Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_Al__MO_315820974149_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.360254209517775
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010374194207447363
Energy: 0.011194456962620027
Energy: 0.683992470167552
Energy: 0.011194456962620027
Energy: 0.011194456962620027
Energy: 0.5525468412679622
Energy: 0.011194456962620027
Energy: 0.5525468412679622
Energy: 0.6839924701670802
Energy: 0.011194456962620027
Energy: 0.010374194207447363
Energy: 0.011194456962620027
Energy: 0.011194456962620027
Energy: 0.5525468412679622
Energy: 0.011194456962620027
Energy: 0.5525468412679622

minimum gb energy = 0.010374194207447363 eV
minimum distance =  2.67558151334819 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 0.6485156530266022
Energy: 0.6248199842945364
Energy: 0.6873404561154176
Energy: 0.6248199842945364
Energy: 0.6222944931708609
Energy: 0.6410712689989991
Energy: 0.6236406160742962
Energy: 0.6410712689983932
Energy: 0.6056670818359373
Energy: 0.6165916656481991
Energy: 0.6334254007381794
Energy: 0.6165916656481991
Energy: 0.6221022563048791
Energy: 0.643829009202362
Energy: 0.6051121395579849
Energy: 0.6438290092017558
Energy: 0.6260056303835199
Energy: 0.6309738390702524
Energy: 0.616013501374142
Energy: 0.6309738390708584
Energy: 0.5944605685198924
Energy: 0.7009714194836311
Energy: 0.5825115772081398
Energy: 0.7009714194836311
Energy: 0.6225889646447927
Energy: 0.6216503250963015
Energy: 0.59585845080545
Energy: 0.6216503250963015
Energy: 0.5614366318376872
Energy: 0.6290874306417211
Energy: 0.5841007821435268
Energy: 0.6290874306417211
Energy: 0.6055472093768351
Energy: 0.7899141613447297
Energy: 0.618882296853642
Energy: 0.7899141613447297
Energy: 0.5880408863205422
Energy: 0.6161307489773106
Energy: 0.5619043286323762
Energy: 0.6161307489773106
Energy: 0.621496810730841
Energy: 0.6436825493776989
Energy: 0.6052435537817771
Energy: 0.6436825493776989
Energy: 0.6324813720480016
Energy: 0.6289862810207086
Energy: 0.5923236859647881
Energy: 0.6289862810213147
Energy: 0.6221178087205541
Energy: 0.6145418629342065
Energy: 0.6227900694924572
Energy: 0.6145418629342065
Energy: 0.6305611380729329
Energy: 0.6458963351255015
Energy: 0.6021835015100763
Energy: 0.6458963351248954
Energy: 0.6446905403458845
Energy: 0.6331944215553644
Energy: 0.6220273684683755
Energy: 0.6331944215559703
Energy: 0.6407789764440595
Energy: 0.6268146364944169
Energy: 0.6304886360356484
Energy: 0.6268146364944169
Energy: 0.6335632178902603
Energy: 0.6163746750840667
Energy: 0.5912681294155162
Energy: 0.6163746750834606
Energy: 0.6237225930628036
Energy: 0.6147692767748637
Energy: 0.6221001518413389
Energy: 0.6147692767748637
Energy: 0.5767855623587603
Energy: 0.6276937063333722
Energy: 0.5971520195127447
Energy: 0.6276937063333722
Energy: 0.6236078331386536
Energy: 0.7694040687099062
Energy: 0.6073072287211587
Energy: 0.7694040687099062
Energy: 0.5816719897987218
Energy: 0.6163252313469513
Energy: 0.5609385117696131
Energy: 0.6163252313463453
Energy: 0.605073953796622
Energy: 0.6979330708903315
Energy: 0.6351302469298743
Energy: 0.6979330708909375
Energy: 0.6788513001349623
Energy: 0.6312084401096733
Energy: 0.6031091189747531
Energy: 0.6312084401096733
Energy: 0.6169924227827941
Energy: 0.6171111535017827
Energy: 0.5945779983163536
Energy: 0.6171111535017827
Energy: 0.59541811437897
Energy: 0.698348731338595
Energy: 0.7011603487973892
Energy: 0.698348731338595
Energy: 0.627738130622942
Energy: 0.6292083374994523
Energy: 0.6073514873426548
Energy: 0.6292083374994523
Energy: 0.6211678492123263
Energy: 0.7158078468166532
Energy: 0.6056499179874393
Energy: 0.7158078468166532
Energy: 0.6075584910522634
Energy: 0.6143864924318794
Energy: 0.6356627657410957
Energy: 0.6143864924318794
Energy: 0.6224405702729837
Energy: 0.6488761374341385
Energy: 0.6212224288112996
Energy: 0.6488761374341385
Energy: 0.6470385583210122
Energy: 0.6257564663012267
Energy: 0.6337241912142325
Energy: 0.6257564663012267
Energy: 0.6228488405946319
Energy: 0.6498670276674304
Energy: 0.6218835819628441
Energy: 0.6498670276674304
Energy: 0.6254286044817351
Energy: 0.6189262347588406
Energy: 0.6306438334878678
Energy: 0.6189262347588406
Energy: 0.6256450911484729
Energy: 0.6413217621718168
Energy: 0.6064461290308072
Energy: 0.6413217621718168

minimum gb energy = 0.5609385117696131 eV
minimum distance =  2.53577146731026 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 0.6805304039321091
Energy: 0.7139428655489682
Energy: 0.6892303378691114
Energy: 0.7139428655503502
Energy: 0.6487742246143577
Energy: 0.6946165275093116
Energy: 0.6468932394859392
Energy: 0.6946165275093116
Energy: 0.6337743241170121
Energy: 0.6707935689959454
Energy: 0.6654664834687208
Energy: 0.6707935689952544
Energy: 0.6101355036598962
Energy: 0.6764249770605117
Energy: 0.6127609596282759
Energy: 0.6764249770612027
Energy: 0.6099148411632118
Energy: 0.6587449222379832
Energy: 0.6437122474695881
Energy: 0.6587449222379832
Energy: 0.6639491793807148
Energy: 0.6585429458279143
Energy: 0.7193946977631143
Energy: 0.6585429458292964
Energy: 0.6097866535653936
Energy: 0.709351636008492
Energy: 0.6167113780431212
Energy: 0.709351636007801
Energy: 0.5823815067675767
Energy: 0.6702551081972155
Energy: 0.6089057187527287
Energy: 0.6702551081985975
Energy: 0.6093758464494363
Energy: 0.7997237462699824
Energy: 0.6470737873615867
Energy: 0.7997237462692915
Energy: 0.6218874839814589
Energy: 0.6721648035643186
Energy: 0.627442814822052
Energy: 0.6721648035629366
Energy: 0.619304435219931
Energy: 0.6614180853739275
Energy: 0.6422966807490172
Energy: 0.6614180853725458
Energy: 0.5967935293146408
Energy: 0.7084556782047635
Energy: 0.6546246764639515
Energy: 0.7084556782047635
Energy: 0.6571388958435576
Energy: 0.6541899884928251
Energy: 0.6309536737971815
Energy: 0.6541899884921342
Energy: 0.6569572644423973
Energy: 0.6540351281245738
Energy: 0.6371461739202199
Energy: 0.6540351281231919
Energy: 0.5966340566599633
Energy: 0.6877171418289842
Energy: 0.6656892661699754
Energy: 0.6877171418282932
Energy: 0.619243117611041
Energy: 0.6613451070000859
Energy: 0.6469299904139297
Energy: 0.661345106998704
Energy: 0.6218720476860266
Energy: 0.671954397729877
Energy: 0.6024809346710595
Energy: 0.6719543977284951
Energy: 0.609289499139594
Energy: 0.7997295905482121
Energy: 0.6470823773726149
Energy: 0.799729590547521
Energy: 0.5823823167756482
Energy: 0.6700094476037529
Energy: 0.6107770124386376
Energy: 0.6700094476030618
Energy: 0.6486803545600348
Energy: 0.7094122312585281
Energy: 0.6124774596027971
Energy: 0.7094122312571461
Energy: 0.6639233545693188
Energy: 0.6577960486094968
Energy: 0.6114617379799473
Energy: 0.6577960486101878
Energy: 0.6099943515806878
Energy: 0.6588161417327814
Energy: 0.6305067872237412
Energy: 0.6588161417327814
Energy: 0.6101357666635521
Energy: 0.6762840397868726
Energy: 0.6163455246568798
Energy: 0.6762840397868726
Energy: 0.6337974077038011
Energy: 0.6708766752215137
Energy: 0.6655221826422326
Energy: 0.6708766752215137
Energy: 0.648843413915994
Energy: 0.6945141896086383
Energy: 0.6470970547389444
Energy: 0.6945141896093293
Energy: 0.6805304039321091
Energy: 0.7139428655489682
Energy: 0.7114814333098689
Energy: 0.7139428655503502
Energy: 0.6487742246143577
Energy: 0.6946165275086205
Energy: 0.6468932394859392
Energy: 0.6946165275100025
Energy: 0.6337743241170121
Energy: 0.6707935689959454
Energy: 0.638939355772391
Energy: 0.6707935689945634
Energy: 0.6101355036598962
Energy: 0.6764249770598209
Energy: 0.6127609596282759
Energy: 0.6764249770605117

minimum gb energy = 0.5823815067675767 eV
minimum distance =  2.51530308841048 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 0.6531668286520341
Energy: 0.6954084390297369
Energy: 0.7838394522435373
Energy: 0.6954084390297369
Energy: 0.6359904310671266
Energy: 0.7106393592159145
Energy: 0.6349354972998092
Energy: 0.7106393592159145
Energy: 0.6632817334675403
Energy: 0.7435631451516667
Energy: 0.6347965519142571
Energy: 0.7435631451516667
Energy: 0.6383059961116211
Energy: 0.7301236531369774
Energy: 0.6329687961575461
Energy: 0.7301236531369774
Energy: 0.6342099753881661
Energy: 0.7008579156351515
Energy: 0.6320600038094644
Energy: 0.7008579156351515
Energy: 0.697149792832441
Energy: 0.7444572690121112
Energy: 0.7423273410705351
Energy: 0.7444572690121112
Energy: 0.6476697856992385
Energy: 0.7274358615276415
Energy: 0.6379443651797676
Energy: 0.7274358615276415
Energy: 0.7664129116019309
Energy: 0.696674629269613
Energy: 0.6056910911025009
Energy: 0.696674629269613
Energy: 0.6482998577820361
Energy: 0.6710198356792808
Energy: 0.6476444808416325
Energy: 0.6710198356792808
Energy: 0.6368067058371363
Energy: 0.7217365622715275
Energy: 0.618943592760594
Energy: 0.7217365622715275
Energy: 0.637635040209087
Energy: 0.6942617091186374
Energy: 0.6351810545109926
Energy: 0.6942617091186374
Energy: 0.6326775894611925
Energy: 0.6952156442143982
Energy: 0.6347515253794395
Energy: 0.6952156442135948
Energy: 0.6346948276506299
Energy: 0.7051101153633789
Energy: 0.6197770079919193
Energy: 0.7051101153633789
Energy: 0.6482869903549694
Energy: 0.70664976254277
Energy: 0.6359398867567524
Energy: 0.70664976254277
Energy: 0.6292624071108807
Energy: 0.7019394080462252
Energy: 0.6043487998798318
Energy: 0.7019394080462252
Energy: 0.6355916007725884
Energy: 0.8387320127909625
Energy: 0.6243263076633571
Energy: 0.8387320127909625
Energy: 0.6069812435670975
Energy: 0.746485819685968
Energy: 0.6034524259393826
Energy: 0.746485819685968
Energy: 0.633235203996197
Energy: 0.6963196989731996
Energy: 0.638701546890947
Energy: 0.6963196989731996
Energy: 0.6194886412498357
Energy: 0.7294262311758396
Energy: 0.6337293662922306
Energy: 0.7294262311758396
Energy: 0.6351413919658381
Energy: 0.7442656937296928
Energy: 0.6356643149158773
Energy: 0.7442656937296928
Energy: 0.6511878318716475
Energy: 0.7093909683479843
Energy: 0.6384652786535259
Energy: 0.7093909683471812
Energy: 0.6504318637683874
Energy: 0.7000629483307074
Energy: 0.7041418106853765
Energy: 0.7000629483307074
Energy: 0.6475248254939786
Energy: 0.685462730244717
Energy: 0.6350645929077328
Energy: 0.685462730244717
Energy: 0.6667469881917976
Energy: 0.7267425353286359
Energy: 0.6367329797093211
Energy: 0.7267425353286359
Energy: 0.6360562279907209
Energy: 0.8064447427666366
Energy: 0.6233180876661327
Energy: 0.8064447427666366

minimum gb energy = 0.6034524259393826 eV
minimum distance =  2.54533082484749 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 0.7026341215466333
Energy: 0.7656586994744741
Energy: 0.8500866236803173
Energy: 0.7656586994744741
Energy: 0.6536480794742979
Energy: 0.7267908227748605
Energy: 0.6628632335396116
Energy: 0.7267908227748605
Energy: 0.6211394465532876
Energy: 0.7410002657093111
Energy: 0.6631762374945492
Energy: 0.7410002657093111
Energy: 0.7247347940817613
Energy: 0.7995429384806404
Energy: 0.6309460015835603
Energy: 0.7995429384806404
Energy: 0.7051741461960556
Energy: 0.7028014980287226
Energy: 0.6635864596593143
Energy: 0.7028014980287226
Energy: 0.6360562263455892
Energy: 0.7590173913661334
Energy: 0.6250581018133162
Energy: 0.7590173913661334
Energy: 0.661773647681599
Energy: 0.6302504693757827
Energy: 0.6295297085758249
Energy: 0.6302504693767409
Energy: 0.6798459263592525
Energy: 0.7602609482580439
Energy: 0.6451207944624987
Energy: 0.7602609482590023
Energy: 0.6630464521266691
Energy: 0.7023874514210763
Energy: 0.6578538150812926
Energy: 0.7023874514210763
Energy: 0.6574439836001043
Energy: 0.7830920224067599
Energy: 0.6308602982785573
Energy: 0.7830920224067599
Energy: 0.6567257426377489
Energy: 0.7315887296561618
Energy: 0.6737972442338179
Energy: 0.7315887296561618
Energy: 0.6620049609019389
Energy: 0.7058875362057365
Energy: 0.66657308543073
Energy: 0.7058875362047784
Energy: 0.6361607922183684
Energy: 0.766930881378079
Energy: 0.6237068172379553
Energy: 0.7669308813771207
Energy: 0.6591230366987033
Energy: 0.751409406456869
Energy: 0.6636429368577382
Energy: 0.7514094064578273
Energy: 0.640919941476951
Energy: 0.7804620897146299
Energy: 0.6916984367630764
Energy: 0.7804620897146299
Energy: 0.7245172726311379
Energy: 0.7824243490986273
Energy: 0.6309016461068679
Energy: 0.7824243490986273
Energy: 0.6882266588799517
Energy: 0.7374906408618801
Energy: 0.6631511746084483
Energy: 0.7374906408618801
Energy: 0.6825126580027788
Energy: 0.7442594247447231
Energy: 0.6634028534249525
Energy: 0.7442594247447231
Energy: 0.6665137691684699
Energy: 0.7078340628949595
Energy: 0.6593586255805649
Energy: 0.7078340628959177
Energy: 0.7462779989968622
Energy: 0.7424118446674921
Energy: 0.6450591854106016
Energy: 0.7424118446674921
Energy: 0.6626458489642969
Energy: 0.7453966972469928
Energy: 0.6664950596748063
Energy: 0.7453966972469928

minimum gb energy = 0.6211394465532876 eV
minimum distance =  2.56888287601038 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 0.6308196301286252
Energy: 0.7340228220783389
Energy: 0.7771197521023004
Energy: 0.7340228220783389
Energy: 0.6209798678023843
Energy: 0.6903858774674391
Energy: 0.623189048695683
Energy: 0.6903858774674391
Energy: 0.6223361459869651
Energy: 0.7322200566679176
Energy: 0.6253624586418887
Energy: 0.7322200566691026
Energy: 0.6334757323598804
Energy: 0.7178250212528325
Energy: 0.7720305146390577
Energy: 0.7178250212528325
Energy: 0.7436621890271152
Energy: 0.695497820601893
Energy: 0.6618347017217605
Energy: 0.6954978206030781
Energy: 0.6219634443465966
Energy: 0.7575195934181227
Energy: 0.6233138263367178
Energy: 0.7575195934181227
Energy: 0.6504379970695433
Energy: 0.7089376635505373
Energy: 0.6225576322310401
Energy: 0.7089376635505373
Energy: 0.7807577209964375
Energy: 0.735216220237308
Energy: 0.6341501979044936
Energy: 0.735216220237308
Energy: 0.6252341344152734
Energy: 0.6905145752328857
Energy: 0.6229214615314916
Energy: 0.6905145752328857
Energy: 0.7719506913560212
Energy: 0.7080002916037085
Energy: 0.6219451221148864
Energy: 0.7080002916037085
Energy: 0.6915586135877365
Energy: 0.733644829065368
Energy: 0.8624609632683359
Energy: 0.733644829065368
Energy: 0.6228291764775606
Energy: 0.6383287551157654
Energy: 0.7469171839963078
Energy: 0.6383287551133953
Energy: 0.7769090694559724
Energy: 0.733848845910313
Energy: 0.6231699620660829
Energy: 0.733848845910313
Energy: 0.6853489153796835
Energy: 0.6964563868249646
Energy: 0.6332771086719156
Energy: 0.6964563868261495
Energy: 0.6239156670662398
Energy: 0.7479362829038874
Energy: 0.7400378856060252
Energy: 0.7479362829038874
Energy: 0.6254243184020588
Energy: 0.7054142326774162
Energy: 0.6219324195572793
Energy: 0.7054142326774162
Energy: 0.6238332300800098
Energy: 0.7353965393128283
Energy: 0.7451559772917303
Energy: 0.7353965393128283

minimum gb energy = 0.6209798678023843 eV
minimum distance =  2.58753454458873 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 0.7150310702585394
Energy: 0.7713922324788558
Energy: 0.9259380741449356
Energy: 0.7713922324788558
Energy: 0.7444528261796705
Energy: 0.6797787468172675
Energy: 0.6703923363150152
Energy: 0.6797787468172675
Energy: 0.7489284318358478
Energy: 0.7615944939295646
Energy: 0.646197183372444
Energy: 0.7615944939302356
Energy: 0.6423249633813456
Energy: 0.7829252117807406
Energy: 0.7356449953266703
Energy: 0.7829252117807406
Energy: 0.762215198497079
Energy: 0.7536560038291925
Energy: 0.649303565004086
Energy: 0.7536560038285213
Energy: 0.6439023314444132
Energy: 0.7543173564332638
Energy: 0.8890201189653432
Energy: 0.7543173564332638
Energy: 0.6418482053770751
Energy: 0.7167390491190252
Energy: 0.6689811195874613
Energy: 0.7167390491183542
Energy: 0.7509922282338497
Energy: 0.7683155878055776
Energy: 0.6448010983696876
Energy: 0.7683155878055776
Energy: 0.6461942070154194
Energy: 0.7460457172448681
Energy: 0.7687063333532764
Energy: 0.7460457172448681
Energy: 0.8169597710823219
Energy: 0.7285821275956966
Energy: 0.6435500569419588
Energy: 0.7285821275956966
Energy: 0.6411700752766641
Energy: 0.7631773455167294
Energy: 0.7424029141057522
Energy: 0.7631773455167294
Energy: 0.6449748337457092
Energy: 0.7160237818263977
Energy: 0.6593770423188334
Energy: 0.7160237818263977
Energy: 0.8632010364622897
Energy: 0.7639435405795061
Energy: 0.6916194036887331
Energy: 0.7639435405795061
Energy: 0.643707832655495
Energy: 0.7800263037403613
Energy: 0.7441190533191706
Energy: 0.7800263037403613
Energy: 0.7157119509532125
Energy: 0.7033122849477659
Energy: 0.6467536602510352
Energy: 0.7033122849484371
Energy: 0.7442073156040837
Energy: 0.7486959658446334
Energy: 0.7509153627990187
Energy: 0.7486959658446334
Energy: 0.6665455332885072
Energy: 0.7203841787184055
Energy: 0.8047324718995872
Energy: 0.7203841787184055
Energy: 0.8555864535304906
Energy: 0.7434180400689396
Energy: 0.6439880124066996
Energy: 0.7434180400696108
Energy: 0.6881552821985203
Energy: 0.7206946456446996
Energy: 0.7088540100090288
Energy: 0.7206946456446996
Energy: 0.6896217617310706
Energy: 0.7653874590483454
Energy: 0.6428748530938131
Energy: 0.7653874590483454
Energy: 0.7021511381689315
Energy: 0.764071966020907
Energy: 0.7486483238226161
Energy: 0.764071966020907
Energy: 0.6691383463086517
Energy: 0.7574252404794809
Energy: 0.8213289556337955
Energy: 0.7574252404794809
Energy: 0.7987925506645122
Energy: 0.7879164163268053
Energy: 0.6418106427680895
Energy: 0.7879164163268053
Energy: 0.690149555497543
Energy: 0.7035925879754237
Energy: 0.7516140168123103
Energy: 0.7035925879754237
Energy: 0.6884344629434296
Energy: 0.7794903030365561
Energy: 0.7307464179976401
Energy: 0.7794903030365561
Energy: 0.7978269174215892
Energy: 0.7829790320527477
Energy: 0.6428874492666933
Energy: 0.7829790320527477
Energy: 0.6492896328828456
Energy: 0.7633536962585938
Energy: 0.8434588192790462
Energy: 0.763353696259265
Energy: 0.7520002046226474
Energy: 0.7674816508606292
Energy: 0.7463668281568003
Energy: 0.7674816508606292
Energy: 0.7832320766751294
Energy: 0.807734272161212
Energy: 0.6417729004162348
Energy: 0.807734272161212
Energy: 0.6446146315836105
Energy: 0.7594345015138565
Energy: 0.8577308667214366
Energy: 0.7594345015138565

minimum gb energy = 0.6411700752766641 eV
minimum distance =  2.5133457992763 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 0.6029406817443685
Energy: 0.7481708775419555
Energy: 1.0067206565623743
Energy: 0.7481708775419555
Energy: 0.7481256418892352
Energy: 0.6682558539482566
Energy: 0.6833957171421464
Energy: 0.6682558539498017
Energy: 0.6034531558174151
Energy: 0.6785466177432302
Energy: 0.7780194598063163
Energy: 0.6785466177432302
Energy: 0.6034168822500228
Energy: 0.6034401952244995
Energy: 0.735521228832365
Energy: 0.6034401952244995
Energy: 0.7481022806386146
Energy: 0.6682716451907528
Energy: 0.7318521024406047
Energy: 0.6682716451892077
Energy: 0.6029406817443685
Energy: 0.7481708775419555
Energy: 0.8542195531494514
Energy: 0.7481708775419555
Energy: 0.7481269782930668
Energy: 0.6682558539482566
Energy: 0.7355015604174325
Energy: 0.6682558539482566
Energy: 0.6034531558019639
Energy: 0.6785466177432302
Energy: 0.7780194598233126
Energy: 0.6785466177432302
Energy: 0.6034168822809253
Energy: 0.6034401952244995
Energy: 0.6790038300118535
Energy: 0.6034401952244995
Energy: 0.7481074743117069
Energy: 0.6682716451892077
Energy: 0.7326495170182452
Energy: 0.6682716451892077
Energy: 0.6029406817443685
Energy: 0.7481708775419555
Energy: 0.9143461287275345
Energy: 0.7481708775419555
Energy: 0.7481256010989892
Energy: 0.6682558539482566
Energy: 0.7353161735294975
Energy: 0.6682558539482566
Energy: 0.6034531558035091
Energy: 0.6785466177432302
Energy: 0.7780194598449443
Energy: 0.6785466177432302

minimum gb energy = 0.6029406817443685 eV
minimum distance =  2.55367799794104 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 0.6899481574345878
Energy: 0.7597566595311633
Energy: 0.9382265498442476
Energy: 0.7597566595317353
Energy: 0.7947375328818923
Energy: 0.7119194482488403
Energy: 0.7057092568409252
Energy: 0.7119194482488403
Energy: 0.6546298427032736
Energy: 0.713700986915714
Energy: 0.6743104237504545
Energy: 0.713700986915714
Energy: 0.755699286431374
Energy: 0.7611495245173259
Energy: 0.6627941162966552
Energy: 0.7611495245167541
Energy: 0.8536647873183711
Energy: 0.7310817730987005
Energy: 0.6718448006738656
Energy: 0.7310817730987005
Energy: 0.6850463740696031
Energy: 0.7404038383391157
Energy: 0.8760271246159214
Energy: 0.7404038383391157
Energy: 0.8806088589145039
Energy: 0.7402766818880899
Energy: 0.6916675181760906
Energy: 0.7402766818880899
Energy: 0.6546909501064395
Energy: 0.7743447199581738
Energy: 0.7642352111449583
Energy: 0.7743447199581738
Energy: 0.656459779007256
Energy: 0.7746330149712184
Energy: 0.6869453801240304
Energy: 0.7746330149712184
Energy: 0.6546612621815528
Energy: 0.7305950221640761
Energy: 0.6700530835485704
Energy: 0.7305950221640761
Energy: 0.6562882227560727
Energy: 0.7627592068604713
Energy: 0.8726250766064076
Energy: 0.7627592068610431
Energy: 0.7933847845998093
Energy: 0.7846930499166402
Energy: 0.6594533594227922
Energy: 0.7846930499160683
Energy: 0.6570508454974424
Energy: 0.7607672789620744
Energy: 0.8084738104218869
Energy: 0.7607672789626462
Energy: 0.7426309055369806
Energy: 0.7744225537097876
Energy: 0.6897021750527169
Energy: 0.7744225537103595
Energy: 0.6558982187342816
Energy: 0.7576938468485024
Energy: 0.7455880469887639
Energy: 0.7576938468485024
Energy: 0.6595049516446945
Energy: 0.7750881411555768
Energy: 0.7648278339914266
Energy: 0.7750881411555768
Energy: 0.7039491378886217
Energy: 0.7227851539326967
Energy: 0.6563052901476101
Energy: 0.7227851539321248
Energy: 0.6584695541513218
Energy: 0.7579982008655928
Energy: 0.8746740681123523
Energy: 0.7579982008661645
Energy: 0.7648586747651569
Energy: 0.7475055631630004
Energy: 0.6854966741888093
Energy: 0.7475055631624284
Energy: 0.6591398144215275
Energy: 0.728708674683399
Energy: 0.7269521182059192
Energy: 0.7287086746839708
Energy: 0.7604439599361897
Energy: 0.7659865291569201
Energy: 0.7568270415873576
Energy: 0.7659865291569201
Energy: 0.7114310238517398
Energy: 0.7493632765180267
Energy: 0.655499655421777
Energy: 0.7493632765180267
Energy: 0.6868141286131267
Energy: 0.7522417569275883
Energy: 0.6582262427969248
Energy: 0.7522417569270166
Energy: 0.8636175892862878
Energy: 0.7546419108970313
Energy: 0.6543198823615164
Energy: 0.7546419108976031
Energy: 0.6759106776758332
Energy: 0.8258976744396415
Energy: 0.8504672641941455
Energy: 0.8258976744396415
Energy: 0.7163061301332809
Energy: 0.7530832186567851
Energy: 0.6554336279813431
Energy: 0.7530832186567851
Energy: 0.7259841440442074
Energy: 0.7513756902556439
Energy: 0.7449333325650569
Energy: 0.7513756902556439
Energy: 0.6873871485766968
Energy: 0.770251209779898
Energy: 0.7457171600259244
Energy: 0.7702512097804699
Energy: 0.7289970213250412
Energy: 0.7357126255242441
Energy: 0.6546986528663498
Energy: 0.7357126255236722
Energy: 0.7055608936450719
Energy: 0.9028985595469116
Energy: 0.8506288941769377
Energy: 0.9028985595474833
Energy: 0.8718771511312327
Energy: 0.7531679739252691
Energy: 0.6535985922429065
Energy: 0.7531679739252691
Energy: 0.6735993306836902
Energy: 0.7500858255748202
Energy: 0.6560547473003367
Energy: 0.7500858255748202
Energy: 0.6813893143516971
Energy: 0.7654221541249654
Energy: 0.6547576056291106
Energy: 0.7654221541255374
Energy: 0.7626201701753657
Energy: 0.7647622180060192
Energy: 0.7559877628325958
Energy: 0.764762218006591
Energy: 0.6743077063349634
Energy: 0.7669746306935572
Energy: 0.876830372214211
Energy: 0.7669746306935572

minimum gb energy = 0.6535985922429065 eV
minimum distance =  2.51579014711428 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 0.7602955034040456
Energy: 0.7544860118839357
Energy: 0.89919790871983
Energy: 0.7544860118839357
Energy: 0.6605760944598515
Energy: 0.8265867258800117
Energy: 0.6855307148394425
Energy: 0.8265867258791044
Energy: 0.6478568783489138
Energy: 0.7120495713761545
Energy: 0.6659182479133535
Energy: 0.7120495713770618
Energy: 0.6524917066839906
Energy: 0.7559114642157068
Energy: 0.6679256268416758
Energy: 0.7559114642157068
Energy: 0.7035525231236197
Energy: 0.7345978679415527
Energy: 0.6638976955569311
Energy: 0.7345978679415527
Energy: 0.6671664883473736
Energy: 0.7567538092269049
Energy: 0.8464563958743389
Energy: 0.7567538092269049
Energy: 0.8496139706797059
Energy: 0.8083789541675477
Energy: 0.6480635674641504
Energy: 0.8083789541675477
Energy: 0.665251535744814
Energy: 0.7259767489253229
Energy: 0.8224439194542741
Energy: 0.7259767489253229
Energy: 0.8514824232233705
Energy: 0.7289088608580748
Energy: 0.6955491234534426
Energy: 0.7289088608580748
Energy: 0.6491520519280588
Energy: 0.729301329321108
Energy: 0.6476236071863135
Energy: 0.729301329321108
Energy: 0.6681833524581999
Energy: 0.7444813228578582
Energy: 0.7956381546255552
Energy: 0.7444813228578582
Energy: 0.7530338703656431
Energy: 0.7616450800885222
Energy: 0.6528212670648158
Energy: 0.7616450800885222
Energy: 0.6671073295480301
Energy: 0.7489146292423451
Energy: 0.9769611814649617
Energy: 0.7489146292423451
Energy: 0.8619901527166892
Energy: 0.7705219097873149
Energy: 0.6682196170660686
Energy: 0.7705219097873149
Energy: 0.6729149905597845
Energy: 0.763027425955402
Energy: 0.8214306883115717
Energy: 0.763027425955402
Energy: 0.8210851942974167
Energy: 0.7445297880150055
Energy: 0.6657619104934656
Energy: 0.7445297880159127
Energy: 0.7214641701393069
Energy: 0.7715133010359585
Energy: 0.6478346081353428
Energy: 0.7715133010350511
Energy: 0.7335820943103053
Energy: 0.7477800485959878
Energy: 0.6489806745439427
Energy: 0.7477800485959878
Energy: 0.6510082190671928
Energy: 0.7365500351048573
Energy: 0.6648381380544175
Energy: 0.7365500351048573
Energy: 0.712331813963612
Energy: 0.837755519575715
Energy: 0.8431606094120024
Energy: 0.837755519575715
Energy: 0.8379817733916723
Energy: 0.7580799003770408
Energy: 0.6667150136961622
Energy: 0.7580799003770408
Energy: 0.6724798797302031
Energy: 0.7338832947840708
Energy: 0.7464681074538355
Energy: 0.7338832947840708

minimum gb energy = 0.6476236071863135 eV
minimum distance =  2.52194350474034 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 0.7315450215606061
Energy: 0.759950476285993
Energy: 0.9004448025234081
Energy: 0.7599504762847099
Energy: 0.7574104212054323
Energy: 0.8206574611316015
Energy: 0.7336012699573263
Energy: 0.8206574611322431
Energy: 0.6867489934650524
Energy: 0.7722517983906866
Energy: 0.7023297683206754
Energy: 0.7722517983894034
Energy: 0.6805943820002492
Energy: 0.7563847594284204
Energy: 0.6988674259814824
Energy: 0.756384759429062
Energy: 0.7168031073123539
Energy: 0.7485352930646064
Energy: 0.6835541784044689
Energy: 0.7485352930658896
Energy: 0.6781745032677016
Energy: 0.7656535757438996
Energy: 0.8328993639786033
Energy: 0.7656535757451829
Energy: 0.7851756976401146
Energy: 0.8485711322931175
Energy: 0.6941067408159253
Energy: 0.8485711322924759
Energy: 0.6783444328515589
Energy: 0.7511281194513568
Energy: 0.8960364656378914
Energy: 0.7511281194532816
Energy: 0.9133997081345642
Energy: 0.7576877789779596
Energy: 0.6790203939919368
Energy: 0.7576877789786012
Energy: 0.7157471942898301
Energy: 0.760356817716787
Energy: 0.7638379987116067
Energy: 0.760356817716787
Energy: 0.7089517838087663
Energy: 0.7626929588420674
Energy: 0.7109553954232894
Energy: 0.7626929588401429
Energy: 0.6885474843022246
Energy: 0.7415718157267109
Energy: 0.6699292698278557
Energy: 0.7415718157260693
Energy: 0.7160435608562498
Energy: 0.7668276421507267
Energy: 0.6711778406791847
Energy: 0.7668276421500851
Energy: 0.7015914376056623
Energy: 0.764708147081105
Energy: 0.6701426117619611
Energy: 0.7647081470823882
Energy: 0.7096025584839386
Energy: 0.7536965627118539
Energy: 0.761146133393871
Energy: 0.7536965627137495
Energy: 0.8934031751786345
Energy: 0.7477458187018562
Energy: 0.6759748731865044
Energy: 0.7477458187024978
Energy: 0.6998448299891054
Energy: 0.7264916644451405
Energy: 0.716022110451189
Energy: 0.7264916644451405
Energy: 0.6838943864851305
Energy: 0.8134101075526055
Energy: 0.6701792117319145
Energy: 0.8134101075545302
Energy: 0.6977583734700157
Energy: 0.7713593799318628
Energy: 0.6730052901265204
Energy: 0.7713593799312212
Energy: 0.7140403870413201
Energy: 0.7355616795579034
Energy: 0.6703417385200248
Energy: 0.7355616795579034
Energy: 0.8617744073064258
Energy: 0.7593091044392405
Energy: 0.6792741507799065
Energy: 0.7593091044385989
Energy: 0.6858318163055863
Energy: 0.7696733248178174
Energy: 0.7819414072821476
Energy: 0.7696733248178174
Energy: 0.8223159514869123
Energy: 0.7615801519684723
Energy: 0.6732349336209608
Energy: 0.7615801519697554
Energy: 0.7327904407394006
Energy: 0.7497018174660359
Energy: 0.8569071211571149
Energy: 0.7497018174641403
Energy: 0.6914199583390708
Energy: 0.7350858177223418
Energy: 0.6724425329755874
Energy: 0.7350858177223418
Energy: 0.6806004019335673
Energy: 0.7727541659522571
Energy: 0.7039222297278716
Energy: 0.7727541659516154
Energy: 0.716237778772518
Energy: 0.7554726677759185
Energy: 0.7464435987398089
Energy: 0.7554726677765601
Energy: 0.6808662385806421
Energy: 0.7264171044145259
Energy: 0.6844921157828825
Energy: 0.7264171044164507
Energy: 0.6752137311020376
Energy: 0.7568071579927838
Energy: 0.8253270150862267
Energy: 0.7568071579927838
Energy: 0.7117874880149059
Energy: 0.6901136193175216
Energy: 0.7506050624822416
Energy: 0.6901136193194463
Energy: 0.6752186287809067
Energy: 0.7568509605239364
Energy: 0.8074084981275012
Energy: 0.7568509605252194

minimum gb energy = 0.6699292698278557 eV
minimum distance =  2.49173347068636 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.6526307015848342
Energy: 0.7206680042654393
Energy: 0.7417086825582363
Energy: 0.7206680042652408
Energy: 0.6459219593934622
Energy: 0.6785730958149069
Energy: 0.6873319355193077
Energy: 0.6785730958151301
Energy: 0.6598758622320311
Energy: 0.7089670108428624
Energy: 0.6726110736693366
Energy: 0.7089670108428624
Energy: 0.6542839108578226
Energy: 0.687898300380248
Energy: 0.6535283360007351
Energy: 0.687898300380248
Energy: 0.6534788007375923
Energy: 0.6836814622196751
Energy: 0.672453519902626
Energy: 0.6836814622196751
Energy: 0.6603469976655314
Energy: 0.7151034050115632
Energy: 0.6603163423531959
Energy: 0.7151034050115632
Energy: 0.659676121352677
Energy: 0.683680085017064
Energy: 0.6534755558068227
Energy: 0.683680085017064
Energy: 0.6535419146541056
Energy: 0.6879219740281826
Energy: 0.6542787610741027
Energy: 0.6879219740279592
Energy: 0.6727145865475388
Energy: 0.708934693093187
Energy: 0.6723238632408346
Energy: 0.708934693093187

minimum gb energy = 0.6459219593934622 eV
minimum distance =  2.56748714052816 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 0.6660848713828743
Energy: 0.7142086367185279
Energy: 0.8498867559255591
Energy: 0.7142086367185279
Energy: 0.7547820810286988
Energy: 0.7867206015835249
Energy: 0.6412694586502108
Energy: 0.7867206015835249
Energy: 0.6330638394653947
Energy: 0.738639304490434
Energy: 0.8005907331803698
Energy: 0.7386393044910401
Energy: 0.6506795307017769
Energy: 0.7365807599205645
Energy: 0.654363383840982
Energy: 0.7365807599193523
Energy: 0.6487681294561778
Energy: 0.764695660054449
Energy: 0.7340144533160773
Energy: 0.764695660054449
Energy: 0.7092475287967158
Energy: 0.7616833657629356
Energy: 0.6529586506754399
Energy: 0.7616833657623298
Energy: 0.6462060550036952
Energy: 0.7208546024882007
Energy: 0.6496037914624995
Energy: 0.7208546024882007
Energy: 0.6500901865422252
Energy: 0.7798641323856415
Energy: 0.6556630097580779
Energy: 0.7798641323850354
Energy: 0.6491179095321387
Energy: 0.7822418747567713
Energy: 0.6585590111081313
Energy: 0.7822418747567713
Energy: 0.6477233758098322
Energy: 0.7229297043898845
Energy: 0.6560665789991293
Energy: 0.7229297043904904
Energy: 0.6863490535123323
Energy: 0.8186343109191602
Energy: 0.6352044530792149
Energy: 0.8186343109191602
Energy: 0.6449291163442789
Energy: 0.7710296020661763
Energy: 0.7080684576774431
Energy: 0.7710296020661763
Energy: 0.7000701017947526
Energy: 0.7465027193160465
Energy: 0.6917041004268287
Energy: 0.7465027193160465
Energy: 0.6418183059035811
Energy: 0.7788206685954525
Energy: 0.7471676680973488
Energy: 0.7788206685954525
Energy: 0.6706611485012587
Energy: 0.7664993409996276
Energy: 0.6395523654169797
Energy: 0.7664993409990214
Energy: 0.6568946028627622
Energy: 0.7321177622780344
Energy: 0.6980278074485673
Energy: 0.7321177622780344
Energy: 0.7601272884083664
Energy: 0.7600157357657004
Energy: 0.6393716484758335
Energy: 0.7600157357657004
Energy: 0.636699061223176
Energy: 0.7399456736361186
Energy: 0.7438733357878081
Energy: 0.7399456736361186
Energy: 0.6382774886107402
Energy: 0.7304918810346686
Energy: 0.6542873436266082
Energy: 0.7304918810346686
Energy: 0.6483659305250216
Energy: 0.8378053109095824
Energy: 0.6796159601656911
Energy: 0.8378053109095824
Energy: 0.646730082003366
Energy: 0.7866550618362264
Energy: 0.6562866779328232
Energy: 0.7866550618368325
Energy: 0.6507186788775641
Energy: 0.7192452888802519
Energy: 0.6505979462469981
Energy: 0.7192452888796459
Energy: 0.6438458251214507
Energy: 0.7889870199793718
Energy: 0.6488819198031215
Energy: 0.7889870199793718
Energy: 0.7031330540366157
Energy: 0.7554481017628099
Energy: 0.6482675068418786
Energy: 0.7554481017615977
Energy: 0.710372587886075
Energy: 0.7141907410574967
Energy: 0.6543519572264967
Energy: 0.7141907410574967
Energy: 0.6758080814578776
Energy: 0.7608226208499881
Energy: 0.65055615887784
Energy: 0.7608226208499881
Energy: 0.6438745578893218
Energy: 0.7387640582716174
Energy: 0.6863193621432142
Energy: 0.7387640582716174
Energy: 0.7151112385813033
Energy: 0.823557031300551
Energy: 0.6568960946871195
Energy: 0.823557031300551
Energy: 0.6392413421571047
Energy: 0.8430785038393164
Energy: 0.7596889220648764
Energy: 0.8430785038393164
Energy: 0.7663894445255617
Energy: 0.764117726715362
Energy: 0.636778846757616
Energy: 0.764117726715362
Energy: 0.6515074816017472
Energy: 0.6991888209589113
Energy: 0.7406896412633335
Energy: 0.6991888209589113
Energy: 0.7706268795254984
Energy: 0.8021777787779575
Energy: 0.6383861407537773
Energy: 0.8021777787779575
Energy: 0.659016918630163
Energy: 0.8219832293187336
Energy: 0.8118182049805572
Energy: 0.8219832293187336

minimum gb energy = 0.6330638394653947 eV
minimum distance =  2.50664560342428 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 0.7527244857344915
Energy: 0.7474708107644056
Energy: 0.7609341260931194
Energy: 0.7474708107635676
Energy: 0.6816946916727997
Energy: 0.8423228762670532
Energy: 0.6186613716289596
Energy: 0.8423228762670532
Energy: 0.6289351122958413
Energy: 0.7247824136034723
Energy: 0.7450273193465536
Energy: 0.7247824136043104
Energy: 0.6238342299536241
Energy: 0.7732997202502198
Energy: 0.6332840846080481
Energy: 0.7732997202502198
Energy: 0.6208885863581303
Energy: 0.7562625191436857
Energy: 0.7422489278847758
Energy: 0.7562625191436857
Energy: 0.6196081923945532
Energy: 0.7858477189834774
Energy: 0.633382258376781
Energy: 0.7858477189834774
Energy: 0.635041389881269
Energy: 0.7174431437534564
Energy: 0.6646614313750434
Energy: 0.7174431437534564
Energy: 0.6281576707372413
Energy: 0.7017221483767081
Energy: 0.6463790379835792
Energy: 0.7017221483767081
Energy: 0.6873276865065929
Energy: 0.7049055756571715
Energy: 0.6839292773193609
Energy: 0.7049055756571715
Energy: 0.6869402741454934
Energy: 0.7187435220640606
Energy: 0.6448254215553687
Energy: 0.7187435220640606
Energy: 0.6278898930300905
Energy: 0.7175657396674066
Energy: 0.666309290424981
Energy: 0.7175657396682444
Energy: 0.6274364844082895
Energy: 0.7446477282201109
Energy: 0.6623675545321924
Energy: 0.7446477282201109
Energy: 0.6142868051448401
Energy: 0.7984548236214966
Energy: 0.6350079780478314
Energy: 0.7984548236214966
Energy: 0.612368117580802
Energy: 0.7432220453433461
Energy: 0.6819643748974177
Energy: 0.7432220453425084
Energy: 0.6738951780694403
Energy: 0.7395538984118256
Energy: 0.641541202275096
Energy: 0.7395538984126636
Energy: 0.6289599433946562
Energy: 0.7010303392082059
Energy: 0.6595508279976868
Energy: 0.7010303392082059
Energy: 0.7235849539184827
Energy: 0.8446518882919308
Energy: 0.615859148290365
Energy: 0.8446518882919308
Energy: 0.7527244857344915
Energy: 0.7474708107635676
Energy: 0.7834066962423389
Energy: 0.7474708107635676
Energy: 0.6816946916727997
Energy: 0.8423228762670532
Energy: 0.6186613716289596
Energy: 0.8423228762662153
Energy: 0.6289351122950224
Energy: 0.7247824136034723
Energy: 0.7450273193465536
Energy: 0.7247824136043104
Energy: 0.6238342299536241
Energy: 0.7732997202502198
Energy: 0.6332840846080481
Energy: 0.7732997202502198
Energy: 0.6208885863581303
Energy: 0.7562625191436857
Energy: 0.7422489278856137
Energy: 0.7562625191445237
Energy: 0.6196081923945532
Energy: 0.7858477189834774
Energy: 0.6333822583776189
Energy: 0.7858477189834774
Energy: 0.6350413898821069
Energy: 0.7174431437526184
Energy: 0.6876048820975946
Energy: 0.7174431437534564

minimum gb energy = 0.612368117580802 eV
minimum distance =  2.54012119658518 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 0.6656593694858403
Energy: 0.6662911732667778
Energy: 0.7850458216713337
Energy: 0.66629117326626
Energy: 0.8046776871543802
Energy: 0.7744454814815181
Energy: 0.6282086848611902
Energy: 0.7744454814825541
Energy: 0.6303834412577731
Energy: 0.6932007526413076
Energy: 0.795148521886927
Energy: 0.6932007526423436
Energy: 0.6937577750373317
Energy: 0.7341619302144882
Energy: 0.6238075309247066
Energy: 0.7341619302144882
Energy: 0.6294126797000277
Energy: 0.7537901041599955
Energy: 0.745869108256614
Energy: 0.7537901041599955
Energy: 0.6361728402771839
Energy: 0.8268397532074299
Energy: 0.6293961081775754
Energy: 0.8268397532079479
Energy: 0.633889504482847
Energy: 0.7262659338952105
Energy: 0.6812008904288007
Energy: 0.7262659338957285
Energy: 0.6256975222851958
Energy: 0.730442051046049
Energy: 0.6307485811662185
Energy: 0.730442051046049
Energy: 0.6732755086577016
Energy: 0.7419190319396963
Energy: 0.6721371726132047
Energy: 0.7419190319402142
Energy: 0.6737738692736434
Energy: 0.805168406958092
Energy: 0.6352784394784513
Energy: 0.8051684069575741
Energy: 0.6319800883924332
Energy: 0.7870016942403926
Energy: 0.6352286750526649
Energy: 0.7870016942403926
Energy: 0.6338731991308263
Energy: 0.6739970900097668
Energy: 0.634145271086153
Energy: 0.6739970900102848
Energy: 0.6332369401335469
Energy: 0.804632805667269
Energy: 0.6285438143311743
Energy: 0.804632805667269
Energy: 0.6358634951110238
Energy: 0.7483428336496897
Energy: 0.6857385792222975
Energy: 0.7483428336496897
Energy: 0.635259494990074
Energy: 0.7716481300234487
Energy: 0.6724777182747507
Energy: 0.7716481300239666
Energy: 0.6324237478027592
Energy: 0.7279846216447174
Energy: 0.7459940089622428
Energy: 0.7279846216457533
Energy: 0.6619351648186134
Energy: 0.7292394615477683
Energy: 0.6284330531977526
Energy: 0.7292394615472503
Energy: 0.6184027653075489
Energy: 0.6973721751667109
Energy: 0.6539588704528397
Energy: 0.6973721751667109
Energy: 0.7507443162553031
Energy: 0.7936200371974345
Energy: 0.6286338202863571
Energy: 0.7936200371969164
Energy: 0.623338988864427
Energy: 0.6614164363497502
Energy: 0.7998616910376101
Energy: 0.6614164363497502
Energy: 0.8472573764509624
Energy: 0.7174612651546448
Energy: 0.6238785350931416
Energy: 0.7174612651546448
Energy: 0.6237282058084794
Energy: 0.7478266637071574
Energy: 0.7156161009484105
Energy: 0.7478266637071574
Energy: 0.8483229279387737
Energy: 0.7269666232893939
Energy: 0.6247237759853447
Energy: 0.7269666232899117
Energy: 0.6294890551452643
Energy: 0.7315276799999691
Energy: 0.7698072934338096
Energy: 0.7315276800004871
Energy: 0.6889483107175624
Energy: 0.6973000695057151
Energy: 0.6192187804611883
Energy: 0.6973000695057151
Energy: 0.6295570330426226
Energy: 0.7010363915199463
Energy: 0.6603845570950788
Energy: 0.7010363915204644
Energy: 0.723805581067146
Energy: 0.8104002126506511
Energy: 0.630714436785333
Energy: 0.8104002126506511
Energy: 0.675195816864813
Energy: 0.7604256528536751
Energy: 0.6337415541542295
Energy: 0.7604256528536751
Energy: 0.6823199563114876
Energy: 0.7346291948369454
Energy: 0.6364367723515341
Energy: 0.7346291948364275
Energy: 0.6238574976587116
Energy: 0.7777915767520197
Energy: 0.6802348864205947
Energy: 0.7777915767525376
Energy: 0.6331157343820398
Energy: 0.7066483881710387
Energy: 0.6355073017335222
Energy: 0.7066483881705207
Energy: 0.6309840099226186
Energy: 0.7827418428241821
Energy: 0.6270479922600916
Energy: 0.7827418428247
Energy: 0.6327392918953133
Energy: 0.7950061450025003
Energy: 0.7459889308494302
Energy: 0.7950061450025003
Energy: 0.6761289227660892
Energy: 0.7431388973666138
Energy: 0.6346061870646391
Energy: 0.7431388973681676
Energy: 0.6299978317304358
Energy: 0.733111030385891
Energy: 0.6563575997407337
Energy: 0.733111030385891
Energy: 0.6909061041949436
Energy: 0.7473197645744102
Energy: 0.6301451346414243
Energy: 0.7473197645749281
Energy: 0.6247339649781061
Energy: 0.8236620440857775
Energy: 0.7947352593357012
Energy: 0.8236620440852596
Energy: 0.7805503394385452
Energy: 0.7476460458154246
Energy: 0.6297080290451698
Energy: 0.7476460458154246

minimum gb energy = 0.6184027653075489 eV
minimum distance =  2.53650279734713 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 0.5812267916514267
Energy: 0.581337802404804
Energy: 0.6490267482359887
Energy: 0.5813378024034488
Energy: 0.5828248844232469
Energy: 0.5964435392553652
Energy: 0.5929069514216928
Energy: 0.5964435392553652
Energy: 0.5906699972733525
Energy: 0.7060819578809772
Energy: 0.6564214442329155
Energy: 0.706081957879622
Energy: 0.6121204106373291
Energy: 0.5958319366206702
Energy: 0.5928238506822613
Energy: 0.5958319366206702
Energy: 0.5913755340432828
Energy: 0.6700865604552557
Energy: 0.8370706688806848
Energy: 0.6700865604552557
Energy: 0.5908459708138836
Energy: 0.5816004264468221
Energy: 0.5846756539339587
Energy: 0.581600426445467
Energy: 0.5905917556685328
Energy: 0.7070198847372692
Energy: 0.5825153277703541
Energy: 0.7070198847386091
Energy: 0.6311961705171266
Energy: 0.7060745489986819
Energy: 0.5927453224663907
Energy: 0.7060745489986819
Energy: 0.5910514700433392
Energy: 0.6324373750027208
Energy: 0.6100923590208397
Energy: 0.6324373750027208
Energy: 0.6161701491772894
Energy: 0.6699686505952027
Energy: 0.5843335268864763
Energy: 0.6699686505952027
Energy: 0.5814637145129891
Energy: 0.5962228308584389
Energy: 0.5904652891545495
Energy: 0.5962228308584389
Energy: 0.5821151304998343
Energy: 0.6680308643207434
Energy: 0.5922678558408779
Energy: 0.6680308643193882
Energy: 0.5910143543722299
Energy: 0.6702900259503868
Energy: 0.6320072691729871
Energy: 0.6702900259503868
Energy: 0.5912100823527168
Energy: 0.6308845985098799
Energy: 0.5912053385565801
Energy: 0.6308845985098799
Energy: 0.6092245765852243
Energy: 0.6703674305072091
Energy: 0.5909901741582559
Energy: 0.6703674305072091

minimum gb energy = 0.5812267916514267 eV
minimum distance =  2.55337448721633 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 0.5814632596379085
Energy: 0.7043971171793596
Energy: 0.8963782766199467
Energy: 0.7043971171839035
Energy: 0.7438735785374511
Energy: 0.7121606838738272
Energy: 0.5691719059623743
Energy: 0.7121606838738272
Energy: 0.5692363991664657
Energy: 0.735818363958704
Energy: 0.8181761561674634
Energy: 0.735818363959272
Energy: 0.5730213812584198
Energy: 0.7119396600729565
Energy: 0.5705843305849188
Energy: 0.7119396600905387
Energy: 0.5786472393523608
Energy: 0.7581430365199775
Energy: 0.6055396275923041
Energy: 0.7581430365194095
Energy: 0.8303652314906332
Energy: 0.6465473609465814
Energy: 0.5721451705788274
Energy: 0.6465473609460134
Energy: 0.5784817175905136
Energy: 0.7488096606577461
Energy: 0.7077520525490368
Energy: 0.7488096606577461
Energy: 0.5727561245009922
Energy: 0.7418049570811401
Energy: 0.572055907011904
Energy: 0.7418049570800043
Energy: 0.5776733979301976
Energy: 0.7481857278394921
Energy: 0.6861006508683766
Energy: 0.7481857278377883
Energy: 0.6724528803326276
Energy: 0.766115617487609
Energy: 0.5707488777476439
Energy: 0.7661156174870409
Energy: 0.5785623099143612
Energy: 0.7044891564215593
Energy: 0.6160286433368578
Energy: 0.7044891564232634
Energy: 0.7047378641966545
Energy: 0.7454628480782658
Energy: 0.5761770846983498
Energy: 0.7454628480765617
Energy: 0.589396786844992
Energy: 0.7589416965823954
Energy: 0.5717070131313752
Energy: 0.7589416965823954
Energy: 0.715038623803813
Energy: 0.7542041085368949
Energy: 0.5764604353966142
Energy: 0.7542041085363269
Energy: 0.5785933308514803
Energy: 0.7269720237876192
Energy: 0.5743397409387913
Energy: 0.7269720237881871
Energy: 0.5662582651345844
Energy: 0.6740870923528947
Energy: 0.5764936599001352
Energy: 0.6740870923517587
Energy: 0.5767131270080045
Energy: 0.7267391163463245
Energy: 0.5765503315194597
Energy: 0.7267391163474605
Energy: 0.5904638985093785
Energy: 0.7802090896605098
Energy: 0.580956090640383
Energy: 0.7802090896576956
Energy: 0.5750828304485793
Energy: 0.771054351442325
Energy: 0.5812582331459045
Energy: 0.771054351443461
Energy: 0.5750310634564109
Energy: 0.7707183471639393
Energy: 0.5807825674151993
Energy: 0.7707183471622352
Energy: 0.5904754166250864
Energy: 0.7802336641365639
Energy: 0.5807390820098494
Energy: 0.7802336641354278
Energy: 0.5747638681978612
Energy: 0.7267701137179149
Energy: 0.5765942764402141
Energy: 0.7267701137196189
Energy: 0.5662397668791864
Energy: 0.6740989243600335
Energy: 0.5764898589575871
Energy: 0.6740989243606015
Energy: 0.5785872221874521
Energy: 0.7269807063044923
Energy: 0.5930524050231408
Energy: 0.7269807063044923
Energy: 0.7150283249923329
Energy: 0.7542691846309696
Energy: 0.5764379783198572
Energy: 0.7542691846298336
Energy: 0.5888995492072638
Energy: 0.7591259451891859
Energy: 0.5933474273743624
Energy: 0.7591259451880498
Energy: 0.7045934222274991
Energy: 0.7452404479652818
Energy: 0.5760330742296403
Energy: 0.7452404479624418
Energy: 0.5772748137590912
Energy: 0.704710282105946
Energy: 0.6159347434695933
Energy: 0.704710282105946
Energy: 0.6724857117921319
Energy: 0.7659192040898648
Energy: 0.5707405369129032
Energy: 0.7659192040881608
Energy: 0.5775191812349216
Energy: 0.7484442401513992
Energy: 0.7116007519848736
Energy: 0.7484442401508312
Energy: 0.5724709571452691
Energy: 0.7423839092813088
Energy: 0.5720563300597065
Energy: 0.7423839092818768
Energy: 0.5785265260566138
Energy: 0.7479757822069197
Energy: 0.7782269771159073
Energy: 0.7479757822080557
Energy: 0.8299577503727343
Energy: 0.6466196537632034
Energy: 0.5720358436778336
Energy: 0.6466196537637715
Energy: 0.5784678341609694
Energy: 0.7577041513854994
Energy: 0.6146616078980025
Energy: 0.7577041513826593
Energy: 0.5735928273537165
Energy: 0.7120888014709269
Energy: 0.570590046772698
Energy: 0.7120888014714949

minimum gb energy = 0.5662397668791864 eV
minimum distance =  2.40872652633237 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 0.6069034680687684
Energy: 0.5974350993292469
Energy: 0.9191594939076906
Energy: 0.5974350993292469
Energy: 0.785041977585438
Energy: 0.6432404388737374
Energy: 0.5252069003894788
Energy: 0.6432404388737374
Energy: 0.533492092623934
Energy: 0.7852215984027876
Energy: 0.7382936058121324
Energy: 0.7852215984018104
Energy: 0.5734611290625353
Energy: 0.592734015029347
Energy: 0.5275008248428104
Energy: 0.592734015029347
Energy: 0.5253349486944375
Energy: 0.6390709840586162
Energy: 0.686827942230971
Energy: 0.6390709840595934
Energy: 0.5435277755741938
Energy: 0.701600209586257
Energy: 0.587685887584745
Energy: 0.7016002095852798
Energy: 0.5321365393098035
Energy: 0.7817466257054408
Energy: 0.7047932864879001
Energy: 0.7817466257054408
Energy: 0.5145677108391542
Energy: 0.5329767130595661
Energy: 0.5347544701964895
Energy: 0.5329767130595661
Energy: 0.5269212241321237
Energy: 0.6434742966869935
Energy: 0.6380933656100387
Energy: 0.6434742966869935
Energy: 0.696247750498139
Energy: 0.7634593352670894
Energy: 0.5876702324386722
Energy: 0.7634593352661122
Energy: 0.5337534689178511
Energy: 0.7293745363425737
Energy: 0.5876050787831999
Energy: 0.7293745363425737
Energy: 0.6704927904436756
Energy: 0.6390742903143071
Energy: 0.5274181940014041
Energy: 0.6390742903143071
Energy: 0.5856717217359882
Energy: 0.6970166567694952
Energy: 0.5295709659575167
Energy: 0.6970166567694952
Energy: 0.7059788646852604
Energy: 0.7814160394999916
Energy: 0.5197418097765804
Energy: 0.7814160394999916
Energy: 0.6069114972763171
Energy: 0.6096725605358586
Energy: 0.5245133480401208
Energy: 0.6096725605358586
Energy: 0.6081110946204075
Energy: 0.6328058925674624
Energy: 0.5250611981934714
Energy: 0.6328058925674624
Energy: 0.5856124057038635
Energy: 0.7500618562254906
Energy: 0.5198176480729079
Energy: 0.7500618562264454
Energy: 0.5878395105889376
Energy: 0.7374946039131323
Energy: 0.5255919693840359
Energy: 0.7374946039140873
Energy: 0.5256676302574992
Energy: 0.6391740881207222
Energy: 0.5253531448979255
Energy: 0.6391740881207222
Energy: 0.5251872847882646
Energy: 0.7093574146210718
Energy: 0.5856617465582742
Energy: 0.7093574146200945

minimum gb energy = 0.5145677108391542 eV
minimum distance =  2.52847358507582 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.5494753181450419
Energy: 0.7309717888861986
Energy: 0.8919890161413719
Energy: 0.7309717888861986
Energy: 0.7069132343703549
Energy: 0.6458555892306053
Energy: 0.4754724212798953
Energy: 0.6458555892313684
Energy: 0.5246534781572685
Energy: 0.5183489716953472
Energy: 0.6764120486209966
Energy: 0.5183489716953472
Energy: 0.6049692946041519
Energy: 0.6136851666328195
Energy: 0.4763148124243317
Energy: 0.6136851666328195
Energy: 0.4809923769354019
Energy: 0.6463526975784961
Energy: 0.5112457253067338
Energy: 0.6463526975777331
Energy: 0.508786236691877
Energy: 0.6458145930408636
Energy: 0.4827434183700717
Energy: 0.6458145930416268
Energy: 0.47560419071885607
Energy: 0.5577753250646043
Energy: 0.659523736610248
Energy: 0.5577753250638412
Energy: 0.4790269996241386
Energy: 0.6165457130973075
Energy: 0.5256887132041776
Energy: 0.6165457130973075
Energy: 0.4747880890929488
Energy: 0.6473478108349255
Energy: 0.7921323655356278
Energy: 0.6473478108356886
Energy: 0.46302214533850855
Energy: 0.640484261008987
Energy: 0.4948910066581469
Energy: 0.6404842610082239
Energy: 0.475678385378214
Energy: 0.5571604507395513
Energy: 0.6454421302776882
Energy: 0.5571604507395513
Energy: 0.5997646641593202
Energy: 0.7001349084926767
Energy: 0.5258231982294301
Energy: 0.7001349084919135
Energy: 0.4773071263923236
Energy: 0.6145696128487905
Energy: 0.6053180278234666
Energy: 0.6145696128487905
Energy: 0.6210705640121263
Energy: 0.686630949650398
Energy: 0.48290962170814616
Energy: 0.6866309496496348
Energy: 0.4829812522349639
Energy: 0.6012239466471813
Energy: 0.5148973486178132
Energy: 0.6012239466471813
Energy: 0.6411072954896204
Energy: 0.7002260975748236
Energy: 0.4746541302201163
Energy: 0.7002260975748236
Energy: 0.5288749473726497
Energy: 0.6177268975190431
Energy: 0.47061597447100817
Energy: 0.6177268975182799
Energy: 0.6235543658027516
Energy: 0.6669426175305533
Energy: 0.47567272799821286
Energy: 0.6669426175297903
Energy: 0.5535104456111647
Energy: 0.6751805625698961
Energy: 0.46868804445587575
Energy: 0.6751805625706592
Energy: 0.7348677912800734
Energy: 0.6843021733490163
Energy: 0.4749815666476685
Energy: 0.6843021733482532
Energy: 0.5288921728920405
Energy: 0.6996891597189459
Energy: 0.4739864644027516
Energy: 0.699689159719709
Energy: 0.5257132775986261
Energy: 0.6333089269936615
Energy: 0.48024664071847084
Energy: 0.6333089269944245
Energy: 0.4829260706841058
Energy: 0.6964979326316526
Energy: 0.622565589357827
Energy: 0.6964979326316526
Energy: 0.5148461496854235
Energy: 0.6946918678943774
Energy: 0.4804780254471892
Energy: 0.6946918678936145
Energy: 0.47491603932551896
Energy: 0.7002800074621043
Energy: 0.6701285188142816
Energy: 0.7002800074621043
Energy: 0.46920942393724
Energy: 0.6369922077743312
Energy: 0.5249547918299393
Energy: 0.6369922077743312

minimum gb energy = 0.46302214533850855 eV
minimum distance =  2.50924019560007 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 0.5966981442338637
Energy: 0.5719738361244214
Energy: 0.44756213110038984
Energy: 0.5719738361250469
Energy: 0.6810793120262185
Energy: 0.5671685739525418
Energy: 0.42831854601399255
Energy: 0.5671685739519163
Energy: 0.4378670819677177
Energy: 0.5647955887035396
Energy: 0.8354895810781133
Energy: 0.564795588702914
Energy: 0.5241099819683565
Energy: 0.5675210407237132
Energy: 0.428487118408266
Energy: 0.5675210407237132
Energy: 0.4251208424055136
Energy: 0.5785209556329642
Energy: 0.46159993517249187
Energy: 0.5785209556342154
Energy: 0.5963725753100704
Energy: 0.5678806692651496
Energy: 0.4283092460522538
Energy: 0.5678806692651496
Energy: 0.4277579966522303
Energy: 0.567579939073963
Energy: 0.6351496651713143
Energy: 0.567579939073963
Energy: 0.42403596941098315
Energy: 0.5065694295064194
Energy: 0.4256828340176091
Energy: 0.5065694295064194
Energy: 0.4301245677843839
Energy: 0.6136106479340413
Energy: 0.655041233822648
Energy: 0.6136106479334157
Energy: 0.4277389515357682
Energy: 0.5651135224374041
Energy: 0.43858370495177973
Energy: 0.5651135224298969
Energy: 0.4277132974139334
Energy: 0.5677234534314917
Energy: 0.6771965939294223
Energy: 0.5677234534314917
Energy: 0.4217545292434539
Energy: 0.571196277559446
Energy: 0.5973697579347734
Energy: 0.5711962775588204
Energy: 0.4300729013597624
Energy: 0.614272465940305
Energy: 0.677350071311388
Energy: 0.614272465940305
Energy: 0.4881143775778359
Energy: 0.7012390326148956
Energy: 0.4385533699608926
Energy: 0.7012390326148956
Energy: 0.4278576820065877
Energy: 0.5913319613415494
Energy: 0.5787519701287063
Energy: 0.5913319613415494
Energy: 0.540418246825469
Energy: 0.6217253309963062
Energy: 0.4257147323638858
Energy: 0.6217253309963062
Energy: 0.4301556111015487
Energy: 0.6132881093878663
Energy: 0.53948394270011
Energy: 0.6132881093884918
Energy: 0.529158903854573
Energy: 0.7041058968609327
Energy: 0.4283542962548488
Energy: 0.7041058968609327
Energy: 0.42777573405396535
Energy: 0.5301192151943409
Energy: 0.4246053441550645
Energy: 0.5301192151943409
Energy: 0.5248871366410672
Energy: 0.6210235242792
Energy: 0.43298403685274506
Energy: 0.6210235242785743
Energy: 0.44040127577880245
Energy: 0.6432329595846272
Energy: 0.4277918520008738
Energy: 0.6432329595840016
Energy: 0.6748273780722914
Energy: 0.6869435535666452
Energy: 0.4282223289685691
Energy: 0.6869435535660195
Energy: 0.599146570802231
Energy: 0.5959995619328462
Energy: 0.4251695771349061
Energy: 0.5959995619328462
Energy: 0.6020190674615307
Energy: 0.6150854334356176
Energy: 0.43256876929224336
Energy: 0.6150854334337692
Energy: 0.44058585377534454
Energy: 0.6717002303012996
Energy: 0.43443033303262063
Energy: 0.6717002303019252
Energy: 0.5828869787512705
Energy: 0.6788154578144889
Energy: 0.4283540486919837
Energy: 0.6788154578138633
Energy: 0.4277738886977516
Energy: 0.6222116955475239
Energy: 0.5312559114382854
Energy: 0.6222116955475239
Energy: 0.42551525465125484
Energy: 0.6129732962265547
Energy: 0.43277296161319984
Energy: 0.612973296225929
Energy: 0.4301492433510201
Energy: 0.6505176549438584
Energy: 0.5292508187374196
Energy: 0.650517654944484
Energy: 0.42445474162061175
Energy: 0.6334025393719441
Energy: 0.4307019548104702
Energy: 0.6334025393719441
Energy: 0.4333272779640435
Energy: 0.6221418765471316
Energy: 0.5099773585133792
Energy: 0.6221418765471316
Energy: 0.42486326357601123
Energy: 0.6337306081981899
Energy: 0.44349663498292546
Energy: 0.6337306081981899

minimum gb energy = 0.4217545292434539 eV
minimum distance =  2.49814539848363 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 0.5431932870727088
Energy: 0.6633803912290401
Energy: 0.7537919556625361
Energy: 0.6633803912295702
Energy: 0.6185246412643014
Energy: 0.6023254405119662
Energy: 0.40024224223380694
Energy: 0.6023254405124963
Energy: 0.41138632055418206
Energy: 0.5133756775768787
Energy: 0.4010387352080595
Energy: 0.5133756775789987
Energy: 0.6181843948588708
Energy: 0.600295331014448
Energy: 0.4003290818991057
Energy: 0.600295331014448
Energy: 0.398416068470876
Energy: 0.7111344847841738
Energy: 0.6233941276880617
Energy: 0.7111344847841738
Energy: 0.525910358596335
Energy: 0.6011900411149081
Energy: 0.40042422228609703
Energy: 0.6011900411149081
Energy: 0.3998842560941491
Energy: 0.5176562953646563
Energy: 0.4242621178696224
Energy: 0.5176562953651862
Energy: 0.45140434271792734
Energy: 0.5170862023641319
Energy: 0.4004079328480421
Energy: 0.5170862023641319
Energy: 0.4016399785934996
Energy: 0.6667399429465326
Energy: 0.6052522248598892
Energy: 0.6667399429465326
Energy: 0.390633228382866
Energy: 0.6332890541844652
Energy: 0.3987616794222577
Energy: 0.633289054184995
Energy: 0.3999400695169425
Energy: 0.564136861684159
Energy: 0.6181611572693633
Energy: 0.5641368616836291
Energy: 0.3977733978836729
Energy: 0.5129681317240297
Energy: 0.4116974679919349
Energy: 0.5129681317224396
Energy: 0.4014983100556837
Energy: 0.6355117575667143
Energy: 0.6819554895231034
Energy: 0.6355117575667143
Energy: 0.38931772066813525
Energy: 0.6631744037142306
Energy: 0.5435729742342511
Energy: 0.6631744037137006
Energy: 0.3997930748920215
Energy: 0.5627651399976128
Energy: 0.7016348379227427
Energy: 0.5627651399986728
Energy: 0.46452715915844334
Energy: 0.5129215508244185
Energy: 0.41180639590309015
Energy: 0.5129215508286583
Energy: 0.401504209309439
Energy: 0.6302740058284965
Energy: 0.6142948248415144
Energy: 0.6302740058284965
Energy: 0.5017508462054013
Energy: 0.6460349771866841
Energy: 0.3988262807714479
Energy: 0.6460349771861542
Energy: 0.40007869287802345
Energy: 0.5647549871176198
Energy: 0.5268453794225227
Energy: 0.5647549871170897
Energy: 0.48297673545767267
Energy: 0.5664678130079168
Energy: 0.4002750341460912
Energy: 0.5664678130079168
Energy: 0.40162276090155563
Energy: 0.568436394681793
Energy: 0.4544305918912024
Energy: 0.568436394681793
Energy: 0.4798199358083839
Energy: 0.6427053126601974
Energy: 0.4034452986061289
Energy: 0.6427053126601974
Energy: 0.3999259079625196
Energy: 0.5737890710929857
Energy: 0.3909785248508535
Energy: 0.5737890710929857
Energy: 0.5933027977251975
Energy: 0.5651268674026086
Energy: 0.4001990406459687
Energy: 0.5651268674026086
Energy: 0.41299309001176493
Energy: 0.5896207868417213
Energy: 0.3971888600703155
Energy: 0.5896207868417213
Energy: 0.6397920735570952
Energy: 0.6216787080669633
Energy: 0.4033544418713424
Energy: 0.6216787080674934
Energy: 0.5446034631100837
Energy: 0.5915963883484014
Energy: 0.4042476337523273
Energy: 0.5915963883484014
Energy: 0.6996714713290737
Energy: 0.554878523258847
Energy: 0.4003054484313369
Energy: 0.554878523258317
Energy: 0.4129953753094562
Energy: 0.6574518969648966
Energy: 0.396496134237777
Energy: 0.6574518969654267
Energy: 0.5279331079467503
Energy: 0.6365003164606133
Energy: 0.4033735743583247
Energy: 0.6365003164606133
Energy: 0.39987935896486254
Energy: 0.6133788928382472
Energy: 0.48304513217788897
Energy: 0.6133788928387771
Energy: 0.5219549379211598
Energy: 0.5572671224289018
Energy: 0.40046171159375477
Energy: 0.5572671224278417
Energy: 0.40151106981714435
Energy: 0.6574211497428368
Energy: 0.481724460898921
Energy: 0.6574211497428368
Energy: 0.3912317250156809
Energy: 0.5732218928118035
Energy: 0.4034096855936629
Energy: 0.5732218928123336
Energy: 0.3940048173699647
Energy: 0.612047297414391
Energy: 0.4796565407714164
Energy: 0.612047297414391
Energy: 0.39119995171127386
Energy: 0.5782803205933196
Energy: 0.4019187248163924
Energy: 0.5782803205927896
Energy: 0.40135751599588
Energy: 0.6573341884795831
Energy: 0.6054040638523017
Energy: 0.6573341884801132

minimum gb energy = 0.38931772066813525 eV
minimum distance =  2.51291356350377 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 0.5493015694117218
Energy: 0.6236514536673501
Energy: 0.49775809712779273
Energy: 0.6236514536664308
Energy: 0.6710343285797336
Energy: 0.5380278087745227
Energy: 0.36422879639101946
Energy: 0.5380278087740631
Energy: 0.5306864520497555
Energy: 0.5093859395777879
Energy: 0.4157282361380991
Energy: 0.5093859395782475
Energy: 0.5937891592683961
Energy: 0.5379529527991213
Energy: 0.36422607081949454
Energy: 0.5379529527986615
Energy: 0.40994931475565904
Energy: 0.49717574327281067
Energy: 0.40618670381364325
Energy: 0.4971757432732703
Energy: 0.6587420149330399
Energy: 0.5102348402777499
Energy: 0.3640453483981521
Energy: 0.5102348402782094
Energy: 0.3936259839352821
Energy: 0.4781869320634937
Energy: 0.43984556166490313
Energy: 0.4781869320634937
Energy: 0.4990570753052952
Energy: 0.5470212854299346
Energy: 0.3682187581144289
Energy: 0.5470212854290154
Energy: 0.36748031364076367
Energy: 0.46372966703575835
Energy: 0.47683952632448473
Energy: 0.46372966703575835
Energy: 0.43154817492820347
Energy: 0.47480250459526124
Energy: 0.39413605855415834
Energy: 0.47480250459480156
Energy: 0.36555984862501645
Energy: 0.5381265202112064
Energy: 0.6405653586615381
Energy: 0.5381265202125854
Energy: 0.3774102526522932
Energy: 0.5782631833163128
Energy: 0.4104127820067014
Energy: 0.5782631833167724
Energy: 0.3637700254037314
Energy: 0.463851336502868
Energy: 0.6510726714278384
Energy: 0.46385133650194865
Energy: 0.3560425208013808
Energy: 0.5093648568765763
Energy: 0.5310185231573482
Energy: 0.5093648568765763
Energy: 0.36541750902055586
Energy: 0.5381318886585484
Energy: 0.7207869773050187
Energy: 0.5381318886585484
Energy: 0.3507996270291827
Energy: 0.5996300672006517
Energy: 0.5070464185269565
Energy: 0.5996300671997323
Energy: 0.3638296492916194
Energy: 0.4828559007569818
Energy: 0.6892139756526136
Energy: 0.4828559007569818
Energy: 0.3963497543546551
Energy: 0.509809122248684
Energy: 0.5310202719470198
Energy: 0.509809122248684
Energy: 0.3654837546708158
Energy: 0.5124737179695357
Energy: 0.6594767508735508
Energy: 0.5124737179695357
Energy: 0.4334212419340743
Energy: 0.6194015082937054
Energy: 0.41034329459305235
Energy: 0.6194015082941652
Energy: 0.36441165120854535
Energy: 0.4645530422045422
Energy: 0.5828845273535929
Energy: 0.4645530422045422
Energy: 0.45907398313863945
Energy: 0.5199055270722511
Energy: 0.39411462023616256
Energy: 0.5199055270713316
Energy: 0.3697907843146649
Energy: 0.5205945173919919
Energy: 0.49931710148026015
Energy: 0.5205945173915323
Energy: 0.46380429779567006
Energy: 0.5819721003722418
Energy: 0.36831796063989986
Energy: 0.5819721003722418
Energy: 0.3954019384746092
Energy: 0.4670167224486627
Energy: 0.4316215042540038
Energy: 0.46701672244912235
Energy: 0.64094113570235
Energy: 0.5106366439984825
Energy: 0.36569752057894156
Energy: 0.5106366439984825
Energy: 0.4116755045364539
Energy: 0.551801798241994
Energy: 0.3792123285570349
Energy: 0.551801798241994
Energy: 0.5666162316592647
Energy: 0.5698925677540599
Energy: 0.3641878139646082
Energy: 0.5698925677540599
Energy: 0.5323066889439635
Energy: 0.5275333886248972
Energy: 0.3836003592580513
Energy: 0.5275333886253567
Energy: 0.7195761488870929
Energy: 0.5104118174110204
Energy: 0.36554840810888584
Energy: 0.5104118174105607
Energy: 0.5509605134335308
Energy: 0.5728780244346818
Energy: 0.35264309397024357
Energy: 0.5728780244346818
Energy: 0.6664618453392458
Energy: 0.5720972725074016
Energy: 0.364190498631411
Energy: 0.572097272506942
Energy: 0.5323017717672522
Energy: 0.5276674895247857
Energy: 0.35528382164221317
Energy: 0.5276674895247857
Energy: 0.6576457612342913
Energy: 0.5215449586996679
Energy: 0.3656370927753449
Energy: 0.5215449586987487
Energy: 0.41158875363537734
Energy: 0.5977783114214474
Energy: 0.43477357609006245
Energy: 0.5977783114214474
Energy: 0.5126814108749731
Energy: 0.5606762355591619
Energy: 0.36552823160196546
Energy: 0.5606762355596215
Energy: 0.3953403105857414
Energy: 0.5103258044036252
Energy: 0.46209824702941493
Energy: 0.5103258044031657
Energy: 0.4992444743231478
Energy: 0.5290873995563733
Energy: 0.3685322490365419
Energy: 0.5290873995559137
Energy: 0.3697445551402174
Energy: 0.5840860540034646
Energy: 0.46318726246880065
Energy: 0.5840860540034646
Energy: 0.3864188295665299
Energy: 0.538925492151843
Energy: 0.3974360228268323
Energy: 0.538925492151843
Energy: 0.3639935914100518
Energy: 0.5101974369368003
Energy: 0.5763543717959866
Energy: 0.5101974369368003
Energy: 0.3834814760024574
Energy: 0.5368968023264145
Energy: 0.4136149203546935
Energy: 0.5368968023259546
Energy: 0.3653547831214798
Energy: 0.5610573259776082
Energy: 0.5673042171191514
Energy: 0.5610573259762291

minimum gb energy = 0.3507996270291827 eV
minimum distance =  2.56241952220439 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.01172184963938693
Energy: 0.012540544785049635
Energy: 0.6395188513201011
Energy: 0.012540544785049635
Energy: 0.6389668173178148
Energy: 0.19350478249916253
Energy: 0.19382122860525694
Energy: 0.19350478249882883
Energy: 0.01172184963938693
Energy: 0.012540544785049635
Energy: 0.6395160621488029
Energy: 0.012540544785049635
Energy: 0.6389668173181485
Energy: 0.19350478249882883
Energy: 0.19396506692938484
Energy: 0.19350478249847547
Energy: 0.01172184963938693
Energy: 0.012540544785049635
Energy: 0.6395164646134882
Energy: 0.01254054478540299
Energy: 0.6389668173178148
Energy: 0.19350478249882883
Energy: 0.19395986036630875
Energy: 0.19350478249882883

minimum gb energy = 0.01172184963938693 eV
minimum distance =  2.85657743979351 Angstroms
sigma value = 1