794775691963143
Energy: 0.6928001536481935
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Energy: 0.6928001536481935
Energy: 0.7794775691963143
Energy: 0.6928001536481935
Energy: 0.8050537669308815
Energy: 0.8526179882244795
Energy: 0.8050537669308815
Energy: 0.8526179882244795
Energy: 0.8075350120000084
Energy: 0.8526179882244795
Energy: 0.7209880503891258
Energy: 0.7445504309087659
Energy: 0.7209880503891258
Energy: 0.7445504309087659
Energy: 0.7209880503891258
Energy: 0.7445504309087659
Energy: 0.7166154533999008
Energy: 0.7831616279225537
Energy: 0.7166154533999008
Energy: 0.7831616279225537
Energy: 0.7166154533999008
Energy: 0.7831616279231367
Energy: 0.7362656367087176
Energy: 0.7523012006730461
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Energy: 0.7523012006730461
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Energy: 0.7523012006730461
Energy: 0.8174133993227333
Energy: 0.8183874514118535
Energy: 0.8174133993233165
Energy: 0.8183874514118535
Energy: 0.8174133993233165
Energy: 0.8183874514112706
Energy: 0.7314317861475799
Energy: 0.7730548735423344
Energy: 0.731431786148163
Energy: 0.7730548735429176
Energy: 0.7314317861475799
Energy: 0.7730548735423344
Energy: 0.8019728645829165
Energy: 0.7040984552553224
Energy: 0.8019728645759459
Energy: 0.7040984552553224
Energy: 0.8019728645689486
Energy: 0.7040984552553224
Energy: 0.7372474767896611
Energy: 0.7543235192988215
Energy: 0.737247476789078
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Energy: 0.737247476789078
Energy: 0.7543235192988215
Energy: 0.8226200187579853
Energy: 0.7687748861074825
Energy: 0.8226200187579853
Energy: 0.7687748861074825
Energy: 0.8226200187579853
Energy: 0.7687748861074825
Energy: 0.7313900098567627
Energy: 0.7234085167123735
Energy: 0.7313900098567627
Energy: 0.7234085167123735
Energy: 0.7313900098567627
Energy: 0.7234085167123735
Energy: 0.7227346640305538
Energy: 0.7527600014214615
Energy: 0.724095068190695
Energy: 0.7527600014214615
Energy: 0.7245203209857618
Energy: 0.7527600014214615
Energy: 0.6682597753837621
Energy: 0.8537112645660783
Energy: 0.6682597753843452
Energy: 0.8537112645660783
Energy: 0.6682597753843452
Energy: 0.8537112645660783
Energy: 0.7170179592532022
Energy: 0.7846030881258865
Energy: 0.7170179592532022
Energy: 0.7846030881258865
Energy: 0.7170179592532022
Energy: 0.7846030881258865
Energy: 0.7614899297986079
Energy: 0.7411735029084938
Energy: 0.7614899297986079
Energy: 0.7411735029084938
Energy: 0.7614899297986079
Energy: 0.7411735029084938
Energy: 0.794701092301535
Energy: 0.6930925777766668
Energy: 0.794701092301535
Energy: 0.69309257777725
Energy: 0.794701092301535
Energy: 0.69309257777725
Energy: 0.8041007927658789
Energy: 0.7458710568082566
Energy: 0.8041007927658789
Energy: 0.7458710568082566
Energy: 0.8041007927658789
Energy: 0.7458710568082566
Energy: 0.8235503370111866
Energy: 0.731848983385071
Energy: 0.8235503370106035
Energy: 0.731848983385071
Energy: 0.8235503370106035
Energy: 0.731848983385071
Energy: 0.7934467602236398
Energy: 0.6946250438620098
Energy: 0.7934467602236398
Energy: 0.6946250438625929
Energy: 0.7934467602236398
Energy: 0.6946250438625929
Energy: 0.7612120744995763
Energy: 0.7745582590220905
Energy: 0.7612120744995763
Energy: 0.7745582590220905
Energy: 0.7612120744995763
Energy: 0.7745582590220905
Energy: 0.7934908243038109
Energy: 0.7855946609162577
Energy: 0.7934908243032278
Energy: 0.7855946609162577
Energy: 0.7934908243038109
Energy: 0.7855946609162577
Energy: 0.6692175900134792
Energy: 0.7974959977921433
Energy: 0.6692175900134792
Energy: 0.7974959977927265
Energy: 0.6692175900134792
Energy: 0.7974959977921433
Energy: 0.8135501294746053
Energy: 0.7531502646132674
Energy: 0.813550129474022
Energy: 0.7531502646132674
Energy: 0.813550129474022
Energy: 0.7531502646138504
Energy: 0.731965843763545
Energy: 0.7312385531537926
Energy: 0.731965843763545
Energy: 0.7312385531537926
Energy: 0.731965843763545
Energy: 0.7312385531537926
Energy: 0.8122730534095192
Energy: 0.761956952246857
Energy: 0.8122730534095192
Energy: 0.761956952246857
Energy: 0.8122730534095192
Energy: 0.761956952246857
Energy: 0.7539816953341857
Energy: 0.6922003901316532
Energy: 0.7539816953341857
Energy: 0.6922003901316532
Energy: 0.7539816953341857
Energy: 0.6922003901316532
Energy: 0.8550882648403391
Energy: 0.6885270652899771
Energy: 0.8550882648403391
Energy: 0.6885270652899771
Energy: 0.8550882648403391
Energy: 0.6885270652899771
Energy: 0.7320294544204089
Energy: 0.773308327390732
Energy: 0.7320294544204089
Energy: 0.7733083273901488
Energy: 0.7320294544204089
Energy: 0.773308327390732
Energy: 0.7747335734656845
Energy: 0.7948626574215757
Energy: 0.7747335734656845
Energy: 0.7948626574215757
Energy: 0.7747335734656845
Energy: 0.7948626574215757
Energy: 0.7374566283058844
Energy: 0.7524266631475972
Energy: 0.7374566283058844
Energy: 0.7524266631475972
Energy: 0.7374566283053012
Energy: 0.7524266631475972

minimum gb energy = 0.6682597753837621 eV
minimum distance =  2.35600161186374 Angstroms
sigma value = 57


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

Energy: 0.7612237245844773
Energy: 0.6584062855969159
Energy: 0.7612237245844773
Energy: 0.6584062855969159
Energy: 0.7612237245844773
Energy: 0.6584062855969159
Energy: 0.7330121817005473
Energy: 0.6719156067868632
Energy: 0.7330121817005473
Energy: 0.6719156067868632
Energy: 0.7330121817005473
Energy: 0.6719156067868632
Energy: 0.7613544780614767
Energy: 0.8343943869906698
Energy: 0.7613544780614767
Energy: 0.8343943869906698
Energy: 0.7613544780622317
Energy: 0.8343943869906698
Energy: 0.7611322557604957
Energy: 0.7814203657536408
Energy: 0.7611322557604957
Energy: 0.7814203657536408
Energy: 0.7611322557604957
Energy: 0.7814203657536408
Energy: 0.6926214770908312
Energy: 0.779202778766671
Energy: 0.6926214770900763
Energy: 0.7792027787674259
Energy: 0.6926214770908312
Energy: 0.7792027787674259
Energy: 0.728244762279029
Energy: 0.7339243537104752
Energy: 0.728244762279029
Energy: 0.7339243537104752
Energy: 0.728244762279029
Energy: 0.7339243537104752
Energy: 0.7574935482214104
Energy: 0.8336126342396598
Energy: 0.7574935482214104
Energy: 0.8336126342396598
Energy: 0.7574935482214104
Energy: 0.8336126342396598
Energy: 0.7612548679877543
Energy: 0.6606844308770646
Energy: 0.7612548679877543
Energy: 0.6606844308778195
Energy: 0.7612548679877543
Energy: 0.6606844308778195
Energy: 0.7077692758033878
Energy: 0.6629214192925924
Energy: 0.7077692758033878
Energy: 0.6629214192925924
Energy: 0.7077692758033878
Energy: 0.6629214192925924
Energy: 0.6225565008683211
Energy: 0.742600504934901
Energy: 0.6225565008675661
Energy: 0.742600504934901
Energy: 0.6225565008683211
Energy: 0.742600504934901
Energy: 0.7571604343692527
Energy: 0.7872818135327004
Energy: 0.7571604343692527
Energy: 0.7872818135327004
Energy: 0.7571604343692527
Energy: 0.7872818135327004
Energy: 0.6967781413066471
Energy: 0.7776011258485995
Energy: 0.6967781413066471
Energy: 0.7776011258485995
Energy: 0.6967781413066471
Energy: 0.7776011258485995
Energy: 0.7540540030977672
Energy: 0.6632535328796978
Energy: 0.7540540030970122
Energy: 0.6632535328796978
Energy: 0.7540540030970122
Energy: 0.6632535328796978
Energy: 0.7183837720183427
Energy: 0.6752306615145718
Energy: 0.7183837720085278
Energy: 0.6752306615145718
Energy: 0.7183837720123027
Energy: 0.6752306615145718
Energy: 0.6911434476492311
Energy: 0.6674377882440803
Energy: 0.6911434476499863
Energy: 0.6674377882440803
Energy: 0.6911434476499863
Energy: 0.6674377882440803
Energy: 0.6986972849494948
Energy: 0.6587294126884823
Energy: 0.6986972849494948
Energy: 0.6587294126884823
Energy: 0.6986972849494948
Energy: 0.6587294126884823
Energy: 0.6528708254554586
Energy: 0.7322790497530406
Energy: 0.6528708254554586
Energy: 0.7322790497530406
Energy: 0.6528708254554586
Energy: 0.7322790497530406
Energy: 0.7551335913996003
Energy: 0.6658856665205035
Energy: 0.7551335913996003
Energy: 0.6658856665212586
Energy: 0.7551335913988455
Energy: 0.6658856665205035
Energy: 0.6532767748760803
Energy: 0.7322860842877847
Energy: 0.6532767748760803
Energy: 0.7322860842877847
Energy: 0.6532767748760803
Energy: 0.7322860842877847
Energy: 0.6984496720129504
Energy: 0.6587571139597852
Energy: 0.6984496720129504
Energy: 0.6587571139597852
Energy: 0.6984496720129504
Energy: 0.6587571139597852
Energy: 0.6908767475492201
Energy: 0.6673655353192383
Energy: 0.6908767475809301
Energy: 0.6673655353192383
Energy: 0.6908767475529951
Energy: 0.6673655353192383
Energy: 0.7169966364357773
Energy: 0.7574248859470216
Energy: 0.7169966363112714
Energy: 0.7574248859470216
Energy: 0.7169966357105673
Energy: 0.7574248859470216
Energy: 0.7539239347138386
Energy: 0.6632875059092943
Energy: 0.7539239347138386
Energy: 0.6632875059092943
Energy: 0.7539239347138386
Energy: 0.6632875059092943
Energy: 0.6946678481177204
Energy: 0.7775054929269014
Energy: 0.6946678481177204
Energy: 0.7775054929269014
Energy: 0.6946678481177204
Energy: 0.7775054929269014

minimum gb energy = 0.6225565008675661 eV
minimum distance =  2.39042073520163 Angstroms
sigma value = 17


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

Energy: 0.7034913536716617
Energy: 0.6862170460670823
Energy: 0.7034913536716617
Energy: 0.6862170460670823
Energy: 0.7034913536716617
Energy: 0.6862170460670823
Energy: 0.6684972979472102
Energy: 0.6704439023370085
Energy: 0.6684972979472102
Energy: 0.6704439023370085
Energy: 0.6684972979472102
Energy: 0.6704439023370085
Energy: 0.8044765697711054
Energy: 0.7886988853057881
Energy: 0.8044765697711054
Energy: 0.7886988853057881
Energy: 0.8044765697700378
Energy: 0.7886988853057881
Energy: 0.6033041536002094
Energy: 0.7703196910063186
Energy: 0.6033041536002094
Energy: 0.7703196910063186
Energy: 0.6033041536002094
Energy: 0.7703196910063186
Energy: 0.6871873115170739
Energy: 0.7386118316526804
Energy: 0.6871873115170739
Energy: 0.7386118316526804
Energy: 0.6871873115170739
Energy: 0.7386118316526804
Energy: 0.7050624087343632
Energy: 0.7590743405864157
Energy: 0.705062408735431
Energy: 0.7590743405864157
Energy: 0.705062408735431
Energy: 0.7590743405864157
Energy: 0.7598700205038281
Energy: 0.6680516654167534
Energy: 0.7598700205038281
Energy: 0.6680516654156857
Energy: 0.7598700205038281
Energy: 0.6680516654167534
Energy: 0.6029828460441363
Energy: 0.7309534564923745
Energy: 0.6029828460441363
Energy: 0.7309534564923745
Energy: 0.6029828460441363
Energy: 0.7309534564923745
Energy: 0.7401868403880648
Energy: 0.675810962026904
Energy: 0.7401868403880648
Energy: 0.675810962026904
Energy: 0.7401868403880648
Energy: 0.675810962026904
Energy: 0.7118008107881619
Energy: 0.6659556759857495
Energy: 0.7118008107892296
Energy: 0.6659556759857495
Energy: 0.7118008107881619
Energy: 0.6659556759857495
Energy: 0.7007698645507338
Energy: 0.6436672261300213
Energy: 0.7007698645507338
Energy: 0.643667226131089
Energy: 0.7007698645507338
Energy: 0.643667226131089
Energy: 0.6852586848723285
Energy: 0.6638699892305162
Energy: 0.6852586848723285
Energy: 0.6638699892305162
Energy: 0.6852586848723285
Energy: 0.6638699892305162
Energy: 0.6285033349163981
Energy: 0.7614323361108097
Energy: 0.6285033349163981
Energy: 0.7614323361108097
Energy: 0.6285033349163981
Energy: 0.7614323361108097
Energy: 0.7113049232021225
Energy: 0.7510788930442021
Energy: 0.7113049232010548
Energy: 0.7510788930442021
Energy: 0.7113049232010548
Energy: 0.7510788930442021
Energy: 0.7117578607349977
Energy: 0.6248971563161094
Energy: 0.7117578607349977
Energy: 0.6248971563161094
Energy: 0.7117578607349977
Energy: 0.6248971563161094
Energy: 0.7090092462308234
Energy: 0.762824357975646
Energy: 0.7090092462308234
Energy: 0.762824357975646
Energy: 0.7090092462308234
Energy: 0.762824357975646
Energy: 0.7095817193040196
Energy: 0.7498872966532603
Energy: 0.7095817193040196
Energy: 0.7498872966532603
Energy: 0.7095817193040196
Energy: 0.7498872966532603

minimum gb energy = 0.6029828460441363 eV
minimum distance =  2.3371804191024 Angstroms
sigma value = 17


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

Energy: 0.7019009375796221
Energy: 0.6282683480326721
Energy: 0.7019009375796221
Energy: 0.6282683480326721
Energy: 0.7019009375796221
Energy: 0.6282683480326721
Energy: 0.6457868515261388
Energy: 0.6114086533347574
Energy: 0.6457868515257266
Energy: 0.6114086533351697
Energy: 0.6457868515253142
Energy: 0.6114086533351697
Energy: 0.7030974728605449
Energy: 0.6683034895410631
Energy: 0.7030974728601326
Energy: 0.6683034895414754
Energy: 0.7030974728601326
Energy: 0.6683034895410631
Energy: 0.589391189486814
Energy: 0.6776165246858084
Energy: 0.5893911894864017
Energy: 0.6776165246858084
Energy: 0.589391189486814
Energy: 0.6776165246858084
Energy: 0.7190217282493787
Energy: 0.6070967062243819
Energy: 0.7190217282493787
Energy: 0.6070967062247943
Energy: 0.7190217282493787
Energy: 0.6070967062247943
Energy: 0.6716787210746177
Energy: 0.6393170886934796
Energy: 0.6716787210746177
Energy: 0.6393170886930674
Energy: 0.6716787210746177
Energy: 0.6393170886930674
Energy: 0.642060525446466
Energy: 0.6402457323755844
Energy: 0.6420605254460535
Energy: 0.6402457323751719
Energy: 0.6420605254460535
Energy: 0.6402457323755844
Energy: 0.6495929862680593
Energy: 0.7088598337569276
Energy: 0.6495929862680593
Energy: 0.7088598337565153
Energy: 0.649592986267647
Energy: 0.7088598337569276
Energy: 0.6573984631152407
Energy: 0.6754356238189428
Energy: 0.6573984631152407
Energy: 0.6754356238189428
Energy: 0.6573984631152407
Energy: 0.6754356238189428
Energy: 0.6382521665522936
Energy: 0.5776914565220036
Energy: 0.6382521665510565
Energy: 0.5776914565220036
Energy: 0.6382521665510565
Energy: 0.5776914565220036
Energy: 0.5891862197241416
Energy: 0.682262251744766
Energy: 0.5891862197241416
Energy: 0.6822622517443537
Energy: 0.5891862197241416
Energy: 0.6822622517451784
Energy: 0.7068816995594317
Energy: 0.6251830813591815
Energy: 0.7068816995594317
Energy: 0.6251830813591815
Energy: 0.7068816995594317
Energy: 0.6251830813591815
Energy: 0.6522630925520805
Energy: 0.626248047580153
Energy: 0.6522630925520805
Energy: 0.626248047580153
Energy: 0.6522630925520805
Energy: 0.626248047580153
Energy: 0.6427603885003429
Energy: 0.6336839478316624
Energy: 0.6427603885003429
Energy: 0.6336839478308377
Energy: 0.6427603885007552
Energy: 0.6336839478308377
Energy: 0.6680507417001782
Energy: 0.6249818528910961
Energy: 0.6680507417001782
Energy: 0.6249818528910961
Energy: 0.6680507417001782
Energy: 0.6249818528910961
Energy: 0.5889219467180464
Energy: 0.6633302947984681
Energy: 0.5889219467180464
Energy: 0.6633302947980557
Energy: 0.5889219467180464
Energy: 0.6633302947984681
Energy: 0.6517752250631166
Energy: 0.6616193247427304
Energy: 0.6517752250631166
Energy: 0.6616193247427304
Energy: 0.6517752250635289
Energy: 0.6616193247427304
Energy: 0.6736010368083497
Energy: 0.6644703381175818
Energy: 0.6736010368083497
Energy: 0.6644703381175818
Energy: 0.6736010368083497
Energy: 0.6644703381175818
Energy: 0.6483182603482117
Energy: 0.6647368826180918
Energy: 0.6483182603477993
Energy: 0.6647368826180918
Energy: 0.6483182603477993
Energy: 0.6647368826185042
Energy: 0.6509332024709081
Energy: 0.6021100426498462
Energy: 0.6509332024709081
Energy: 0.5767202804549267
Energy: 0.6509332024709081
Energy: 0.5767202804549267
Energy: 0.6482759572050893
Energy: 0.6652501615724354
Energy: 0.6482759572050893
Energy: 0.66525016157326
Energy: 0.6482759572050893
Energy: 0.66525016157326
Energy: 0.67378360227549
Energy: 0.6650450671583814
Energy: 0.67378360227549
Energy: 0.6650450671583814
Energy: 0.67378360227549
Energy: 0.6650450671583814
Energy: 0.6518187396857898
Energy: 0.6614692917546292
Energy: 0.6518187396857898
Energy: 0.6614692917546292
Energy: 0.6518187396857898
Energy: 0.6614692917546292
Energy: 0.5892077573105421
Energy: 0.7215563189334687
Energy: 0.5892077573105421
Energy: 0.7215563189342933
Energy: 0.5892077573105421
Energy: 0.7215563189334687
Energy: 0.6680317040865408
Energy: 0.6251022053144234
Energy: 0.6680317040865408
Energy: 0.6251022053247314
Energy: 0.6680317040865408
Energy: 0.6251022053383378
Energy: 0.6425433092416925
Energy: 0.6335272721878843
Energy: 0.6425433092416925
Energy: 0.6335272721878843
Energy: 0.6425433092416925
Energy: 0.6335272721878843
Energy: 0.6522097000136015
Energy: 0.6268998238256824
Energy: 0.6522097000136015
Energy: 0.6268998238260947
Energy: 0.6522097000136015
Energy: 0.6268998238256824
Energy: 0.7069383471862554
Energy: 0.6252599892406213
Energy: 0.7069383471858429
Energy: 0.6252599892406213
Energy: 0.7069383471862554
Energy: 0.6252599892406213
Energy: 0.5891770800297235
Energy: 0.6852550793366347
Energy: 0.5891770800297235
Energy: 0.685255079337047
Energy: 0.5891770800297235
Energy: 0.6852550793362224
Energy: 0.638245955880635
Energy: 0.5779867989917811
Energy: 0.638245955880635
Energy: 0.5779867989917811
Energy: 0.6382459558810476
Energy: 0.5779867989917811
Energy: 0.6573385809693
Energy: 0.6752055987118423
Energy: 0.6573385809697123
Energy: 0.6752055987118423
Energy: 0.6573385809697123
Energy: 0.6752055987118423
Energy: 0.6485444558450355
Energy: 0.7093412667998034
Energy: 0.6485444558450355
Energy: 0.7093412667998034
Energy: 0.6485444558450355
Energy: 0.7093412667998034
Energy: 0.6421384441736603
Energy: 0.6404576772249683
Energy: 0.6421384441736603
Energy: 0.6404576772249683
Energy: 0.6421384441736603
Energy: 0.6404576772249683
Energy: 0.6711548351931169
Energy: 0.6163128064017686
Energy: 0.6711548351931169
Energy: 0.6163128064017686
Energy: 0.6711548351931169
Energy: 0.6163128064017686
Energy: 0.718645286429482
Energy: 0.6071878959515382
Energy: 0.7186452864290696
Energy: 0.6071878959503013
Energy: 0.718645286429482
Energy: 0.607187895949889
Energy: 0.5896046581943041
Energy: 0.6745073917133712
Energy: 0.5896046581943041
Energy: 0.6745073917129588
Energy: 0.5896046581943041
Energy: 0.6745073917129588
Energy: 0.7032568723882557
Energy: 0.6683808935257421
Energy: 0.7032568723882557
Energy: 0.6683808935257421
Energy: 0.7032568723878434
Energy: 0.6683808935253299
Energy: 0.645645255693385
Energy: 0.6076442509244446
Energy: 0.645645255693385
Energy: 0.6076442509244446
Energy: 0.645645255693385
Energy: 0.6076442509244446
Energy: 0.7019009375796221
Energy: 0.6282683480326721
Energy: 0.7019009375796221
Energy: 0.6282683480326721
Energy: 0.7019009375796221
Energy: 0.6282683480326721
Energy: 0.6457868515253142
Energy: 0.6136311801853853
Energy: 0.6457868515253142
Energy: 0.6136311801857975
Energy: 0.6457868515253142
Energy: 0.6136311801853853
Energy: 0.7030974728605449
Energy: 0.6683034895414754
Energy: 0.7030974728605449
Energy: 0.6683034895410631
Energy: 0.7030974728601326
Energy: 0.6683034895410631
Energy: 0.589391189486814
Energy: 0.661372297170907
Energy: 0.589391189486814
Energy: 0.661372297170907
Energy: 0.589391189486814
Energy: 0.661372297170907
Energy: 0.7190217282493787
Energy: 0.6070967062247943
Energy: 0.7190217282493787
Energy: 0.6070967062247943
Energy: 0.7190217282493787
Energy: 0.6070967062247943

minimum gb energy = 0.5767202804549267 eV
minimum distance =  2.36453615721941 Angstroms
sigma value = 57


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

Energy: 0.5969453943167925
Energy: 0.5819802922652164
Energy: 0.5969453943167925
Energy: 0.5819802922652164
Energy: 0.5969453943167925
Energy: 0.581980292264545
Energy: 0.660818307770395
Energy: 0.57400956447189
Energy: 0.660818307770395
Energy: 0.57400956447189
Energy: 0.660818307770395
Energy: 0.57400956447189
Energy: 0.6609203538404558
Energy: 0.6208235582275367
Energy: 0.6609203538404558
Energy: 0.6208235582275367
Energy: 0.6609203538404558
Energy: 0.6208235582275367
Energy: 0.5578353343188659
Energy: 0.6369564386779939
Energy: 0.5578353343195374
Energy: 0.6369564386779939
Energy: 0.5578353343195374
Energy: 0.6369564386779939
Energy: 0.6566191614562191
Energy: 0.5666332849738097
Energy: 0.6566191614562191
Energy: 0.5666332849738097
Energy: 0.6566191614562191
Energy: 0.5666332849738097
Energy: 0.6321045973281477
Energy: 0.5735394856884003
Energy: 0.6321045973274764
Energy: 0.5735394856884003
Energy: 0.6321045973274764
Energy: 0.5735394856884003
Energy: 0.5461067484595977
Energy: 0.6135529900277802
Energy: 0.5461067484595977
Energy: 0.6135529900277802
Energy: 0.5461067484595977
Energy: 0.6135529900277802
Energy: 0.7253162830675763
Energy: 0.6006138505538197
Energy: 0.7253162830682477
Energy: 0.6006138505538197
Energy: 0.7253162830675763
Energy: 0.6006138505538197
Energy: 0.5791809171717672
Energy: 0.5753774764804979
Energy: 0.5791809171717672
Energy: 0.5753774764798265
Energy: 0.5791809171717672
Energy: 0.5753774764798265
Energy: 0.5873983861899669
Energy: 0.5899051511757166
Energy: 0.5873983861899669
Energy: 0.5899051511757166
Energy: 0.5873983861899669
Energy: 0.5899051511757166
Energy: 0.5460643066556795
Energy: 0.7292264387181542
Energy: 0.5460643066556795
Energy: 0.7292264387181542
Energy: 0.5460643066556795
Energy: 0.7292264387181542
Energy: 0.6041046201732535
Energy: 0.5525860211471065
Energy: 0.6041046201732535
Energy: 0.5525860211464352
Energy: 0.6041046201732535
Energy: 0.5525860211471065
Energy: 0.5858499635087756
Energy: 0.6252194101751761
Energy: 0.5858499635087756
Energy: 0.6252194101751761
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Energy: 0.6252194101751761
Energy: 0.5552709700127793
Energy: 0.6835710142312831
Energy: 0.5552709700127793
Energy: 0.6835710142312831
Energy: 0.5552709700127793
Energy: 0.6835710142312831
Energy: 0.6502138022688545
Energy: 0.584370041902688
Energy: 0.6502138022688545
Energy: 0.584370041902688
Energy: 0.6502138022688545
Energy: 0.584370041902688
Energy: 0.5850098819145385
Energy: 0.5825898176822568
Energy: 0.5850098819145385
Energy: 0.5825898176829283
Energy: 0.5850098819145385
Energy: 0.5825898176822568
Energy: 0.6043870001827396
Energy: 0.6606719436417232
Energy: 0.604387000183411
Energy: 0.6606719436417232
Energy: 0.604387000183411
Energy: 0.6606719436417232
Energy: 0.6203039290749156
Energy: 0.6369940819492065
Energy: 0.6203039290749156
Energy: 0.636994081948535
Energy: 0.6203039290742441
Energy: 0.6369940819492065
Energy: 0.5639949079676758
Energy: 0.6925782492094683
Energy: 0.5639949079676758
Energy: 0.6925782492094683
Energy: 0.5639949079676758
Energy: 0.6925782492094683
Energy: 0.5584641567171461
Energy: 0.6310099025544651
Energy: 0.5584641567171461
Energy: 0.6310099025544651
Energy: 0.5584641567171461
Energy: 0.6310099025544651
Energy: 0.6175311328159967
Energy: 0.6147897444675955
Energy: 0.6175311328159967
Energy: 0.6147897444682667
Energy: 0.6175311328159967
Energy: 0.6147897444682667
Energy: 0.5453441817460509
Energy: 0.6959716820504388
Energy: 0.5453441817460509
Energy: 0.6959716820497674
Energy: 0.5453441817467223
Energy: 0.6959716820504388
Energy: 0.6029151110900763
Energy: 0.603795711692151
Energy: 0.6029151110900763
Energy: 0.603795711692151
Energy: 0.6029151110900763
Energy: 0.603795711692151
Energy: 0.6069387043688921
Energy: 0.6960605921826044
Energy: 0.6069387043688921
Energy: 0.6960605921826044
Energy: 0.6069387043688921
Energy: 0.6960605921826044
Energy: 0.5975913425152399
Energy: 0.7423830704433396
Energy: 0.5975913425159112
Energy: 0.7423830704433396
Energy: 0.5975913425152399
Energy: 0.7423830704433396
Energy: 0.584906399424366
Energy: 0.6030961921925556
Energy: 0.584906399424366
Energy: 0.6030961921925556
Energy: 0.584906399424366
Energy: 0.6030961921925556
Energy: 0.5544354325242591
Energy: 0.6926852572838448
Energy: 0.5544354325242591
Energy: 0.6926852572831734
Energy: 0.5544354325242591
Energy: 0.6926852572831734

minimum gb energy = 0.5453441817460509 eV
minimum distance =  2.32536826136814 Angstroms
sigma value = 43


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

Energy: 0.5559090517981372
Energy: 0.5225602617153922
Energy: 0.5559090517981372
Energy: 0.5225602617149031
Energy: 0.5559090517981372
Energy: 0.5225602617153922
Energy: 0.5725416915760442
Energy: 0.5300937213544312
Energy: 0.5725416915760442
Energy: 0.5300937213549205
Energy: 0.5725416915760442
Energy: 0.5300937213544312
Energy: 0.592836087265694
Energy: 0.5517066129167918
Energy: 0.5928360872661832
Energy: 0.5517066129172808
Energy: 0.592836087265694
Energy: 0.5517066129172808
Energy: 0.5306544343358841
Energy: 0.5472386531015593
Energy: 0.5306544343358841
Energy: 0.5472386531015593
Energy: 0.5306544343353949
Energy: 0.5472386531015593
Energy: 0.570722714811795
Energy: 0.5048842281605591
Energy: 0.570722714811795
Energy: 0.5048842281605591
Energy: 0.570722714811795
Energy: 0.5048842281605591
Energy: 0.537892137714359
Energy: 0.5131381550573386
Energy: 0.537892137714359
Energy: 0.5131381550573386
Energy: 0.537892137714359
Energy: 0.5131381550573386
Energy: 0.4867328660819367
Energy: 0.530363060595075
Energy: 0.4867328660809585
Energy: 0.530363060595075
Energy: 0.4867328660814476
Energy: 0.530363060595075
Energy: 0.6974661888795126
Energy: 0.4967689736095607
Energy: 0.6974661888795126
Energy: 0.4967689736095607
Energy: 0.6974661888795126
Energy: 0.4967689736095607
Energy: 0.5148298804177426
Energy: 0.5063425068856254
Energy: 0.5148298804177426
Energy: 0.5063425068861146
Energy: 0.5148298804182317
Energy: 0.5063425068861146
Energy: 0.5750269898698035
Energy: 0.5045686280516928
Energy: 0.5750269898698035
Energy: 0.5045686280516928
Energy: 0.5750269898698035
Energy: 0.504568628052182
Energy: 0.6206854870367853
Energy: 0.5557313790568199
Energy: 0.6206854870372744
Energy: 0.5557313790568199
Energy: 0.6206854870377636
Energy: 0.5557313790568199
Energy: 0.48834740515265396
Energy: 0.5078519568660196
Energy: 0.48834740515265396
Energy: 0.5078519568660196
Energy: 0.48834740515265396
Energy: 0.5078519568660196
Energy: 0.5745281436286841
Energy: 0.48611512654733946
Energy: 0.5745281436286841
Energy: 0.48611512654733946
Energy: 0.5745281436286841
Energy: 0.48611512654733946
Energy: 0.6199950806229202
Energy: 0.5556211023741849
Energy: 0.6199950806229202
Energy: 0.5556211023741849
Energy: 0.6199950806229202
Energy: 0.5556211023741849
Energy: 0.5048815373813614
Energy: 0.5080245218324487
Energy: 0.5048815373808723
Energy: 0.5080245218324487
Energy: 0.5048815373813614
Energy: 0.5080245218324487
Energy: 0.5374761860673337
Energy: 0.5345654670921839
Energy: 0.5374761860673337
Energy: 0.5345654670921839
Energy: 0.537476186067823
Energy: 0.5345654670921839
Energy: 0.5739910741197937
Energy: 0.6131641688295959
Energy: 0.5739910741197937
Energy: 0.6131641688295959
Energy: 0.5739910741197937
Energy: 0.6131641688295959
Energy: 0.5237235450651365
Energy: 0.509114655254962
Energy: 0.5237235450646474
Energy: 0.509114655254962
Energy: 0.5237235450646474
Energy: 0.509114655254962
Energy: 0.48769664447887334
Energy: 0.5644500277793675
Energy: 0.48769664447887334
Energy: 0.5644500277788783
Energy: 0.48769664447887334
Energy: 0.5644500277788783
Energy: 0.5360029563725802
Energy: 0.5572223157553701
Energy: 0.5360029563725802
Energy: 0.5572223157558592
Energy: 0.5360029563725802
Energy: 0.5572223157553701
Energy: 0.5647907962520187
Energy: 0.5182400570722634
Energy: 0.5647907962520187
Energy: 0.5182400570722634
Energy: 0.5647907962520187
Energy: 0.5182400570722634
Energy: 0.5309372645517125
Energy: 0.5673584093839256
Energy: 0.5309372645512235
Energy: 0.5673584093839256
Energy: 0.5309372645512235
Energy: 0.5673584093834364
Energy: 0.534601081180914
Energy: 0.5665708589677422
Energy: 0.534601081180914
Energy: 0.5665708589677422
Energy: 0.534601081180914
Energy: 0.5665708589677422
Energy: 0.5933177724126542
Energy: 0.5165819605567171
Energy: 0.5933177724126542
Energy: 0.516581960556228
Energy: 0.5933177724126542
Energy: 0.5165819605567171
Energy: 0.4879102119606406
Energy: 0.5565164359817127
Energy: 0.4879102119606406
Energy: 0.5565164359817127
Energy: 0.4879102119606406
Energy: 0.5565164359817127
Energy: 0.5004480321046347
Energy: 0.5463515951958977
Energy: 0.5004480321041455
Energy: 0.5463515951958977
Energy: 0.5004480321046347
Energy: 0.5463515951958977
Energy: 0.5361968826405943
Energy: 0.49993492603584294
Energy: 0.5361968826405943
Energy: 0.49993492603633205
Energy: 0.5361968826405943
Energy: 0.49993492603584294
Energy: 0.48261207237600817
Energy: 0.552914529076804
Energy: 0.48261207237600817
Energy: 0.552914529076804
Energy: 0.48261207237600817
Energy: 0.552914529076804
Energy: 0.5007071569709318
Energy: 0.5132857854850625
Energy: 0.5007071569709318
Energy: 0.5132857854850625
Energy: 0.5007071569709318
Energy: 0.5132857854850625
Energy: 0.5009885362344794
Energy: 0.6225094397492601
Energy: 0.5009885362344794
Energy: 0.6225094397492601
Energy: 0.5009885362344794
Energy: 0.6225094397492601
Energy: 0.49515379081863214
Energy: 0.5536102246439643
Energy: 0.49515379081863214
Energy: 0.5536102246444533
Energy: 0.49515379081863214
Energy: 0.5536102246439643
Energy: 0.5011103753909116
Energy: 0.49671067926629753
Energy: 0.5011103753909116
Energy: 0.49671067926629753
Energy: 0.5011103753909116
Energy: 0.49671067926629753
Energy: 0.4858082058859991
Energy: 0.5557451205834222
Energy: 0.4858082058859991
Energy: 0.5557451205834222
Energy: 0.4858082058859991
Energy: 0.5557451205834222
Energy: 0.575411963737539
Energy: 0.6235920781449058
Energy: 0.575411963737539
Energy: 0.6235920781449058
Energy: 0.575411963737539
Energy: 0.6235920781449058
Energy: 0.5213467273655571
Energy: 0.48231456823712543
Energy: 0.5213467273655571
Energy: 0.48231456823712543
Energy: 0.5213467273655571
Energy: 0.48231456823712543
Energy: 0.45017625655233245
Energy: 0.5543085651110783
Energy: 0.45017625655233245
Energy: 0.5543085651110783
Energy: 0.45017625655233245
Energy: 0.5543085651110783

minimum gb energy = 0.45017625655233245 eV
minimum distance =  2.31601324887607 Angstroms
sigma value = 81


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

Energy: 0.2301135118167018
Energy: 0.2610941164913974
Energy: 0.01519900219998419
Energy: 0.2610941164913974
Energy: 0.2301135118167018
Energy: 0.2610941164913974
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.01519900219998419
Energy: 0.2610941164913974
Energy: 0.01519900219998419
Energy: 0.2610941164913974
Energy: 0.01519900219998419
Energy: 0.2610941164913974
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.2301135118167018
Energy: 0.2610941164913974
Energy: 0.01519900219998419
Energy: 0.2610941164913974
Energy: 0.2301135118167018
Energy: 0.2610941164913974
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.6163887229569656
Energy: 0.016118565198252756
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.566601819283086
Energy: 0.01579506135550665
Energy: 0.5666018192812887
Energy: 0.01579506135550665
Energy: 0.01519900219998419
Energy: 0.2610941164913974
Energy: 0.01519900219998419
Energy: 0.2610941164913974
Energy: 0.01519900219998419
Energy: 0.2610941164913974

minimum gb energy = 0.01519900219998419 eV
minimum distance =  2.48711668750654 Angstroms
sigma value = 3


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

Energy: 0.4678423104979471
Energy: 0.3860229699225547
Energy: 0.46784231049848496
Energy: 0.3860229699225547
Energy: 0.46784231049848496
Energy: 0.3860229699225547
Energy: 0.3972015765203388
Energy: 0.4556516296281282
Energy: 0.3972015765203388
Energy: 0.45565162962866607
Energy: 0.3972015765203388
Energy: 0.4556516296281282
Energy: 0.46899702528710735
Energy: 0.45707940681656223
Energy: 0.46899702528710735
Energy: 0.45707940681656223
Energy: 0.46899702528710735
Energy: 0.45707940681656223
Energy: 0.47621128393125767
Energy: 0.4386014220442434
Energy: 0.47621128393125767
Energy: 0.4386014220442434
Energy: 0.47621128393125767
Energy: 0.4386014220442434
Energy: 0.3980810568527545
Energy: 0.4575061973185528
Energy: 0.3980810568527545
Energy: 0.45750619731801495
Energy: 0.3980810568527545
Energy: 0.4575061973185528
Energy: 0.47022624384449474
Energy: 0.4638005024276828
Energy: 0.47022624384449474
Energy: 0.4638005024276828
Energy: 0.47022624384449474
Energy: 0.4638005024276828
Energy: 0.46059363574010576
Energy: 0.4472348095855682
Energy: 0.46059363574010576
Energy: 0.4472348095855682
Energy: 0.46059363574010576
Energy: 0.4472348095855682
Energy: 0.3945527854319657
Energy: 0.4580261344563549
Energy: 0.3945527854319657
Energy: 0.4580261344558171
Energy: 0.3945527854319657
Energy: 0.4580261344563549
Energy: 0.47906529336886633
Energy: 0.47007373258260116
Energy: 0.47906529336886633
Energy: 0.47007373258260116
Energy: 0.47906529336886633
Energy: 0.47007373258260116
Energy: 0.4357984767654324
Energy: 0.4314581405744377
Energy: 0.4357984767654324
Energy: 0.4314581405744377
Energy: 0.4357984767654324
Energy: 0.4314581405744377
Energy: 0.42231631678695725
Energy: 0.450751247706124
Energy: 0.42231631678695725
Energy: 0.450751247706124
Energy: 0.42231631678695725
Energy: 0.450751247706124
Energy: 0.4904523695847937
Energy: 0.49463649781226887
Energy: 0.4904523695847937
Energy: 0.49463649781226887
Energy: 0.4904523695847937
Energy: 0.49463649781226887
Energy: 0.4542811333877982
Energy: 0.4074359835100587
Energy: 0.4542811333877982
Energy: 0.4074359835100587
Energy: 0.4542811333877982
Energy: 0.4074359835100587
Energy: 0.44028142072185367
Energy: 0.4285003581394542
Energy: 0.44028142072185367
Energy: 0.42850035813999204
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Energy: 0.4285003581394542
Energy: 0.46535100577164445
Energy: 0.48079894036126575
Energy: 0.46535100577164445
Energy: 0.4807989403618036
Energy: 0.46535100577164445
Energy: 0.4807989403618036
Energy: 0.4592484230017193
Energy: 0.3996415798912179
Energy: 0.4592484230017193
Energy: 0.3996415798912179
Energy: 0.4592484230017193
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Energy: 0.34972212109051015
Energy: 0.4912210674240387
Energy: 0.3497221210899723
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Energy: 0.45414457890053805
Energy: 0.4538902643913599
Energy: 0.45414457890053805
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Energy: 0.45414457890053805
Energy: 0.4538902643913599
Energy: 0.46112789836296203
Energy: 0.40876428267248605
Energy: 0.46112789836296203
Energy: 0.40876428267248605
Energy: 0.46112789836296203
Energy: 0.40876428267248605
Energy: 0.4519529487902744
Energy: 0.4957871964247719
Energy: 0.4519529487902744
Energy: 0.4957871964247719
Energy: 0.4519529487902744
Energy: 0.4957871964247719
Energy: 0.46110278703949475
Energy: 0.32924273620392297
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Energy: 0.32924273620392297
Energy: 0.46110278703949475
Energy: 0.32924273620392297
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Energy: 0.4456523462021443
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Energy: 0.4456523462021443
Energy: 0.4362358090238145
Energy: 0.4456523462021443
Energy: 0.4583335701025831
Energy: 0.4356955585252482
Energy: 0.4583335701025831
Energy: 0.4356955585247103
Energy: 0.4583335701025831
Energy: 0.4356955585247103
Energy: 0.46460624311902876
Energy: 0.44067898659098387
Energy: 0.46460624311902876
Energy: 0.44067898659098387
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Energy: 0.44067898659098387
Energy: 0.45276335210830887
Energy: 0.46714613257870274
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Energy: 0.46714613257870274
Energy: 0.45276335210830887
Energy: 0.46714613257870274
Energy: 0.45675872526425293
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Energy: 0.45292387535854306
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Energy: 0.45292387535854306
Energy: 0.5193961658158223
Energy: 0.3885283081816623
Energy: 0.5193961658158223
Energy: 0.3885283081816623
Energy: 0.5193961658158223
Energy: 0.38852830818220013
Energy: 0.4665063450781501
Energy: 0.48409667982160226
Energy: 0.4665063450781501
Energy: 0.48409667982160226
Energy: 0.4665063450781501
Energy: 0.48409667982160226
Energy: 0.44996078662211064
Energy: 0.4597247920649055
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Energy: 0.4597247920649055
Energy: 0.44996078662211064
Energy: 0.4597247920649055
Energy: 0.5235443282978949
Energy: 0.41763940163255747
Energy: 0.5235443282978949
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Energy: 0.41763940163255747
Energy: 0.47867306727539016
Energy: 0.4795313154422711
Energy: 0.4786730672748523
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Energy: 0.42924178013909386
Energy: 0.45898851925992695
Energy: 0.4292417801396316
Energy: 0.45898851925992695
Energy: 0.42924178013909386
Energy: 0.45898851925992695
Energy: 0.4802479466578233
Energy: 0.4663724800721686
Energy: 0.4802479466578233
Energy: 0.4663724800721686
Energy: 0.4802479466578233
Energy: 0.4663724800721686

minimum gb energy = 0.32924273620392297 eV
minimum distance =  2.37198491920605 Angstroms
sigma value = 67


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

Energy: 0.6234931401545605
Energy: 0.5819862917092299
Energy: 0.6234931401545605
Energy: 0.5819862917092299
Energy: 0.6234931401553268
Energy: 0.5819862917092299
Energy: 0.5807147607841743
Energy: 0.5793178341790852
Energy: 0.5807147607841743
Energy: 0.5793178341790852
Energy: 0.5807147607841743
Energy: 0.5793178341790852
Energy: 0.6123491052535669
Energy: 0.6000090438242399
Energy: 0.6123491052535669
Energy: 0.6000090438242399
Energy: 0.6123491052535669
Energy: 0.6000090438242399
Energy: 0.609284901620576
Energy: 0.598525811620331
Energy: 0.6092849016198095
Energy: 0.598525811620331
Energy: 0.609284901620576
Energy: 0.598525811620331
Energy: 0.530417786182328
Energy: 0.5678454220102519
Energy: 0.530417786182328
Energy: 0.5678454220102519
Energy: 0.530417786182328
Energy: 0.5678454220102519
Energy: 0.6124813894076091
Energy: 0.5999772835314758
Energy: 0.6124813894076091
Energy: 0.5999772835314758
Energy: 0.6124813894076091
Energy: 0.5999772835314758
Energy: 0.5693238092394709
Energy: 0.5739305331501496
Energy: 0.5693238092394709
Energy: 0.5739305331501496
Energy: 0.5693238092394709
Energy: 0.5739305331501496
Energy: 0.5751384027661619
Energy: 0.5583687898870934
Energy: 0.5751384027661619
Energy: 0.5583687898870934
Energy: 0.5751384027661619
Energy: 0.5583687898870934
Energy: 0.6289955748969801
Energy: 0.6368244519189821
Energy: 0.6289955748969801
Energy: 0.6368244519182156
Energy: 0.6289955748969801
Energy: 0.6368244519182156
Energy: 0.5931096484030395
Energy: 0.5408257957906344
Energy: 0.5931096484030395
Energy: 0.5408257957906344
Energy: 0.5931096484030395
Energy: 0.5408257957906344
Energy: 0.5944974643345979
Energy: 0.6062158057037785
Energy: 0.5944974643345979
Energy: 0.6062158057030123
Energy: 0.5944974643345979
Energy: 0.6062158057037785
Energy: 0.5735343659514629
Energy: 0.6023132875858352
Energy: 0.5735343659514629
Energy: 0.6023132875858352
Energy: 0.5735343659514629
Energy: 0.6023132875858352
Energy: 0.5927229565316744
Energy: 0.57503471830025
Energy: 0.5927229565316744
Energy: 0.57503471830025
Energy: 0.5927229565316744
Energy: 0.57503471830025
Energy: 0.5835194324951098
Energy: 0.5964135251153891
Energy: 0.5835194324951098
Energy: 0.5964135251153891
Energy: 0.5835194324951098
Energy: 0.5964135251153891
Energy: 0.574000235086224
Energy: 0.575180332300585
Energy: 0.574000235086224
Energy: 0.575180332300585
Energy: 0.574000235086224
Energy: 0.575180332300585
Energy: 0.6070169977035156
Energy: 0.5848914735760005
Energy: 0.607016997704282
Energy: 0.5848914735760005
Energy: 0.6070169977035156
Energy: 0.5848914735760005
Energy: 0.602050458167218
Energy: 0.6040162882379763
Energy: 0.602050458167218
Energy: 0.6040162882379763
Energy: 0.602050458167218
Energy: 0.6040162882379763
Energy: 0.5759649967218603
Energy: 0.5672880730143345
Energy: 0.5759649967226266
Energy: 0.5672880730143345
Energy: 0.5759649967226266
Energy: 0.5672880730143345
Energy: 0.5998704715576271
Energy: 0.6141133187458369
Energy: 0.5998704715576271
Energy: 0.6141133187458369
Energy: 0.5998704715576271
Energy: 0.6141133187458369
Energy: 0.5304074771090487
Energy: 0.6012240707081539
Energy: 0.5304074771090487
Energy: 0.6012240707081539
Energy: 0.530407477109815
Energy: 0.6012240707081539
Energy: 0.623260120355124
Energy: 0.5766931267511024
Energy: 0.623260120355124
Energy: 0.5766931267511024
Energy: 0.623260120355124
Energy: 0.5766931267511024
Energy: 0.6166065558490421
Energy: 0.6378069910365858
Energy: 0.6166065558498085
Energy: 0.6378069910365858
Energy: 0.6166065558490421
Energy: 0.6378069910365858
Energy: 0.5707423710648977
Energy: 0.6013409176817096
Energy: 0.5707423710648977
Energy: 0.6013409176817096
Energy: 0.5707423710648977
Energy: 0.6013409176817096

minimum gb energy = 0.5304074771090487 eV
minimum distance =  2.37466963530975 Angstroms
sigma value = 33


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

Energy: 0.7068418330118421
Energy: 0.658581039443931
Energy: 0.7068418330118421
Energy: 0.658581039443931
Energy: 0.7068418330118421
Energy: 0.658581039443931
Energy: 0.6593033341726021
Energy: 0.6768088407398853
Energy: 0.6593033341726021
Energy: 0.6768088407398853
Energy: 0.6593033341726021
Energy: 0.6768088407403716
Energy: 0.6922253326114747
Energy: 0.6797098968664539
Energy: 0.6922253326114747
Energy: 0.6797098968659677
Energy: 0.6922253326114747
Energy: 0.6797098968664539
Energy: 0.6930494006005987
Energy: 0.6811388951995403
Energy: 0.6930494006005987
Energy: 0.6811388951995403
Energy: 0.6930494006005987
Energy: 0.6811388951995403
Energy: 0.6700523910445407
Energy: 0.6718778201552772
Energy: 0.6700523910445407
Energy: 0.6718778201552772
Energy: 0.6700523910445407
Energy: 0.6718778201552772
Energy: 0.7316530547668213
Energy: 0.7471955428202331
Energy: 0.7316530547668213
Energy: 0.7312710738202735
Energy: 0.7316530547668213
Energy: 0.7312710738202735
Energy: 0.6590573772765177
Energy: 0.6504171057093712
Energy: 0.6590573772765177
Energy: 0.6504171057093712
Energy: 0.6590573772765177
Energy: 0.6504171057093712
Energy: 0.7019035178147809
Energy: 0.697115621768903
Energy: 0.7019035178147809
Energy: 0.6971156217684168
Energy: 0.7019035178147809
Energy: 0.6971156217684168
Energy: 0.678749882094128
Energy: 0.7052789861118836
Energy: 0.678749882094128
Energy: 0.7052789861118836
Energy: 0.6787498820946142
Energy: 0.7052789861118836
Energy: 0.7030989175395317
Energy: 0.6876411798793488
Energy: 0.7030989175390455
Energy: 0.6501347894575024
Energy: 0.7030989175390455
Energy: 0.6862508600112367
Energy: 0.7021611507923026
Energy: 0.6766546371822378
Energy: 0.7021611507923026
Energy: 0.6766546371822378
Energy: 0.7021611507923026
Energy: 0.6766546371822378
Energy: 0.6590514662403294
Energy: 0.6672657098050899
Energy: 0.6590514662403294
Energy: 0.6672657098050899
Energy: 0.6590514662408156
Energy: 0.6672657098050899
Energy: 0.7021318183536144
Energy: 0.6619925941631853
Energy: 0.7021318183541004
Energy: 0.6619925941636715
Energy: 0.7021318183536144
Energy: 0.6619925941636715
Energy: 0.6640689082980772
Energy: 0.6827884465996867
Energy: 0.6640689082980772
Energy: 0.6827884465996867
Energy: 0.6640689082980772
Energy: 0.6827884465992007
Energy: 0.6808865700493979
Energy: 0.6725726657579452
Energy: 0.6808865700493979
Energy: 0.6725726657584313
Energy: 0.6808865700493979
Energy: 0.6725726657579452
Energy: 0.6937053963191083
Energy: 0.6973118854616764
Energy: 0.6937053963186222
Energy: 0.6973118854616764
Energy: 0.6937053963191083
Energy: 0.6973118854611903
Energy: 0.6306220183564761
Energy: 0.6807275971923579
Energy: 0.6306220183564761
Energy: 0.6807275971923579
Energy: 0.63062201835599
Energy: 0.6807275971923579
Energy: 0.7135312800634267
Energy: 0.7232363349025707
Energy: 0.7135312800634267
Energy: 0.7232363349020845
Energy: 0.7135312800639129
Energy: 0.7232363349025707
Energy: 0.649640712840354
Energy: 0.7030252723439175
Energy: 0.649640712840354
Energy: 0.7030252723439175
Energy: 0.649640712840354
Energy: 0.7030252723439175
Energy: 0.6711130378790552
Energy: 0.6800325627512025
Energy: 0.671113037878569
Energy: 0.6800325627512025
Energy: 0.6711130378790552
Energy: 0.6800325627512025
Energy: 0.6898235751093952
Energy: 0.6993593256460396
Energy: 0.6898235751093952
Energy: 0.6993593256460396
Energy: 0.6898235751093952
Energy: 0.6993593256460396
Energy: 0.6657155092507031
Energy: 0.6576081923415656
Energy: 0.6657155092511892
Energy: 0.6576081923415656
Energy: 0.6657155092507031
Energy: 0.6576081923420518
Energy: 0.6891654993093527
Energy: 0.6770816212591869
Energy: 0.6891654993093527
Energy: 0.6770816212591869
Energy: 0.6891654993088666
Energy: 0.6770816212591869
Energy: 0.7009741886473138
Energy: 0.6631934521691956
Energy: 0.7009741886473138
Energy: 0.6631934521691956
Energy: 0.7009741886473138
Energy: 0.6631934521691956
Energy: 0.6572583360054434
Energy: 0.6618824239427603
Energy: 0.6572583360054434
Energy: 0.6618824239427603
Energy: 0.6572583360054434
Energy: 0.6618824239427603
Energy: 0.6880891822640691
Energy: 0.6904313687870377
Energy: 0.6880891822640691
Energy: 0.6904313687870377
Energy: 0.6880891822640691
Energy: 0.6904313687870377
Energy: 0.6583424814306523
Energy: 0.6575389127680482
Energy: 0.6583424814306523
Energy: 0.6575389127680482
Energy: 0.6583424814306523
Energy: 0.6575389127680482
Energy: 0.6888379980688683
Energy: 0.7416495089213019
Energy: 0.6888379980693543
Energy: 0.7416495089213019
Energy: 0.6888379980688683
Energy: 0.7416495089213019
Energy: 0.665244519910454
Energy: 0.6752246353137877
Energy: 0.665244519910454
Energy: 0.6752246353137877
Energy: 0.6652445199099678
Energy: 0.6752246353137877
Energy: 0.6499891814130554
Energy: 0.6473616085515281
Energy: 0.6499891814130554
Energy: 0.6473616085515281
Energy: 0.6499891814130554
Energy: 0.6473616085515281
Energy: 0.7327392858917949
Energy: 0.7251326850739628
Energy: 0.7327392858917949
Energy: 0.7251326850739628
Energy: 0.7327392858917949
Energy: 0.7251326850739628
Energy: 0.6813331357342272
Energy: 0.6793448726442501
Energy: 0.6813331357342272
Energy: 0.6793448726442501
Energy: 0.6813331357342272
Energy: 0.6793448726447363
Energy: 0.6941233614963599
Energy: 0.6956736268952722
Energy: 0.6941233614963599
Energy: 0.6956736268952722
Energy: 0.6941233614963599
Energy: 0.6956736268957583
Energy: 0.6772654412190463
Energy: 0.6729035127469892
Energy: 0.6772654412190463
Energy: 0.6729035127469892
Energy: 0.6772654412190463
Energy: 0.6729035127469892
Energy: 0.662305659187764
Energy: 0.6802583495364256
Energy: 0.662305659187764
Energy: 0.6802583495364256
Energy: 0.662305659187764
Energy: 0.6802583495364256
Energy: 0.6932907920119987
Energy: 0.6605390451325436
Energy: 0.6932907920124848
Energy: 0.6605390451325436
Energy: 0.6932907920124848
Energy: 0.6605390451325436
Energy: 0.6609694091366313
Energy: 0.6702976902181722
Energy: 0.6609694091371174
Energy: 0.6702976902181722
Energy: 0.6609694091371174
Energy: 0.6702976902181722

minimum gb energy = 0.63062201835599 eV
minimum distance =  2.35412823096092 Angstroms
sigma value = 41


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

Energy: 0.8289294087476925
Energy: 0.8065023171257372
Energy: 0.8289294087476925
Energy: 0.8065023171257372
Energy: 0.8289294087476925
Energy: 0.8065023171257372
Energy: 0.7836367295476895
Energy: 0.8028621443821388
Energy: 0.7836367295476895
Energy: 0.8028621443821388
Energy: 0.7836367295476895
Energy: 0.8028621443821388
Energy: 0.9031018008136414
Energy: 0.7996637660156253
Energy: 0.8653030668726087
Energy: 0.7996637660156253
Energy: 0.8653030668726087
Energy: 0.7996637660156253
Energy: 0.8227536687055763
Energy: 0.839694684268987
Energy: 0.8227536687055763
Energy: 0.839694684268987
Energy: 0.8227536687055763
Energy: 0.839694684268987
Energy: 0.7780230788799309
Energy: 0.7975139983550597
Energy: 0.7780230788799309
Energy: 0.7975139983550597
Energy: 0.7780230788799309
Energy: 0.7975139983550597
Energy: 0.8935358835261471
Energy: 0.8595864680623522
Energy: 0.8935358835261471
Energy: 0.8595864680623522
Energy: 0.8935358835261471
Energy: 0.8595864680623522
Energy: 0.8215038571462401
Energy: 0.7681443619261936
Energy: 0.8215038571462401
Energy: 0.7681443619261936
Energy: 0.8215038571462401
Energy: 0.7681443619261936
Energy: 0.829835345156746
Energy: 0.8038863548339373
Energy: 0.829835345156746
Energy: 0.8038863548339373
Energy: 0.829835345156746
Energy: 0.8038863548339373
Energy: 0.7268805474837343
Energy: 0.7846365364179468
Energy: 0.7268805474837343
Energy: 0.7846365364179468
Energy: 0.7268805474837343
Energy: 0.7846365364179468
Energy: 0.8228504958998094
Energy: 0.8125366942533974
Energy: 0.8228504958998094
Energy: 0.8125366942521002
Energy: 0.8228504958998094
Energy: 0.8125366942521002
Energy: 0.7822217894000455
Energy: 0.8001187413994479
Energy: 0.7822217894013728
Energy: 0.8001187413994479
Energy: 0.7822217894000455
Energy: 0.8001187413994479
Energy: 0.8211867499469162
Energy: 0.8026434185827389
Energy: 0.8211867499469162
Energy: 0.8026434185827389
Energy: 0.8211867499469162
Energy: 0.8026434185827389
Energy: 0.8336526574111603
Energy: 0.8397333380323174
Energy: 0.8336526574111603
Energy: 0.8397333380323174
Energy: 0.8336526574111603
Energy: 0.8397333380323174
Energy: 0.7832371593666667
Energy: 0.8038010209158702
Energy: 0.7832371593666667
Energy: 0.8038010209158702
Energy: 0.7832371593666667
Energy: 0.8038010209158702

minimum gb energy = 0.7268805474837343 eV
minimum distance =  2.33601112291236 Angstroms
sigma value = 11


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

Energy: 0.9873485495156914
Energy: 0.9518628053963691
Energy: 0.9873485495156914
Energy: 0.9518628053963691
Energy: 0.9873485495156914
Energy: 0.9518628053963691
Energy: 0.8684674009243918
Energy: 0.91282601876855
Energy: 0.8684674009243918
Energy: 0.91282601876855
Energy: 0.8684674009243918
Energy: 0.91282601876855
Energy: 0.9665093258099736
Energy: 0.9175862656830567
Energy: 0.9665093258099736
Energy: 0.9175862656830567
Energy: 0.925175165570501
Energy: 0.9175862656830567
Energy: 0.9155565181830023
Energy: 0.8759200537069153
Energy: 0.9155565181830023
Energy: 0.8759200537069153
Energy: 0.9155565181830023
Energy: 0.8759200537069153
Energy: 0.9319763767805952
Energy: 0.9130682038431067
Energy: 0.9319763767805952
Energy: 0.9130682038436898
Energy: 0.9319763767805952
Energy: 0.9130682038436898
Energy: 0.8913279885779616
Energy: 0.9393613322582173
Energy: 0.8913279885779616
Energy: 0.9393613322582173
Energy: 0.8913279885779616
Energy: 0.9393613322582173
Energy: 0.9120542722043004
Energy: 0.8978919950646126
Energy: 0.9120542722043004
Energy: 0.8978919950646126
Energy: 0.9120542722043004
Energy: 0.8978919950646126
Energy: 0.9077476810273597
Energy: 0.907224009052
Energy: 0.9077476810273597
Energy: 0.907224009052
Energy: 0.9077476810273597
Energy: 0.907224009052
Energy: 0.9212846483102175
Energy: 0.899783638365491
Energy: 0.9212846483102175
Energy: 0.899783638365491
Energy: 0.9212846483102175
Energy: 0.899783638365491
Energy: 0.9100095540394798
Energy: 0.9223962249532338
Energy: 0.9100095540394798
Energy: 0.9223962249532338
Energy: 0.9100095540394798
Energy: 0.9223962249538171
Energy: 0.9046197345415258
Energy: 0.9096329439306754
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Energy: 0.9096329439306754
Energy: 0.9046197345415258
Energy: 0.9096329439306754
Energy: 0.9241245631697907
Energy: 0.9216522158821203
Energy: 0.9241245631697907
Energy: 0.9216522158821203
Energy: 0.9241245631697907
Energy: 0.9216522158821203
Energy: 0.9165653156669995
Energy: 0.9011919250761707
Energy: 0.9165653156669995
Energy: 0.9011919250761707
Energy: 0.9165653156664163
Energy: 0.9011919250761707
Energy: 0.9177571632079357
Energy: 0.9074655542893558
Energy: 0.9177571632079357
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Energy: 0.9074655542893558
Energy: 0.8989754585480918
Energy: 0.9071235847006583
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Energy: 0.9071235847006583
Energy: 0.8989754585480918
Energy: 0.9071235847006583
Energy: 0.9131806278379722
Energy: 0.8977886740527244
Energy: 0.9131806278379722
Energy: 0.8977886740527244
Energy: 0.9131806278379722
Energy: 0.8977886740527244
Energy: 0.8848940935851499
Energy: 0.9074275916898973
Energy: 0.8848940935851499
Energy: 0.9074275916898973
Energy: 0.8848940935851499
Energy: 0.9074275916898973
Energy: 0.9476782408039078
Energy: 0.9316171145862048
Energy: 0.9476782408039078
Energy: 0.9316171145862048
Energy: 0.9476782408039078
Energy: 0.9316171145862048
Energy: 0.8957542863044449
Energy: 0.8561674400550644
Energy: 0.8957542863038617
Energy: 0.8561674400550644
Energy: 0.8957542863044449
Energy: 0.8561674400550644
Energy: 0.9012378168193252
Energy: 0.9075941504095515
Energy: 0.9012378168193252
Energy: 0.9075941504095515
Energy: 0.9012378168193252
Energy: 0.9075941504095515
Energy: 0.8817539127710762
Energy: 0.892459305161412
Energy: 0.8817539127710762
Energy: 0.892459305161412
Energy: 0.8817539127710762
Energy: 0.892459305161412
Energy: 0.9197240496852594
Energy: 0.9413777490059178
Energy: 0.9197240496846762
Energy: 0.9413777490059178
Energy: 0.9197240496852594
Energy: 0.9413777490059178
Energy: 0.9116928586977955
Energy: 0.9180337919907895
Energy: 0.9116928586977955
Energy: 0.9180337919907895
Energy: 0.9116928586983787
Energy: 0.9180337919902064
Energy: 0.9450547586037725
Energy: 0.9144115614853976
Energy: 0.9450547586037725
Energy: 0.9144115614853976
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Energy: 0.9144115614853976
Energy: 0.9102017677379881
Energy: 0.9037735410207018
Energy: 0.9102017677379881
Energy: 0.9037735410207018
Energy: 0.9102017677379881
Energy: 0.9037735410207018
Energy: 0.8907713855046595
Energy: 0.909488504963804
Energy: 0.8907713855046595
Energy: 0.909488504963804
Energy: 0.8907713855046595
Energy: 0.909488504964387
Energy: 0.8907684177684279
Energy: 0.927860747837398
Energy: 0.8907684177684279
Energy: 0.927860747837398
Energy: 0.8907684177684279
Energy: 0.927860747837398
Energy: 0.9274575709824718
Energy: 0.8987637079958225
Energy: 0.9274575709824718
Energy: 0.8987637079958225
Energy: 0.9274575709824718
Energy: 0.8987637079958225
Energy: 0.9142034517368516
Energy: 0.9198905369994815
Energy: 0.9142034517368516
Energy: 0.9198905369994815
Energy: 0.9142034517368516
Energy: 0.9198905369994815
Energy: 0.8995137217146338
Energy: 0.8619031238650134
Energy: 0.8995137217140508
Energy: 0.8619031238650134
Energy: 0.8995137217146338
Energy: 0.8619031238650134
Energy: 0.9099309905719383
Energy: 0.9465029817470355
Energy: 0.9099309905719383
Energy: 0.9465029817470355
Energy: 0.9099309905719383
Energy: 0.9465029817470355

minimum gb energy = 0.8561674400550644 eV
minimum distance =  2.30725812983432 Angstroms
sigma value = 57


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

Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9263156495888962
Energy: 0.982086878435788
Energy: 0.9337040869165362
Energy: 0.9152959664097452
Energy: 0.9337040869154986
Energy: 0.9152959664097452
Energy: 0.9337040869144608
Energy: 0.9152959664097452
Energy: 0.885574061216826
Energy: 0.9436493371223424
Energy: 0.885574061216826
Energy: 0.8834178873369933
Energy: 0.885574061216826
Energy: 0.8834178873369933
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9263521149482538
Energy: 0.8622377550870794
Energy: 0.9263521149482538
Energy: 0.8622377550870794
Energy: 0.9263521149482538
Energy: 0.8622377550860418
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9337040869144608
Energy: 0.9152959664097452
Energy: 0.9337040869144608
Energy: 0.9152959664097452
Energy: 0.9337040869154986
Energy: 0.9152959664097452
Energy: 0.885574061216826
Energy: 0.9395537835738808
Energy: 0.885574061216826
Energy: 0.9395537835738808
Energy: 0.885574061216826
Energy: 0.9395537835738808
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9263521149482538
Energy: 0.9415900991787053
Energy: 0.9263521149482538
Energy: 0.9415900991787053
Energy: 0.9263521149482538
Energy: 0.9415900991787053
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.8857786189418381
Energy: 0.869723789045843
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9263156495878586
Energy: 0.982086878435788
Energy: 0.9337040869165362
Energy: 0.9152959664097452
Energy: 0.9337040869144608
Energy: 0.9152959664097452
Energy: 0.9337040869144608
Energy: 0.9152959664097452
Energy: 0.885574061216826
Energy: 0.9395537835738808
Energy: 0.885574061216826
Energy: 0.9395537835738808
Energy: 0.885574061216826
Energy: 0.9395537835738808
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9338860658362724
Energy: 0.9153101749123027
Energy: 0.9338860658362724
Energy: 0.9153101749123027

minimum gb energy = 0.8622377550860418 eV
minimum distance =  2.33606330670815 Angstroms
sigma value = 9


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

Energy: 0.9725404275381735
Energy: 0.908991272208512
Energy: 0.9725404275381735
Energy: 0.908991272208512
Energy: 0.9725404275381735
Energy: 0.908991272208512
Energy: 0.9375823605437343
Energy: 0.9078216769094459
Energy: 0.9375823605437343
Energy: 0.9078216769094459
Energy: 0.9375823605437343
Energy: 0.9078216769094459
Energy: 0.9315456188869928
Energy: 0.9371604847382182
Energy: 0.9315456188869928
Energy: 0.9371604847382182
Energy: 0.9315456188869928
Energy: 0.9371604847382182
Energy: 0.9178914428879555
Energy: 0.9872814916295597
Energy: 0.9178914428879555
Energy: 0.9872814916304069
Energy: 0.9178914428879555
Energy: 0.9872814916304069
Energy: 0.9332143116678141
Energy: 0.9454034600099221
Energy: 0.9332143116678141
Energy: 0.9454034600099221
Energy: 0.9332143116678141
Energy: 0.9454034600099221
Energy: 0.9399734981694802
Energy: 0.9462307013406325
Energy: 0.9399734981694802
Energy: 0.9462307013406325
Energy: 0.9399734981694802
Energy: 0.9462307013406325
Energy: 0.9318770338921315
Energy: 0.9427968448742691
Energy: 0.9318770338921315
Energy: 0.9427968448742691
Energy: 0.9318770338921315
Energy: 0.9427968448742691
Energy: 0.9237288716387241
Energy: 0.9619855630615283
Energy: 0.9237288716387241
Energy: 0.9619855630598337
Energy: 0.9237288716387241
Energy: 0.9619855630606808
Energy: 1.0011146095375578
Energy: 0.9088437120416631
Energy: 1.0011146095375578
Energy: 0.9088437120416631
Energy: 1.0011146095375578
Energy: 0.9088437120416631
Energy: 0.9367904408649295
Energy: 0.9250538420559663
Energy: 0.9367904408649295
Energy: 0.9250538420559663
Energy: 0.9367904408649295
Energy: 0.9250538420559663
Energy: 0.9211115297894401
Energy: 0.9348878960126037
Energy: 0.9211115297894401
Energy: 0.9348878960126037
Energy: 0.9211115297894401
Energy: 0.9348878960126037
Energy: 0.9781874307020998
Energy: 0.9450515759214215
Energy: 0.9781874307020998
Energy: 0.9450515759214215
Energy: 0.9781874307020998
Energy: 0.9450515759214215
Energy: 0.934139612605291
Energy: 0.9612711654292285
Energy: 0.9341396126061382
Energy: 0.9612711654292285
Energy: 0.934139612605291
Energy: 0.9612711654292285
Energy: 0.9343193296407015
Energy: 0.9262381652513616
Energy: 0.9343193296407015
Energy: 0.9262381652513616
Energy: 0.9343193296407015
Energy: 0.9262381652513616
Energy: 0.946234257644555
Energy: 0.9343054365392196
Energy: 0.946234257644555
Energy: 0.9343054365392196
Energy: 0.946234257644555
Energy: 0.9343054365392196
Energy: 0.9762192438530314
Energy: 0.9345250854871674
Energy: 0.9762192438530314
Energy: 0.9345250854880147
Energy: 0.9762192438530314
Energy: 0.9345250854871674
Energy: 0.9458865070037646
Energy: 0.9345609854185782
Energy: 0.9458865070037646
Energy: 0.9345609854185782
Energy: 0.9458865070037646
Energy: 0.9345609854185782
Energy: 1.0323982437177968
Energy: 0.9378156721457568
Energy: 1.0323982437177968
Energy: 0.9378156721457568
Energy: 1.0323982437177968
Energy: 0.9378156721457568
Energy: 0.9250152520119406
Energy: 0.9310117390717695
Energy: 0.9250152520110934
Energy: 0.9310117390717695
Energy: 0.9250152520110934
Energy: 0.9310117390717695
Energy: 0.9344481868695501
Energy: 0.9090284425287056
Energy: 0.9344481868695501
Energy: 0.9090284425287056
Energy: 0.9344481868695501
Energy: 0.9090284425287056
Energy: 0.981038949365311
Energy: 0.9532511995726619
Energy: 0.981038949365311
Energy: 0.9532511995726619
Energy: 0.981038949365311
Energy: 0.9532511995726619

minimum gb energy = 0.9078216769094459 eV
minimum distance =  2.31179365042998 Angstroms
sigma value = 27


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

Energy: 0.991358646873596
Energy: 0.8944905813290146
Energy: 0.991358646873596
Energy: 0.8944905813297287
Energy: 0.991358646873596
Energy: 0.8944905813290146
Energy: 0.9616460883582758
Energy: 0.9250084420068746
Energy: 0.9616460883582758
Energy: 0.9250084420068746
Energy: 0.9616460883582758
Energy: 0.9250084420068746
Energy: 0.8970023328401179
Energy: 0.9138669547441746
Energy: 0.8970023328401179
Energy: 0.9138669547434606
Energy: 0.8970023328401179
Energy: 0.9138669547434606
Energy: 0.8992130703165274
Energy: 0.8937249263500798
Energy: 0.8992130703165274
Energy: 0.8937249263500798
Energy: 0.8992130703165274
Energy: 0.8937249263500798
Energy: 0.8989729288093256
Energy: 0.9155332361824351
Energy: 0.8989729288093256
Energy: 0.9155332361824351
Energy: 0.8989729288093256
Energy: 0.9155332361824351
Energy: 0.9101793341556157
Energy: 0.9774983291929678
Energy: 0.9101793341556157
Energy: 0.9774983291929678
Energy: 0.9101793341556157
Energy: 0.9774983291929678
Energy: 0.8996139953217982
Energy: 0.924579736799027
Energy: 0.8996139953217982
Energy: 0.924579736799027
Energy: 0.8996139953217982
Energy: 0.924579736799027
Energy: 0.9216758319696124
Energy: 0.8967177005715951
Energy: 0.9216758319696124
Energy: 0.8967177005715951
Energy: 0.9216758319703265
Energy: 0.8967177005715951
Energy: 0.9025256574152879
Energy: 0.9224929517291393
Energy: 0.9025256574152879
Energy: 0.9224929517291393
Energy: 0.9025256574152879
Energy: 0.9224929517291393
Energy: 0.9731447440860127
Energy: 0.8981610670537549
Energy: 0.9731447440860127
Energy: 0.8981610670537549
Energy: 0.9731447440860127
Energy: 0.8981610670537549
Energy: 0.9686632233932311
Energy: 0.9214035756749593
Energy: 0.9686632233932311
Energy: 0.9214035756749593
Energy: 0.9686632233932311
Energy: 0.9214035756749593
Energy: 0.9278714730452711
Energy: 0.9038349440360991
Energy: 0.9278714730459853
Energy: 0.9038349440360991
Energy: 0.9278714730459853
Energy: 0.9038349440360991
Energy: 0.9389452081977999
Energy: 0.9232456375444485
Energy: 0.9389452081977999
Energy: 0.9232456375451629
Energy: 0.9389452081977999
Energy: 0.9232456375444485
Energy: 0.918674603877445
Energy: 0.9041877897764588
Energy: 0.918674603877445
Energy: 0.9041877897764588
Energy: 0.9186746038767308
Energy: 0.9041877897764588
Energy: 0.9037750726173688
Energy: 0.9779874206729531
Energy: 0.9037750726173688
Energy: 0.9779874206729531
Energy: 0.9037750726173688
Energy: 0.9779874206729531
Energy: 0.9109888541171275
Energy: 0.915274600999681
Energy: 0.9109888541171275
Energy: 0.915274600999681
Energy: 0.9109888541171275
Energy: 0.915274600999681
Energy: 0.8996915964735073
Energy: 0.898632845834421
Energy: 0.8996915964727932
Energy: 0.898632845834421
Energy: 0.8996915964735073
Energy: 0.898632845834421
Energy: 0.8937151922591912
Energy: 0.9042800446705417
Energy: 0.8937151922591912
Energy: 0.9042800446705417
Energy: 0.8937151922591912
Energy: 0.9042800446705417
Energy: 0.8591437399148965
Energy: 0.8985965000574567
Energy: 0.8591437399148965
Energy: 0.8985965000574567
Energy: 0.8591437399148965
Energy: 0.8985965000574567
Energy: 0.9913586468743101
Energy: 0.8944905813290146
Energy: 0.9913586468743101
Energy: 0.8944905813290146
Energy: 0.9913586468743101
Energy: 0.8944905813290146
Energy: 0.9616460883582758
Energy: 0.9250084420068746
Energy: 0.9616460883582758
Energy: 0.9250084420068746
Energy: 0.9616460883582758
Energy: 0.9250084420068746
Energy: 0.8970023328401179
Energy: 0.9138669547434606
Energy: 0.8970023328401179
Energy: 0.9138669547434606
Energy: 0.8970023328401179
Energy: 0.9138669547434606
Energy: 0.8992130703165274
Energy: 0.8937249263507941
Energy: 0.8992130703165274
Energy: 0.8937249263507941
Energy: 0.8992130703165274
Energy: 0.8937249263507941
Energy: 0.8989729288086112
Energy: 0.9155332361824351
Energy: 0.8989729288093256
Energy: 0.9155332361824351
Energy: 0.8989729288093256
Energy: 0.9155332361824351
Energy: 0.9101793341556157
Energy: 0.9774983291929678
Energy: 0.9101793341556157
Energy: 0.9774983291929678
Energy: 0.9101793341556157
Energy: 0.9774983291929678

minimum gb energy = 0.8591437399148965 eV
minimum distance =  2.31233051810153 Angstroms
sigma value = 19


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

Energy: 0.9115385513283817
Energy: 0.907264063483241
Energy: 0.9115385513283817
Energy: 0.9072640634838575
Energy: 0.9115385513283817
Energy: 0.907264063483241
Energy: 0.9005722626611367
Energy: 0.8924524748180304
Energy: 0.9005722626611367
Energy: 0.8924524748180304
Energy: 0.9005722626611367
Energy: 0.8924524748180304
Energy: 0.9472517656622294
Energy: 0.8711311847651596
Energy: 0.9060468865308011
Energy: 0.8711311847651596
Energy: 0.9060468865308011
Energy: 0.8711311847651596
Energy: 0.8824904150662265
Energy: 0.8937753760142605
Energy: 0.8824904150662265
Energy: 0.8937753760142605
Energy: 0.8824904150662265
Energy: 0.8937753760142605
Energy: 0.9007369728761085
Energy: 0.9071405959022372
Energy: 0.9007369728761085
Energy: 0.9071405959022372
Energy: 0.9007369728761085
Energy: 0.9071405959022372
Energy: 0.8907028912519942
Energy: 0.8879802253786971
Energy: 0.8907028912519942
Energy: 0.8879802253786971
Energy: 0.8907028912519942
Energy: 0.8879802253786971
Energy: 0.8739564252789579
Energy: 0.9127298398082099
Energy: 0.8739564252789579
Energy: 0.9127298398082099
Energy: 0.8739564252789579
Energy: 0.9127298398082099
Energy: 0.8932900143467939
Energy: 0.9174693349352164
Energy: 0.8932900143467939
Energy: 0.9174693349352164
Energy: 0.8932900143467939
Energy: 0.9174693349352164
Energy: 0.9470251855233477
Energy: 0.870518076309334
Energy: 0.9470251855233477
Energy: 0.870518076309334
Energy: 0.9470251855233477
Energy: 0.870518076309334
Energy: 0.9102310443002172
Energy: 0.8955594245395689
Energy: 0.9102310443002172
Energy: 0.8955594245395689
Energy: 0.9102310443002172
Energy: 0.8955594245395689
Energy: 0.8727567382950533
Energy: 0.9168074904321083
Energy: 0.8727567382950533
Energy: 0.9168074904321083
Energy: 0.8727567382956698
Energy: 0.9168074904321083
Energy: 0.9038457125116387
Energy: 0.8696838888805003
Energy: 0.9038457125116387
Energy: 0.8696838888805003
Energy: 0.9038457125116387
Energy: 0.8696838888805003
Energy: 0.8959185389680951
Energy: 0.8928810540228513
Energy: 0.8959185389680951
Energy: 0.8928810540228513
Energy: 0.8959185389680951
Energy: 0.8928810540228513
Energy: 0.8842515724992568
Energy: 0.8934294365536647
Energy: 0.8842515724986404
Energy: 0.8934294365530763
Energy: 0.8842515724992568
Energy: 0.8934294365530763
Energy: 0.9155578756631092
Energy: 0.8759923171698201
Energy: 0.9155578756631092
Energy: 0.8759923171698201
Energy: 0.9155578756631092
Energy: 0.8759923171698201
Energy: 0.9069431334685956
Energy: 0.8716162670654434
Energy: 0.9069431334685956
Energy: 0.8716162670654434
Energy: 0.9069431334685956
Energy: 0.8716162670654434
Energy: 0.8819500684325674
Energy: 0.9000061355849169
Energy: 0.8819500684325674
Energy: 0.9000061355843004
Energy: 0.8819500684319509
Energy: 0.9000061355849169
Energy: 0.9121451541283172
Energy: 0.910617960440981
Energy: 0.9121451541283172
Energy: 0.910617960440981
Energy: 0.9121451541283172
Energy: 0.910617960440981
Energy: 0.8900401038014084
Energy: 0.8855566431800687
Energy: 0.8900401038014084
Energy: 0.8855566431800687
Energy: 0.8900401038020248
Energy: 0.885556643180685
Energy: 0.8862547437570116
Energy: 0.9033025580097034
Energy: 0.8862547437570116
Energy: 0.9033025580097034
Energy: 0.8862547437570116
Energy: 0.9033025580097034
Energy: 0.8733692760671793
Energy: 0.9170586370525632
Energy: 0.8733692760671793
Energy: 0.9170586370525632
Energy: 0.8733692760677958
Energy: 0.9170586370525632
Energy: 0.9484801767397849
Energy: 0.8700110152141552
Energy: 0.9484801767397849
Energy: 0.8700110152147718
Energy: 0.9484801767397849
Energy: 0.8700110152147718
Energy: 0.9482697540688491
Energy: 0.900838653128012
Energy: 0.9482697540688491
Energy: 0.9008386531286285
Energy: 0.9482697540688491
Energy: 0.900838653128012
Energy: 0.9098537750441401
Energy: 0.9116451980128766
Energy: 0.9098537750447566
Energy: 0.9116451980122602
Energy: 0.9098537750441401
Energy: 0.9116451980128766
Energy: 0.8939229329010302
Energy: 0.8700985408380731
Energy: 0.8939229329016466
Energy: 0.8700985408380731
Energy: 0.8939229329016466
Energy: 0.8700985408380731
Energy: 0.9022569141939989
Energy: 0.8852396285085434
Energy: 0.9022569141939989
Energy: 0.8852396285085434
Energy: 0.9022569141939989
Energy: 0.8852396285085434
Energy: 0.8707620029319113
Energy: 0.8973427764779832
Energy: 0.8707620029319113
Energy: 0.8973427764779832
Energy: 0.8707620029319113
Energy: 0.8973427764779832
Energy: 0.9125573284461304
Energy: 0.8895067973110135
Energy: 0.9125573284461304
Energy: 0.8895067973110135
Energy: 0.9125573284461304
Energy: 0.8895067973110135
Energy: 0.9004231015004607
Energy: 0.889149353826396
Energy: 0.9004231015004607
Energy: 0.889149353826396
Energy: 0.9004231015004607
Energy: 0.889149353826396

minimum gb energy = 0.8696838888805003 eV
minimum distance =  2.30873029517271 Angstroms
sigma value = 101


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

Energy: 0.8599259431403566
Energy: 0.9017589798683502
Energy: 0.8599259431408984
Energy: 0.9017589798683502
Energy: 0.8599259431403566
Energy: 0.9017589798683502
Energy: 0.9015251676248561
Energy: 0.8693135096994075
Energy: 0.9015251676248561
Energy: 0.854692332401258
Energy: 0.9015251676248561
Energy: 0.854692332401258
Energy: 0.8753446357468582
Energy: 0.8308785498594075
Energy: 0.8753446357463162
Energy: 0.8308785498594075
Energy: 0.8753446357463162
Energy: 0.8308785498594075
Energy: 0.826203450628465
Energy: 0.9078669103671901
Energy: 0.826203450628465
Energy: 0.8758120932501571
Energy: 0.8262034506290069
Energy: 0.8758120932501571
Energy: 0.8565727607145659
Energy: 0.8557334909032152
Energy: 0.8565727607140239
Energy: 0.8557334909032152
Energy: 0.8565727607140239
Energy: 0.8557334909026731
Energy: 0.8690159628391118
Energy: 0.8305617025103579
Energy: 0.8690159628396538
Energy: 0.8305617025103579
Energy: 0.8690159628396538
Energy: 0.8305617025103579
Energy: 0.8532456123546123
Energy: 0.8806222391833628
Energy: 0.8532456123546123
Energy: 0.8806222391833628
Energy: 0.8532456123546123
Energy: 0.8806222391833628
Energy: 0.8238470816915516
Energy: 0.9140206531987256
Energy: 0.8238470816915516
Energy: 0.8828171434863183
Energy: 0.8238470816920936
Energy: 0.8828171434863183
Energy: 0.8702359948850231
Energy: 0.8314365624842847
Energy: 0.8702359948855651
Energy: 0.8314365624848264
Energy: 0.8702359948850231
Energy: 0.8314365624842847
Energy: 0.8570768815536299
Energy: 0.8803620883035019
Energy: 0.8570768815536299
Energy: 0.8973134035075604
Energy: 0.8570768815536299
Energy: 0.9121657503257278
Energy: 0.8216353494446538
Energy: 0.9696135082822543
Energy: 0.8216353494446538
Energy: 0.9696135082822543
Energy: 0.8216353494446538
Energy: 0.9696135082822543
Energy: 0.909581850996192
Energy: 0.8537999804625261
Energy: 0.909581850996192
Energy: 0.8537999804625261
Energy: 0.909581850996192
Energy: 0.8537999804625261
Energy: 0.8705623321632567
Energy: 0.830422017049562
Energy: 0.8705623321627148
Energy: 0.830422017049562
Energy: 0.8705623321627148
Energy: 0.830422017049562
Energy: 0.864001233515186
Energy: 0.9214340766093525
Energy: 0.864001233515186
Energy: 0.8982098006829653
Energy: 0.864001233515186
Energy: 0.8982098006829653
Energy: 0.9003807877806187
Energy: 0.8553276361160206
Energy: 0.9003807877806187
Energy: 0.8553276361154787
Energy: 0.9003807877806187
Energy: 0.8553276361154787
Energy: 0.8757558555574524
Energy: 0.829916657788662
Energy: 0.8757558555574524
Energy: 0.829916657788662
Energy: 0.8757558555574524
Energy: 0.829916657788662
Energy: 0.8200787815084175
Energy: 0.8909862159352486
Energy: 0.8200787815084175
Energy: 0.8909862159352486
Energy: 0.8200787815084175
Energy: 0.8909862159352486
Energy: 0.8227336001940874
Energy: 0.8795104854934789
Energy: 0.8227336001946293
Energy: 0.8795104854934789
Energy: 0.8227336001946293
Energy: 0.879510485492937
Energy: 0.8685078287023663
Energy: 0.8315957688000284
Energy: 0.8685078287023663
Energy: 0.8315957688000284
Energy: 0.8685078287029083
Energy: 0.8315957688000284
Energy: 0.839003350408032
Energy: 0.8901745241795526
Energy: 0.839003350408032
Energy: 0.8901745241795526
Energy: 0.83900335040749
Energy: 0.8901745241795526
Energy: 0.8218745204408129
Energy: 0.9694706396643796
Energy: 0.8218745204408129
Energy: 0.9694706396643796
Energy: 0.8218745204408129
Energy: 0.9694706396643796
Energy: 0.8987420914863532
Energy: 0.8265749289222888
Energy: 0.8987420914863532
Energy: 0.8265749289222888
Energy: 0.8987420914863532
Energy: 0.8265749289222888
Energy: 0.8981441528690843
Energy: 0.8293721960607665
Energy: 0.8981441528690843
Energy: 0.8293721960607665
Energy: 0.8981441528690843
Energy: 0.8293721960602245
Energy: 0.8260820115500294
Energy: 0.8962282448070701
Energy: 0.8260820115505711
Energy: 0.896228244807612
Energy: 0.8260820115500294
Energy: 0.896228244807612
Energy: 0.9110862137282688
Energy: 0.8562103223519583
Energy: 0.9110862137282688
Energy: 0.8562103223519583
Energy: 0.9110862137282688
Energy: 0.8562103223525003
Energy: 0.8728109755758098
Energy: 0.8304108980363386
Energy: 0.8728109755747259
Energy: 0.8304108980363386
Energy: 0.8728109755758098
Energy: 0.8304108980363386
Energy: 0.8595962081204281
Energy: 0.8819598707352344
Energy: 0.8595962081204281
Energy: 0.8819598707352344
Energy: 0.8595962081204281
Energy: 0.8819598707352344
Energy: 0.8598328248036925
Energy: 0.8824318351981839
Energy: 0.8598328248042344
Energy: 0.882431835197642
Energy: 0.8598328248042344
Energy: 0.8824318351981839
Energy: 0.8938807649562626
Energy: 0.8400860761753636
Energy: 0.8938807649562626
Energy: 0.8400860761753636
Energy: 0.8938807649562626
Energy: 0.8400860761753636
Energy: 0.8192482878908083
Energy: 0.8912917333484472
Energy: 0.8192482878908083
Energy: 0.8912917333484472
Energy: 0.8192482878908083
Energy: 0.8912917333484472
Energy: 0.8204035087923635
Energy: 0.8665827758157258
Energy: 0.8204035087918214
Energy: 0.8665827758157258
Energy: 0.8204035087923635
Energy: 0.8665827758157258
Energy: 0.8984168692730988
Energy: 0.8265541322607116
Energy: 0.8984168692730988
Energy: 0.8265541322607116
Energy: 0.8984168692730988
Energy: 0.8265541322607116
Energy: 0.9034068230183055
Energy: 0.825776692177606
Energy: 0.9034068230183055
Energy: 0.825776692177606
Energy: 0.9034068230183055
Energy: 0.825776692177606

minimum gb energy = 0.8192482878908083 eV
minimum distance =  2.32652144333843 Angstroms
sigma value = 33


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

Energy: 0.015639650043538067
Energy: 0.6360201085339926
Energy: 0.015639650043538067
Energy: 0.6360201085335674
Energy: 0.015639650043538067
Energy: 0.6360201085335674
Energy: 0.01629068069437559
Energy: 0.24512780837890888
Energy: 0.01629068069437559
Energy: 0.24512780837890888
Energy: 0.01629068069482583
Energy: 0.24512780837890888
Energy: 0.6367704203982754
Energy: 0.24554261707317285
Energy: 0.6367699172451169
Energy: 0.24554261707359806
Energy: 0.6367721898714871
Energy: 0.24554261707359806
Energy: 0.01629068069437559
Energy: 0.24512780837890888
Energy: 0.01629068069437559
Energy: 0.24512780837890888
Energy: 0.01629068069482583
Energy: 0.24512780837890888

minimum gb energy = 0.015639650043538067 eV
minimum distance =  2.52417281412616 Angstroms
sigma value = 1