Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_Cu__MO_759493141826_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.614958965778353
cohesive_energy=3.5402732499842564
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013735453552492683
Energy: 0.5694224252615482
Energy: 0.013735453552492683
Energy: 0.5694224252615482
Energy: 0.013735453552492683
Energy: 0.5694224252612345
Energy: 0.5694224252618618
Energy: 0.33485626686282166
Energy: 0.5694224252612345
Energy: 0.3348562668625081
Energy: 0.5694224252615482
Energy: 0.33485626686282166
Energy: 0.013735453552492683
Energy: 0.5694224252612345
Energy: 0.013735453552179068
Energy: 0.5694224252609559
Energy: 0.013735453552492683
Energy: 0.5694224252609559
Energy: 0.5694224252615482
Energy: 0.33485626686282166
Energy: 0.5694224252612345
Energy: 0.33485626686282166
Energy: 0.5694224252615482
Energy: 0.3348562668634489
Energy: 0.013735453552492683
Energy: 0.5694224252615482
Energy: 0.013735453552179068
Energy: 0.5694224252615482
Energy: 0.013735453552492683
Energy: 0.5694224252615482
Energy: 0.5694224252609559
Energy: 0.33485626686282166
Energy: 0.5694224252612345
Energy: 0.33485626686282166
Energy: 0.5694224252615482
Energy: 0.33485626686313524

minimum gb energy = 0.013735453552179068 eV
minimum distance =  2.52861763669853 Angstroms
sigma value = 1


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

Energy: 0.8106664935214959
Energy: 0.7698386141758216
Energy: 0.8106664935207409
Energy: 0.7698386141758216
Energy: 0.8106664935222507
Energy: 0.7698386141758216
Energy: 0.8776670977846834
Energy: 0.7232909459277657
Energy: 0.8776670977854383
Energy: 0.7232909459277657
Energy: 0.8776670977846834
Energy: 0.7232909459270108
Energy: 0.8079954718785402
Energy: 0.7981499909700231
Energy: 0.807995471879295
Energy: 0.7981499909700231
Energy: 0.8079954718785402
Energy: 0.7981499909707781
Energy: 0.7826442834875029
Energy: 0.7571265958151665
Energy: 0.782644283503356
Energy: 0.7571265958144116
Energy: 0.7826442835433319
Energy: 0.7571265958151665
Energy: 0.7898412294066819
Energy: 0.8395479165551173
Energy: 0.7898412294081919
Energy: 0.8395479165551173
Energy: 0.7898412294074368
Energy: 0.8395479165551173
Energy: 0.8193145304689121
Energy: 0.7447713259565663
Energy: 0.8193145304704217
Energy: 0.7447713259573211
Energy: 0.819314530469667
Energy: 0.7447713259573211
Energy: 0.757941035964225
Energy: 0.8012339045772175
Energy: 0.7579410359634702
Energy: 0.8012339045794822
Energy: 0.7579410359634702
Energy: 0.8012339045787272
Energy: 0.7563306792701657
Energy: 0.857419192197179
Energy: 0.7563306792694108
Energy: 0.8574191921979339
Energy: 0.7563306792709205
Energy: 0.857419192198689
Energy: 0.8251241121327773
Energy: 0.8107216665726383
Energy: 0.8251241121335322
Energy: 0.8107216665733932
Energy: 0.8251241121327773
Energy: 0.8107216665726383
Energy: 0.7136863860279161
Energy: 0.8505048072141493
Energy: 0.7136863860279161
Energy: 0.8505048072179239
Energy: 0.7136863860286711
Energy: 0.8505048072179239
Energy: 0.8008321763597664
Energy: 0.7353750735766336
Energy: 0.8008321763605214
Energy: 0.7353750735766336
Energy: 0.8008321763605214
Energy: 0.7353750735766336
Energy: 0.698500490303259
Energy: 0.7996899829175554
Energy: 0.6985004903040138
Energy: 0.7996895488843455
Energy: 0.698500490303259
Energy: 0.7996895906546064
Energy: 0.8776791815907722
Energy: 0.6934901373480066
Energy: 0.8776791815907722
Energy: 0.6934901373480066
Energy: 0.877679181592282
Energy: 0.6934901373480066
Energy: 0.7421130569737864
Energy: 0.7538500173343309
Energy: 0.7421130569760512
Energy: 0.7538500173343309
Energy: 0.7421130569745413
Energy: 0.7538500173350857
Energy: 0.8938829206428285
Energy: 0.7223027335189768
Energy: 0.8938829206443384
Energy: 0.7223027335189768
Energy: 0.8938829206428285
Energy: 0.7223027335189768
Energy: 0.8894523122579859
Energy: 0.8144662884082771
Energy: 0.8894523122594615
Energy: 0.8144662884112969
Energy: 0.8894523122572311
Energy: 0.8144662884120517
Energy: 0.7982450431484557
Energy: 0.796872311663715
Energy: 0.7982450431499313
Energy: 0.79687231166296
Energy: 0.7982450431492104
Energy: 0.796872311663715
Energy: 0.7982056700018744
Energy: 0.7550541456011175
Energy: 0.7982056700011195
Energy: 0.7550541455980979
Energy: 0.7982056699935703
Energy: 0.7550541456003627
Energy: 0.7882442082430275
Energy: 0.7575274488064891
Energy: 0.7882442082437824
Energy: 0.7575274488072441
Energy: 0.7882442082437824
Energy: 0.7575274488072441
Energy: 0.808933519733792
Energy: 0.7447127382978851
Energy: 0.808933519733792
Energy: 0.7447127382978851
Energy: 0.808933519733792
Energy: 0.7447127382971303
Energy: 0.7264781223968828
Energy: 0.8737152761988426
Energy: 0.726478122396128
Energy: 0.8737152761988426
Energy: 0.7264781223968828
Energy: 0.8737152761988426
Energy: 0.818377570563612
Energy: 0.8028459776048735
Energy: 0.8183775705628571
Energy: 0.8028459776048735
Energy: 0.818377570563612
Energy: 0.8028459776048735
Energy: 0.7150820813832811
Energy: 0.864535141867534
Energy: 0.7150820813840361
Energy: 0.8645351418682888
Energy: 0.7150820813832811
Energy: 0.8645351418697986

minimum gb energy = 0.6934901373480066 eV
minimum distance =  2.30116314484732 Angstroms
sigma value = 33


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

Energy: 0.894255254613438
Energy: 0.8588217003970592
Energy: 0.8129513596254823
Energy: 0.8588217004008848
Energy: 0.894255254613438
Energy: 0.8588217004017434
Energy: 0.8639388759369381
Energy: 0.7234423215276246
Energy: 0.8639388759339321
Energy: 0.7234423215259069
Energy: 0.8639388759377967
Energy: 0.7234423215263365
Energy: 0.7310311031277327
Energy: 0.5784513169003903
Energy: 0.7310311031311678
Energy: 0.5784513850010848
Energy: 0.7310311031260152
Energy: 0.5784514332766291
Energy: 0.6038453663848627
Energy: 0.68438946501921
Energy: 0.6038453655603941
Energy: 0.6843894650320919
Energy: 0.6038453660719934
Energy: 0.6843894650041815
Energy: 0.7858172550442367
Energy: 0.6579198378591554
Energy: 0.7858172549635504
Energy: 0.6579198376218195
Energy: 0.7858172545223322
Energy: 0.6579198376565611
Energy: 0.6852826508910308
Energy: 0.7309945352655067
Energy: 0.6852826520322725
Energy: 0.7322991362097603
Energy: 0.6852826599158023
Energy: 0.7309945352672244
Energy: 0.7932731224630742
Energy: 0.8682436581721004
Energy: 0.7932731221488776
Energy: 0.8298462334783635
Energy: 0.7932731221939636
Energy: 0.8682436581703827
Energy: 0.6547583658117686
Energy: 0.6630834967370168
Energy: 0.6547583658109097
Energy: 0.663083497123312
Energy: 0.654758365817741
Energy: 0.6630834968280085
Energy: 0.6791720728956065
Energy: 0.7302480259356321
Energy: 0.6791720728956065
Energy: 0.7302480259309087
Energy: 0.6791720728956065
Energy: 0.7302480259274736
Energy: 0.7345089607702552
Energy: 0.666308343381893
Energy: 0.7334538418202369
Energy: 0.6663083763255451
Energy: 0.7345089607728316
Energy: 0.6663083449369109
Energy: 0.6787184087444738
Energy: 0.7324129701523368
Energy: 0.6787184087461913
Energy: 0.7324129701579188
Energy: 0.6787184087491971
Energy: 0.7324129701596364
Energy: 0.7305948675366999
Energy: 0.7544918413869794
Energy: 0.7303534206282987
Energy: 0.7544918414629425
Energy: 0.7305948675392762
Energy: 0.7544918414401848
Energy: 0.5785037147206802
Energy: 0.7212383404419254
Energy: 0.5785037148168246
Energy: 0.7212383404440723
Energy: 0.5785037277185621
Energy: 0.7212383404363433
Energy: 0.8239233539283924
Energy: 0.6626636256156722
Energy: 0.8239233539322569
Energy: 0.662663575250363
Energy: 0.8239233539296806
Energy: 0.6626635770267902
Energy: 0.7742076533295895
Energy: 0.726811457488322
Energy: 0.7742076509243786
Energy: 0.7268114574896101
Energy: 0.7742076489019888
Energy: 0.7268114574878926
Energy: 0.7316130351679644
Energy: 0.6337685697653391
Energy: 0.7316130351701113
Energy: 0.6337685699782387
Energy: 0.7316130351701113
Energy: 0.63376856996321
Energy: 0.7155139874692494
Energy: 0.683695189297304
Energy: 0.7155146604437452
Energy: 0.6836951893033154
Energy: 0.7155141978230446
Energy: 0.683695189303745
Energy: 0.7974477377396003
Energy: 0.7316743211609983
Energy: 0.7974477377353063
Energy: 0.7317140645191517
Energy: 0.7974477377258988
Energy: 0.7316743211661508
Energy: 0.7792300715585897
Energy: 0.7296322012251378
Energy: 0.7792300715663187
Energy: 0.6295201357890114
Energy: 0.7792300715585897
Energy: 0.7296322012337256
Energy: 0.8599810786600238
Energy: 0.8153271088475332
Energy: 0.8599810786583062
Energy: 0.8562856761672715
Energy: 0.8599810786570181
Energy: 0.8153271088479627
Energy: 0.6544185251993168
Energy: 0.6546256914020252
Energy: 0.6544185251971698
Energy: 0.6546256993902874
Energy: 0.6544185252006048
Energy: 0.6546256979460523
Energy: 0.5908698652648359
Energy: 0.7302749555727365
Energy: 0.5908700164693603
Energy: 0.7302749555658662
Energy: 0.5908700129932497
Energy: 0.7302749555714484
Energy: 0.7382933932497042
Energy: 0.6842151711937839
Energy: 0.7545010031667857
Energy: 0.6842153460519037
Energy: 0.7382933932449809
Energy: 0.6842152981214722
Energy: 0.7708857082683387
Energy: 0.8296398257394393
Energy: 0.7708857082636154
Energy: 0.8296398257402983
Energy: 0.7708857082657624
Energy: 0.8296398257407276
Energy: 0.7309918453164488
Energy: 0.6825961802970755
Energy: 0.7308752048781078
Energy: 0.6825961767973875
Energy: 0.7309918453130138
Energy: 0.6825961765184009
Energy: 0.6618856601945445
Energy: 0.6693933648590256
Energy: 0.5782303845831582
Energy: 0.6693933403371247
Energy: 0.6618856521659198
Energy: 0.6693933235652915
Energy: 0.6621255511292673
Energy: 0.7003859655620805
Energy: 0.5992602130312328
Energy: 0.7003859738688332
Energy: 0.6621255522627799
Energy: 0.7003859764903788
Energy: 0.7309063714706764
Energy: 0.5916759832819202
Energy: 0.7309063714745407
Energy: 0.5916759836476048
Energy: 0.7309063714672412
Energy: 0.5916759835754672
Energy: 0.6657768179694336
Energy: 0.7573453675622894
Energy: 0.6657780388689684
Energy: 0.7573453675631482
Energy: 0.6657805425011161
Energy: 0.7573453675627189
Energy: 0.7554742866408438
Energy: 0.7725868018047544
Energy: 0.7554742866395556
Energy: 0.7725868018064718
Energy: 0.7554742866404144
Energy: 0.7725868018090483
Energy: 0.656748387797207
Energy: 0.7364095998809288
Energy: 0.6567483869182058
Energy: 0.7305193140539276
Energy: 0.6567483784110449
Energy: 0.736409599882217
Energy: 0.7558480422070858
Energy: 0.6389739270245607
Energy: 0.7558480422070858
Energy: 0.5779469241065094
Energy: 0.7558480422096622
Energy: 0.6389739271864019
Energy: 0.8605254288638418
Energy: 0.8562814007117653
Energy: 0.8605254288672767
Energy: 0.8153402054549667
Energy: 0.8605254288672767
Energy: 0.85628140070833
Energy: 0.725452817320926
Energy: 0.6988432206476856
Energy: 0.7254528173200674
Energy: 0.6988431312698373
Energy: 0.7254528173162027
Energy: 0.698843166211404
Energy: 0.6332130464626539
Energy: 0.7313417331139982
Energy: 0.6332130465532162
Energy: 0.7313417331135689
Energy: 0.633213046724465
Energy: 0.7313417331144276
Energy: 0.6835448032170127
Energy: 0.6704300472510899
Energy: 0.6835448032101424
Energy: 0.6704300258666277
Energy: 0.6835448032122895
Energy: 0.6704299898782463
Energy: 0.7322554883504974
Energy: 0.7960632605785686
Energy: 0.7313214516512966
Energy: 0.7960632605772804
Energy: 0.7322554883487798
Energy: 0.7960632605820037
Energy: 0.729630024266813
Energy: 0.6852006635088052
Energy: 0.7296300242741126
Energy: 0.6852003604564125
Energy: 0.7296300242702481
Energy: 0.6852004610428338
Energy: 0.8240469210411413
Energy: 0.8630930681700391
Energy: 0.8240469210398532
Energy: 0.8630930681653547
Energy: 0.8240469210359888
Energy: 0.8630930681700391
Energy: 0.6670241468722466
Energy: 0.6547262241790507
Energy: 0.6670241475851518
Energy: 0.6547262241829153
Energy: 0.6670241357667273
Energy: 0.6547262241769038
Energy: 0.7303572123692224
Energy: 0.6779130648439767
Energy: 0.730357212370081
Energy: 0.6779130648456942
Energy: 0.730357212364499
Energy: 0.6779130648465531

minimum gb energy = 0.5779469241065094 eV
minimum distance =  2.40957059001878 Angstroms
sigma value = 51


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

Energy: 0.7813280226830592
Energy: 0.8038259180911255
Energy: 0.7813280226840542
Energy: 0.8038259180911255
Energy: 0.7813280226830592
Energy: 0.8038259180911255
Energy: 0.8497581028947683
Energy: 0.7594317102271502
Energy: 0.8497581028937734
Energy: 0.7594317102271502
Energy: 0.8497581028937734
Energy: 0.759431710228145
Energy: 0.7630738040993598
Energy: 0.7928338760139302
Energy: 0.7630738041003546
Energy: 0.7928338760149252
Energy: 0.7630738040993598
Energy: 0.7928338760159201
Energy: 0.7814734613590766
Energy: 0.704303952356672
Energy: 0.7814734613590766
Energy: 0.704303952356672
Energy: 0.7814734613580815
Energy: 0.704303952356672
Energy: 0.8014508082973338
Energy: 0.7644886389020099
Energy: 0.8014508082983288
Energy: 0.7644886389030048
Energy: 0.8014508082973338
Energy: 0.7644886389039997
Energy: 0.8475217921151693
Energy: 0.7641856019643034
Energy: 0.8475217921151693
Energy: 0.7641856019652982
Energy: 0.8475217921151693
Energy: 0.7641856019662931
Energy: 0.7569016302669485
Energy: 0.764110861715519
Energy: 0.7569016302679433
Energy: 0.7641108617165138
Energy: 0.7569016302659536
Energy: 0.7641108617145241
Energy: 0.7324126495911878
Energy: 0.7648951193212856
Energy: 0.7324126495921827
Energy: 0.7648951193202906
Energy: 0.7324126495911878
Energy: 0.7648951193222805
Energy: 0.881846515168697
Energy: 0.7010738870851206
Energy: 0.8818465151706868
Energy: 0.7010738870851206
Energy: 0.8818465151090035
Energy: 0.7010738870851206
Energy: 0.7119322893577645
Energy: 0.6335543318854676
Energy: 0.7119322893577645
Energy: 0.633521897635983
Energy: 0.7119322893577645
Energy: 0.6346537961886878
Energy: 0.8298415486903632
Energy: 0.7040616816123741
Energy: 0.8298415486893685
Energy: 0.7040616816123741
Energy: 0.8298415486913582
Energy: 0.7040616816123741
Energy: 0.7829947892097971
Energy: 0.8053089305497625
Energy: 0.782994789210792
Energy: 0.8053089305497625
Energy: 0.782994789210792
Energy: 0.8053089305497625
Energy: 0.8468612401825557
Energy: 0.7595624614682308
Energy: 0.8468612404997904
Energy: 0.7595624614682308
Energy: 0.8468608078256853
Energy: 0.7595624614691805
Energy: 0.7633448960428727
Energy: 0.7360128114290799
Energy: 0.7633448960438676
Energy: 0.7360128114300749
Energy: 0.763344896040883
Energy: 0.7360128114281304
Energy: 0.7819508378162737
Energy: 0.7845935393995924
Energy: 0.7819508378172687
Energy: 0.7845935393995924
Energy: 0.7819508378162737
Energy: 0.7845935393995924
Energy: 0.8000245315599122
Energy: 0.764169014109739
Energy: 0.8000245315609072
Energy: 0.7641690141087442
Energy: 0.8000245315619021
Energy: 0.764169014109739
Energy: 0.8010013365140245
Energy: 0.8302910090086811
Energy: 0.8010013365130295
Energy: 0.8302910090086811
Energy: 0.8010013365130295
Energy: 0.8302910090086811
Energy: 0.7872690133606252
Energy: 0.7681796322407329
Energy: 0.7872690133596302
Energy: 0.7681796322407329
Energy: 0.7872690133606252
Energy: 0.7681796322407329

minimum gb energy = 0.633521897635983 eV
minimum distance =  2.2890015870206 Angstroms
sigma value = 19


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

Energy: 0.633996826854387
Energy: 0.6740521996264621
Energy: 0.633996826854387
Energy: 0.6740521996264621
Energy: 0.633996826854387
Energy: 0.6740521996264621
Energy: 0.7299946753229903
Energy: 0.7790573223692044
Energy: 0.7299946753235806
Energy: 0.7790573223692044
Energy: 0.7299946753235806
Energy: 0.7790573223697946
Energy: 0.6295128244835867
Energy: 0.778926215203247
Energy: 0.6295128244835867
Energy: 0.7789262152026569
Energy: 0.6295128244835867
Energy: 0.7789262152026569
Energy: 0.670207911692849
Energy: 0.6294745406780631
Energy: 0.6702079116910786
Energy: 0.6294745406780631
Energy: 0.6702079116898984
Energy: 0.629474540678653
Energy: 0.6363539388895613
Energy: 0.6326676025930383
Energy: 0.6363539388925121
Energy: 0.6326676025948088
Energy: 0.6363539388925121
Energy: 0.6326676025930383
Energy: 0.6363013749503524
Energy: 0.6325846597562511
Energy: 0.6363013749521229
Energy: 0.6325846597544807
Energy: 0.6363013749479919
Energy: 0.632584659755661
Energy: 0.6701669009968227
Energy: 0.6294534061990912
Energy: 0.6701669009968227
Energy: 0.6294534061996814
Energy: 0.6701669009956425
Energy: 0.6294534061990912
Energy: 0.62950768513031
Energy: 0.7788811892934104
Energy: 0.62950768513031
Energy: 0.7788811892934104
Energy: 0.6295076851309002
Energy: 0.7788811892963612
Energy: 0.7299517177985128
Energy: 0.7790607764391453
Energy: 0.7299517177973326
Energy: 0.7790607764397354
Energy: 0.7299517177996931
Energy: 0.7790607764397354
Energy: 0.633996826854387
Energy: 0.6740521996270255
Energy: 0.6339968268555672
Energy: 0.6740521996270255
Energy: 0.633996826854977
Energy: 0.6740521996264621
Energy: 0.7299946753200397
Energy: 0.7790573223692044
Energy: 0.7299946753206298
Energy: 0.7790573223692044
Energy: 0.7299946753182692
Energy: 0.7790573223692044
Energy: 0.6295128244835867
Energy: 0.7789262152020668
Energy: 0.6295128244829965
Energy: 0.778926215203247
Energy: 0.6295128244835867
Energy: 0.7789262152044274
Energy: 0.6702079116910786
Energy: 0.6294745406780631
Energy: 0.6702079116910786
Energy: 0.6294745406774729
Energy: 0.6702079116898984
Energy: 0.6294745406780631
Energy: 0.6363539388942825
Energy: 0.6326676025930383
Energy: 0.6363539388978233
Energy: 0.6326676025942186
Energy: 0.6363539388948726
Energy: 0.6326676025936284
Energy: 0.6363013749533032
Energy: 0.632584659755661
Energy: 0.6363013749509425
Energy: 0.6325846597550708
Energy: 0.6363013749485821
Energy: 0.6325846597550708
Energy: 0.6701669009968227
Energy: 0.6294534061996814
Energy: 0.6701669009962327
Energy: 0.6294534061996814
Energy: 0.6701669009974128
Energy: 0.6294534061996814
Energy: 0.62950768513031
Energy: 0.7788811892975415
Energy: 0.62950768513031
Energy: 0.7788811892940006
Energy: 0.6295076851297198
Energy: 0.7788811892951809
Energy: 0.7299517177967423
Energy: 0.7790607764391453
Energy: 0.7299517177979227
Energy: 0.7790607764391453
Energy: 0.7299517177985128
Energy: 0.7790607764391453
Energy: 0.633996826854977
Energy: 0.6740521996270255
Energy: 0.633996826854387
Energy: 0.6740521996270255
Energy: 0.633996826854387
Energy: 0.6740521996270255
Energy: 0.7299946753241707
Energy: 0.7790573223692044
Energy: 0.7299946753194496
Energy: 0.7790573223692044
Energy: 0.7299946753241707
Energy: 0.7790573223692044
Energy: 0.6295128244824064
Energy: 0.7789262152026569
Energy: 0.6295128244829965
Energy: 0.7789262152020668
Energy: 0.6295128244829965
Energy: 0.7789262152014766
Energy: 0.6702079116904885
Energy: 0.6294745406774729
Energy: 0.6702079116898984
Energy: 0.6294745406780631
Energy: 0.6702079116904885
Energy: 0.6294745406780631
Energy: 0.6363539388913317
Energy: 0.6326676025942186
Energy: 0.6363539388919219
Energy: 0.6326676025948088
Energy: 0.6363539388954628
Energy: 0.6326676025930383
Energy: 0.6363013749521229
Energy: 0.6325846597550708
Energy: 0.6363013749521229
Energy: 0.6325846597544807
Energy: 0.6363013749485821
Energy: 0.632584659755661
Energy: 0.6701669009985932
Energy: 0.6294534061990912
Energy: 0.6701669009956425
Energy: 0.6294534061996814
Energy: 0.6701669009962327
Energy: 0.6294534061996814
Energy: 0.62950768513031
Energy: 0.7788811892951809
Energy: 0.62950768513031
Energy: 0.7788811892951809
Energy: 0.62950768513031
Energy: 0.7788811892969513
Energy: 0.7299517177979227
Energy: 0.7790607764391453
Energy: 0.7299517177973326
Energy: 0.7790607764397354
Energy: 0.7299517178008733
Energy: 0.7790607764397354
Energy: 0.633996826854387
Energy: 0.6740521996270255
Energy: 0.633996826854977
Energy: 0.6740521996270255
Energy: 0.633996826854387
Energy: 0.6740521996270255
Energy: 0.7299946753224003
Energy: 0.7790573223692044
Energy: 0.7299946753229903
Energy: 0.7790573223692044
Energy: 0.7299946753229903
Energy: 0.7790573223692044
Energy: 0.6295128244835867
Energy: 0.7789262152020668
Energy: 0.6295128244829965
Energy: 0.778926215203247
Energy: 0.6295128244835867
Energy: 0.778926215203247

minimum gb energy = 0.6294534061990912 eV
minimum distance =  2.32200411521789 Angstroms
sigma value = 27


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

Energy: 0.6225954551772015
Energy: 0.6168917766966097
Energy: 0.6225954551757559
Energy: 0.6168917766966097
Energy: 0.6225954551772015
Energy: 0.6168917766966097
Energy: 0.7273603030678822
Energy: 0.6358328315978886
Energy: 0.7273603030693279
Energy: 0.6358328315964432
Energy: 0.7273603030678822
Energy: 0.6358328315949976
Energy: 0.6091398193858187
Energy: 0.686263724081833
Energy: 0.6091398193858187
Energy: 0.6862637240789419
Energy: 0.6091398193858187
Energy: 0.686263724081833
Energy: 0.702052722794429
Energy: 0.6025195694203692
Energy: 0.702052722794429
Energy: 0.6025195694218148
Energy: 0.702052722794429
Energy: 0.6025195694218148
Energy: 0.7591107033450876
Energy: 0.5975742593757879
Energy: 0.7591107033450876
Energy: 0.5975742593772335
Energy: 0.7591107033450876
Energy: 0.5975742593757879
Energy: 0.7251459205137316
Energy: 0.7404539320813908
Energy: 0.7251459205151771
Energy: 0.7404539320813908
Energy: 0.7251459205151771
Energy: 0.7404539320813908
Energy: 0.6469095163331265
Energy: 0.637224758846441
Energy: 0.6469095163331265
Energy: 0.637224758846441
Energy: 0.6469095163331265
Energy: 0.637224758846441
Energy: 0.618793423325425
Energy: 0.6204191172179745
Energy: 0.6187934233239796
Energy: 0.6204191172179745
Energy: 0.618793423322534
Energy: 0.6204191172179745
Energy: 0.6836337173421831
Energy: 0.6446952119772625
Energy: 0.683633717339292
Energy: 0.644695212819653
Energy: 0.6836337173407375
Energy: 0.6446952124064247
Energy: 0.6897049721768566
Energy: 0.719890308772649
Energy: 0.6897049721768566
Energy: 0.7198903087769857
Energy: 0.6897049721768566
Energy: 0.71989030877554
Energy: 0.6504803610554388
Energy: 0.597612772725981
Energy: 0.6504803610554388
Energy: 0.5976127727274265
Energy: 0.6504803610539933
Energy: 0.5976127727274265
Energy: 0.7582093007629702
Energy: 0.6834732815128519
Energy: 0.7582093007644157
Energy: 0.6834732815128519
Energy: 0.7582093007644157
Energy: 0.6834732815099608

minimum gb energy = 0.5975742593757879 eV
minimum distance =  2.28218897534356 Angstroms
sigma value = 9


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

Energy: 0.6203894572190187
Energy: 0.5787413619924537
Energy: 0.6203894572190187
Energy: 0.5787413619920475
Energy: 0.6203894572186126
Energy: 0.5787413619920475
Energy: 0.5810593781771453
Energy: 0.5479936704245262
Energy: 0.581059378128812
Energy: 0.5479936704245262
Energy: 0.5810593781422154
Energy: 0.5479936704245262
Energy: 0.555968692258561
Energy: 0.5990322653555089
Energy: 0.5559686922565302
Energy: 0.5990322653551028
Energy: 0.5559686922581548
Energy: 0.5990322653546967
Energy: 0.565240089280747
Energy: 0.5446102603701807
Energy: 0.5652400892803409
Energy: 0.5446102603697746
Energy: 0.5652400892815593
Energy: 0.5446102603697746
Energy: 0.6107434124497104
Energy: 0.5782506717042883
Energy: 0.6107434124472734
Energy: 0.5782506717042883
Energy: 0.6107434124493043
Energy: 0.5782506717038821
Energy: 0.6048101718218258
Energy: 0.5976511152235865
Energy: 0.6048101718206074
Energy: 0.597651115224805
Energy: 0.6048101718206074
Energy: 0.5976511152235865
Energy: 0.5729059800881335
Energy: 0.6372750837241873
Energy: 0.5729059800865088
Energy: 0.6372750837241873
Energy: 0.5729059800877274
Energy: 0.6372750837245935
Energy: 0.5306099225263418
Energy: 0.5947802483195248
Energy: 0.5306099225239048
Energy: 0.5947802483195248
Energy: 0.5306099225259356
Energy: 0.5947802483195248
Energy: 0.6114012980315396
Energy: 0.5785070178826135
Energy: 0.6114012980315396
Energy: 0.5785070178826135
Energy: 0.6114012980319459
Energy: 0.5785070178822073
Energy: 0.6069664351857667
Energy: 0.5610487470612063
Energy: 0.6069664351845482
Energy: 0.5610487470599878
Energy: 0.6069664351853604
Energy: 0.5610487470632003
Energy: 0.5650588352107809
Energy: 0.5404055902199696
Energy: 0.5650588352119994
Energy: 0.5404055902195634
Energy: 0.5650588352107809
Energy: 0.5404055902199696
Energy: 0.5816003945151045
Energy: 0.5897907246648695
Energy: 0.5816003945146984
Energy: 0.5897907246697435
Energy: 0.5816003945155107
Energy: 0.5897907246709619
Energy: 0.5839075869400127
Energy: 0.5988467570707919
Energy: 0.5839075869469176
Energy: 0.5988467570695735
Energy: 0.583907586943262
Energy: 0.5988467570695735
Energy: 0.6179130743442812
Energy: 0.604928661817829
Energy: 0.6179130743458688
Energy: 0.6049286618190475
Energy: 0.6179130743478998
Energy: 0.6049286618190475
Energy: 0.5504358132791267
Energy: 0.6105230300768588
Energy: 0.5504358132807514
Energy: 0.6105230300764527
Energy: 0.5504358132787205
Energy: 0.6105230300764527
Energy: 0.557316011168492
Energy: 0.6139678372405643
Energy: 0.5573160111701168
Energy: 0.6139678372413765
Energy: 0.5573160111672736
Energy: 0.6139678372413765
Energy: 0.6783460183003228
Energy: 0.5368486195352148
Energy: 0.6783460182986982
Energy: 0.5368486195522736
Energy: 0.6783460182974796
Energy: 0.5368486195547106
Energy: 0.5596086295672625
Energy: 0.5822433075208728
Energy: 0.5596086295701055
Energy: 0.5822433075212791
Energy: 0.5596086295668563
Energy: 0.5822433075212791
Energy: 0.5346106382327094
Energy: 0.6095365554732006
Energy: 0.5346106382343341
Energy: 0.6095365554748253
Energy: 0.5346106382318971
Energy: 0.6095365554760439
Energy: 0.6446900103264971
Energy: 0.5699902985572548
Energy: 0.6446900103264971
Energy: 0.5699902985568486
Energy: 0.6446900103277156
Energy: 0.5699902985568486
Energy: 0.5346069860996121
Energy: 0.6092733481563968
Energy: 0.5346069861004245
Energy: 0.6092733481568029
Energy: 0.5346069861012369
Energy: 0.6092733481608646
Energy: 0.5596011284049275
Energy: 0.582107909317444
Energy: 0.5596011284049275
Energy: 0.5821079093178502
Energy: 0.5596011284045213
Energy: 0.5821079093178502
Energy: 0.6782818773995734
Energy: 0.5368208516690228
Energy: 0.678281877398761
Energy: 0.5368208516524072
Energy: 0.6782818773991672
Energy: 0.5368208516503763
Energy: 0.5575595205818284
Energy: 0.5740586433766045
Energy: 0.5575595205785793
Energy: 0.574058643375386
Energy: 0.5575595205834531
Energy: 0.5740586433766045
Energy: 0.5504085875325356
Energy: 0.6110731569819502
Energy: 0.5504085875345665
Energy: 0.6110731569827625
Energy: 0.5504085875325356
Energy: 0.6110731569823563
Energy: 0.6178607200048641
Energy: 0.6054565559720596
Energy: 0.6178607200097381
Energy: 0.6054565559732781
Energy: 0.6178607200105505
Energy: 0.6054565559732781
Energy: 0.5840272369727404
Energy: 0.598918856004918
Energy: 0.5840272369755835
Energy: 0.5989188560061365
Energy: 0.5840272369755835
Energy: 0.5989188560045118
Energy: 0.5815364174834522
Energy: 0.54699168603959
Energy: 0.5815364174830461
Energy: 0.5469916860440579
Energy: 0.5815364174834522
Energy: 0.5469916860408085
Energy: 0.5650669376516384
Energy: 0.5404228000062768
Energy: 0.5650669376500137
Energy: 0.5404228000058707
Energy: 0.5650669376520445
Energy: 0.5404228000062768
Energy: 0.6070218231307685
Energy: 0.5172758589570429
Energy: 0.6070218231311746
Energy: 0.517275858962286
Energy: 0.6070218231315808
Energy: 0.5172758589618799
Energy: 0.6115868326729644
Energy: 0.5785665543378676
Energy: 0.6115868326782445
Energy: 0.5785665543374614
Energy: 0.6115868326741829
Energy: 0.5785665543382739
Energy: 0.5306358352253531
Energy: 0.5947650148377857
Energy: 0.53063583522779
Energy: 0.594765014838598
Energy: 0.5306358352245407
Energy: 0.5947650148377857
Energy: 0.5731872362122102
Energy: 0.6372466706810059
Energy: 0.5731872362109918
Energy: 0.6372466706810059
Energy: 0.5731872362093671
Energy: 0.6372466706810059
Energy: 0.6048783903491344
Energy: 0.5573269106528738
Energy: 0.6048783903548206
Energy: 0.557326910645969
Energy: 0.6048783903552268
Energy: 0.5573269106508429
Energy: 0.6107423985847633
Energy: 0.5782193057847091
Energy: 0.6107423985847633
Energy: 0.5782193057851154
Energy: 0.6107423985831386
Energy: 0.5782193057847091
Energy: 0.5652187847935036
Energy: 0.5394883094086026
Energy: 0.5652187847959406
Energy: 0.5394883094106334
Energy: 0.5652187847939099
Energy: 0.5394883094086026
Energy: 0.5559364196419743
Energy: 0.599023741321459
Energy: 0.5559364196395744
Energy: 0.5990237413202405
Energy: 0.5559364196444113
Energy: 0.599023741321459
Energy: 0.581104717226539
Energy: 0.579297597885831
Energy: 0.581104717228976
Energy: 0.5792975978866435
Energy: 0.5811047172314131
Energy: 0.579297597888268
Energy: 0.6203894572186126
Energy: 0.5787413619892413
Energy: 0.6203894572202372
Energy: 0.5787413619892413
Energy: 0.6203894572182065
Energy: 0.5787413619892413
Energy: 0.5810593781373413
Energy: 0.5479936704245262
Energy: 0.5810593781409968
Energy: 0.5479936704245262
Energy: 0.5810593781409968
Energy: 0.5479936704245262
Energy: 0.5559686922597795
Energy: 0.5990322653571336
Energy: 0.5559686922593733
Energy: 0.5990322653567274
Energy: 0.5559686922589672
Energy: 0.5990322653563213
Energy: 0.5652400892823717
Energy: 0.5446102603689623
Energy: 0.565240089283184
Energy: 0.5446102603693684
Energy: 0.5652400892823717
Energy: 0.5446102603693684
Energy: 0.6107434124444302
Energy: 0.5782506717042883
Energy: 0.6107434124432117
Energy: 0.5782506717042883
Energy: 0.6107434124444302
Energy: 0.5782506717042883

minimum gb energy = 0.5172758589570429 eV
minimum distance =  2.38037738018818 Angstroms
sigma value = 57


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

Energy: 0.5326585544896731
Energy: 0.4800107829358769
Energy: 0.2603205325585341
Energy: 0.48001078293495236
Energy: 0.532658554487824
Energy: 0.4800107829358769
Energy: 0.5156314171157992
Energy: 0.4720825115309175
Energy: 0.5156314171139501
Energy: 0.4719504230728222
Energy: 0.5156314171139501
Energy: 0.4720825115290684
Energy: 0.49897525903239026
Energy: 0.5088134072241988
Energy: 0.4989752590360885
Energy: 0.4788968914572947
Energy: 0.49897525903331486
Energy: 0.5088134072315953
Energy: 0.482572498839517
Energy: 0.39582562826560486
Energy: 0.48257249884229075
Energy: 0.25978946471295855
Energy: 0.48257249884321535
Energy: 0.39582562826560486
Energy: 0.31004905175130343
Energy: 0.5140552745062802
Energy: 0.3100490517503789
Energy: 0.5140552745081293
Energy: 0.31004905175222797
Energy: 0.514055274504431
Energy: 0.2599995028658696
Energy: 0.4819879818965793
Energy: 0.259999502864945
Energy: 0.48198798189842845
Energy: 0.25999950286679413
Energy: 0.48198798189935305
Energy: 0.25997441040964514
Energy: 0.28426120517698633
Energy: 0.25997441040779595
Energy: 0.2842612051742126
Energy: 0.2599744104068714
Energy: 0.2842612051760618
Energy: 0.536372602836791
Energy: 0.31480238092673046
Energy: 0.5363726028330928
Energy: 0.31480238092857954
Energy: 0.5363726028330928
Energy: 0.31480238092857954
Energy: 0.4816542423929959
Energy: 0.2598377114326348
Energy: 0.4816542423939205
Energy: 0.395848116397466
Energy: 0.4816542423911468
Energy: 0.2598377114307857
Energy: 0.2842897067753707
Energy: 0.5172254250195513
Energy: 0.2842897067716725
Energy: 0.5172254250195513
Energy: 0.2842897067744462
Energy: 0.5172254250177022
Energy: 0.3102132726324387
Energy: 0.45561886014956854
Energy: 0.3102132726342879
Energy: 0.45561886015049313
Energy: 0.3102132726352124
Energy: 0.45561886015049313
Energy: 0.5326585544924468
Energy: 0.48001078293680155
Energy: 0.2603205325576095
Energy: 0.4800107829340278
Energy: 0.5326585544915223
Energy: 0.4800107829358769
Energy: 0.5156314171130254
Energy: 0.4720825115290684
Energy: 0.5156314171130254
Energy: 0.47195042307189755
Energy: 0.5156314171139501
Energy: 0.4720825115299929
Energy: 0.49897525903331486
Energy: 0.5088134072251234
Energy: 0.498975259035164
Energy: 0.47889689145174724
Energy: 0.49897525903423945
Energy: 0.5088134072306708
Energy: 0.4825724988385925
Energy: 0.39582562826745393
Energy: 0.4825724988413662
Energy: 0.2597894647148077
Energy: 0.4825724988413662
Energy: 0.39582562826652945
Energy: 0.31004905175222797
Energy: 0.5140552745053556
Energy: 0.31004905175222797
Energy: 0.5140552745062802
Energy: 0.31004905175222797
Energy: 0.5140552745035065
Energy: 0.25999950286679413
Energy: 0.48198798189750386
Energy: 0.2599995028677187
Energy: 0.48198798189842845
Energy: 0.25999950286956786
Energy: 0.48198798189935305
Energy: 0.25997441040779595
Energy: 0.2842612051760618
Energy: 0.25997441040779595
Energy: 0.2842612051751372
Energy: 0.25997441040872055
Energy: 0.2842612051751372
Energy: 0.5363726028349418
Energy: 0.31480238092673046
Energy: 0.5363726028330928
Energy: 0.31480238092857954
Energy: 0.5363726028321681
Energy: 0.31480238092857954

minimum gb energy = 0.25978946471295855 eV
minimum distance =  2.4623638662282 Angstroms
sigma value = 11


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

Energy: 0.4946222344033224
Energy: 0.6150788514367131
Energy: 0.4946222344033224
Energy: 0.6150788514367131
Energy: 0.4946222344019679
Energy: 0.6150788514360359
Energy: 0.48906516811690076
Energy: 0.5296714342116445
Energy: 0.4890651681196098
Energy: 0.5296714342123218
Energy: 0.48906516811690076
Energy: 0.5296714342116445
Energy: 0.5366489578678971
Energy: 0.6850224492886444
Energy: 0.5366489578672199
Energy: 0.6850224492886444
Energy: 0.5366489578678971
Energy: 0.6850224492893217
Energy: 0.6301412285497434
Energy: 0.4527351924035389
Energy: 0.6301412285497434
Energy: 0.4527351924048934
Energy: 0.6301412285483888
Energy: 0.4527351924028616
Energy: 0.6034496891051379
Energy: 0.4344251995398078
Energy: 0.6034496891064924
Energy: 0.4344251995398078
Energy: 0.6034496891058151
Energy: 0.4344251995398078
Energy: 0.5525257533502674
Energy: 0.45618487692534293
Energy: 0.5525257533516219
Energy: 0.45618487692534293
Energy: 0.5525257533509447
Energy: 0.45618487692602017
Energy: 0.44265679529987995
Energy: 0.4783986737570388
Energy: 0.4426567952985254
Energy: 0.47839867375568423
Energy: 0.44265679530055724
Energy: 0.47839867375568423
Energy: 0.5430514182916006
Energy: 0.4171279796644584
Energy: 0.5430514182888916
Energy: 0.4171279796644584
Energy: 0.5430514182909234
Energy: 0.4171279796651357
Energy: 0.5438072084604708
Energy: 0.4199705241380912
Energy: 0.543807208461148
Energy: 0.4199705241387685
Energy: 0.5438072084618254
Energy: 0.4199705241380912
Energy: 0.42148855012935704
Energy: 0.6483819209727246
Energy: 0.42148855012935704
Energy: 0.6483819209747564
Energy: 0.4214885501300342
Energy: 0.6483819209754337
Energy: 0.5861831092235079
Energy: 0.5998796464574757
Energy: 0.5861831092221533
Energy: 0.5998796464567984
Energy: 0.5861831092235079
Energy: 0.5998796464574757
Energy: 0.6049891292753432
Energy: 0.43564491768009284
Energy: 0.6049891292760206
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Energy: 0.6049891292760206
Energy: 0.4356449176807702
Energy: 0.6279034185802884
Energy: 0.456568658623281
Energy: 0.6279034185809655
Energy: 0.45656865862395835
Energy: 0.6279034185809655
Energy: 0.456568658623281
Energy: 0.6184365037568982
Energy: 0.6733586300636043
Energy: 0.6184365037568982
Energy: 0.6733586300615726
Energy: 0.6184365037575754
Energy: 0.6733586300629271
Energy: 0.48734902119954837
Energy: 0.5300208536630616
Energy: 0.4873490212022574
Energy: 0.5300208536630616
Energy: 0.4873490212022574
Energy: 0.5300208536630616
Energy: 0.4736576701604317
Energy: 0.6159904237833238
Energy: 0.47365767016314075
Energy: 0.6159904237826466
Energy: 0.4736576701617862
Energy: 0.6159904237826466
Energy: 0.4576804720430914
Energy: 0.5293378731378521
Energy: 0.4576804720417369
Energy: 0.5293378731364975
Energy: 0.4576804720410596
Energy: 0.5293378731371747
Energy: 0.6891409933260064
Energy: 0.5042332676240645
Energy: 0.6891409933212654
Energy: 0.5042332676084873
Energy: 0.6891409933280381
Energy: 0.5042332676267737
Energy: 0.5650938026657297
Energy: 0.44981824088732264
Energy: 0.5650938026670842
Energy: 0.44981824088664535
Energy: 0.5650938026657297
Energy: 0.44981824088732264
Energy: 0.604607299473991
Energy: 0.4555206843170384
Energy: 0.6046072994760228
Energy: 0.45552068431839293
Energy: 0.6046072994733137
Energy: 0.4555206843170384
Energy: 0.4218811402082444
Energy: 0.46608887822832956
Energy: 0.4218811402082444
Energy: 0.46608887822562045
Energy: 0.4218811402069515
Energy: 0.46608887822291145
Energy: 0.4586903511366183
Energy: 0.4772444179970611
Energy: 0.45869035113865014
Energy: 0.4772444179984156
Energy: 0.4586903511372956
Energy: 0.4772444179970611
Energy: 0.5431289316646476
Energy: 0.5373140421070409
Energy: 0.5431289316646476
Energy: 0.5373140421070409
Energy: 0.5431289316686496
Energy: 0.5373140421070409
Energy: 0.5456964532716913
Energy: 0.5179019401601362
Energy: 0.5456964532683048
Energy: 0.5179019401608135
Energy: 0.5456964532689822
Energy: 0.5179019401608135
Energy: 0.4219598883132836
Energy: 0.48054165513942115
Energy: 0.4219598883126064
Energy: 0.480541655144162
Energy: 0.4219598883126064
Energy: 0.48054165514077574
Energy: 0.8525570556968038
Energy: 0.5998838054346681
Energy: 0.8525570556968038
Energy: 0.5998838054346681
Energy: 0.852557055695449
Energy: 0.5998838054346681

minimum gb energy = 0.4171279796644584 eV
minimum distance =  2.36992571113593 Angstroms
sigma value = 41


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

Energy: 0.5497524275550473
Energy: 0.46974003547577126
Energy: 0.5497524275571825
Energy: 0.46974003547577126
Energy: 0.5497524275550473
Energy: 0.46974003547577126
Energy: 0.5284181151380168
Energy: 0.6337128687730991
Energy: 0.5284181151385505
Energy: 0.6337128687736329
Energy: 0.5284181151374829
Energy: 0.6337128687736329
Energy: 0.5843988636876556
Energy: 0.5737280086404314
Energy: 0.5843988636881895
Energy: 0.5737280086404314
Energy: 0.5843988636865881
Energy: 0.5737280086409652
Energy: 0.5062120816757507
Energy: 0.46275116457223975
Energy: 0.5062120816746831
Energy: 0.46275116457223975
Energy: 0.5062120816746831
Energy: 0.46275116457277354
Energy: 0.4629530994994967
Energy: 0.48689983783950885
Energy: 0.4629530994989629
Energy: 0.486899837838975
Energy: 0.4629530994989629
Energy: 0.48689983783844115
Energy: 0.6485286006346507
Energy: 0.5087763531799178
Energy: 0.6485286006351845
Energy: 0.5087763531799178
Energy: 0.6485286006346507
Energy: 0.5087763531804514
Energy: 0.4722798734977093
Energy: 0.6942046596846807
Energy: 0.47227987349877687
Energy: 0.6942046596852145
Energy: 0.4722798734977093
Energy: 0.6942046596852145
Energy: 0.466425678506425
Energy: 0.4628768048029835
Energy: 0.4664256785069589
Energy: 0.4628768048024497
Energy: 0.466425678506425
Energy: 0.4628768048024497
Energy: 0.4701910212172204
Energy: 0.48367106249756125
Energy: 0.47019102121615286
Energy: 0.48367106249756125
Energy: 0.4701910212172204
Energy: 0.48367106249756125
Energy: 0.5059888468986958
Energy: 0.5346196427648329
Energy: 0.5059888468992297
Energy: 0.5346196427642991
Energy: 0.5059888468986958
Energy: 0.5346196427642991
Energy: 0.5023718575450331
Energy: 0.5358924338276003
Energy: 0.5023718575455669
Energy: 0.5358924338276003
Energy: 0.5023718575455669
Energy: 0.535892433828134
Energy: 0.46231690441232903
Energy: 0.6898644109498289
Energy: 0.4623169044133967
Energy: 0.6898644109503628
Energy: 0.4623169044133967
Energy: 0.6898644109487613
Energy: 0.47389186883633405
Energy: 0.469146135618661
Energy: 0.47389186883633405
Energy: 0.46914613561919477
Energy: 0.47389186883633405
Energy: 0.46914613561919477
Energy: 0.4460583123632974
Energy: 0.5169962249227349
Energy: 0.44605831236383114
Energy: 0.5169962249216673
Energy: 0.4460583123632974
Energy: 0.5169962249227349
Energy: 0.5068985761915887
Energy: 0.505700190599091
Energy: 0.5068985761942577
Energy: 0.505700190599091
Energy: 0.5068985761931901
Energy: 0.505700190599091
Energy: 0.45407773045426986
Energy: 0.48967908734736104
Energy: 0.4540777304553375
Energy: 0.48967908734789484
Energy: 0.4540777304537361
Energy: 0.4896790873468272
Energy: 0.48103680698488815
Energy: 0.4690427725081835
Energy: 0.48103680698435436
Energy: 0.4690427725081835
Energy: 0.48103680698488815
Energy: 0.4690427725081835
Energy: 0.50597912424982
Energy: 0.5745840325197261
Energy: 0.5059791242492861
Energy: 0.5745840325213276
Energy: 0.5059791242482184
Energy: 0.5745840325207937
Energy: 0.518454245618087
Energy: 0.4982138310601165
Energy: 0.518454245618087
Energy: 0.49821383106065026
Energy: 0.518454245618087
Energy: 0.4982138310595827
Energy: 0.5017153153682744
Energy: 0.7568568188517757
Energy: 0.5017153153703854
Energy: 0.7568568188517757
Energy: 0.5017153153688083
Energy: 0.7568568188523095
Energy: 0.48046522941541225
Energy: 0.6341592716641062
Energy: 0.48046522941541225
Energy: 0.6341592716641062
Energy: 0.48046522941541225
Energy: 0.6341592716641062
Energy: 0.5035306697925742
Energy: 0.5736051714310917
Energy: 0.5035306697915066
Energy: 0.5736051714310917
Energy: 0.503530669793108
Energy: 0.5736051714310917
Energy: 0.5086288866967176
Energy: 0.4602503565471177
Energy: 0.5086288866977852
Energy: 0.4602503565465839
Energy: 0.5086288866967176
Energy: 0.4602503565471177
Energy: 0.45454910249525005
Energy: 0.6488984728933704
Energy: 0.45454910249525005
Energy: 0.648898472894438
Energy: 0.4545491024947163
Energy: 0.648898472892861
Energy: 0.44913069926085813
Energy: 0.6956555625654188
Energy: 0.4491306992603243
Energy: 0.6956555625659525
Energy: 0.4491306992603243
Energy: 0.6956555625654188
Energy: 0.47087247635169766
Energy: 0.4853105884854021
Energy: 0.47087247635223145
Energy: 0.4853105884854021
Energy: 0.47087247635169766
Energy: 0.4853105884854021
Energy: 0.46234661455648657
Energy: 0.46027561665347183
Energy: 0.4623466145559528
Energy: 0.460275616652938
Energy: 0.46234661455648657
Energy: 0.460275616652938
Energy: 0.4687966857077498
Energy: 0.751594983155119
Energy: 0.4687966857082836
Energy: 0.751594983155119
Energy: 0.46879668570881733
Energy: 0.7515949831556528
Energy: 0.5022290542069416
Energy: 0.4983031712280591
Energy: 0.5022290542069416
Energy: 0.4983031712237887
Energy: 0.5022290542080092
Energy: 0.4983031712248564
Energy: 0.5495705003179298
Energy: 0.4464262298054684
Energy: 0.5495705003168622
Energy: 0.4464262298054684
Energy: 0.5495705003179298
Energy: 0.4464262298060023
Energy: 0.45704457695970163
Energy: 0.4765085050468663
Energy: 0.45704457695970163
Energy: 0.47650850504953535
Energy: 0.45704457695970163
Energy: 0.4765085050484677
Energy: 0.47212728392195263
Energy: 0.4769721221641455
Energy: 0.47212728392195263
Energy: 0.4769721221641455
Energy: 0.4721272839224864
Energy: 0.4769721221641455
Energy: 0.4486066186391477
Energy: 0.48927639569570597
Energy: 0.4486066186391477
Energy: 0.48927639569570597
Energy: 0.4486066186391477
Energy: 0.4892763956951722

minimum gb energy = 0.4460583123632974 eV
minimum distance =  2.39957478009195 Angstroms
sigma value = 33


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

Energy: 0.541527065764573
Energy: 0.504977294177583
Energy: 0.5415270657668206
Energy: 0.5049772941772083
Energy: 0.5415270657638237
Energy: 0.5049772941772083
Energy: 0.5587666549210296
Energy: 0.5032772483649164
Energy: 0.5587666549191564
Energy: 0.5032772483652911
Energy: 0.5587666549199058
Energy: 0.5032772483645418
Energy: 0.5222219083513133
Energy: 0.5819226449217536
Energy: 0.5222219083513133
Energy: 0.581922644927373
Energy: 0.5222219083509387
Energy: 0.5819226449258745
Energy: 0.526633668935431
Energy: 0.4941342629022346
Energy: 0.5266336689350563
Energy: 0.4941342629022346
Energy: 0.5266336689335578
Energy: 0.49413426290260926
Energy: 0.5070829642808938
Energy: 0.5682699642502378
Energy: 0.5070829642805194
Energy: 0.5682699642457422
Energy: 0.5070829642805194
Energy: 0.5682699642431199
Energy: 0.5280724478033771
Energy: 0.5069856471310713
Energy: 0.5280724477981664
Energy: 0.5069856471310713
Energy: 0.5280724478018788
Energy: 0.5069856471306966
Energy: 0.5234358429953339
Energy: 0.5631663665562909
Energy: 0.5234358429957084
Energy: 0.5631663665566656
Energy: 0.5234358429957084
Energy: 0.5631663665570403
Energy: 0.5405170600022102
Energy: 0.569242052200288
Energy: 0.5405170599995878
Energy: 0.5692420521999133
Energy: 0.5405170600003371
Energy: 0.5692420522006626
Energy: 0.6023368855474585
Energy: 0.5173902484014072
Energy: 0.6023368855493317
Energy: 0.5173902484010325
Energy: 0.602336885553078
Energy: 0.5173902484010325
Energy: 0.6313051432743053
Energy: 0.5167622773047329
Energy: 0.6313051432735559
Energy: 0.5167622773039837
Energy: 0.6313051432750545
Energy: 0.5167622773039837
Energy: 0.5348079806366051
Energy: 0.5344783499324753
Energy: 0.5348079806362305
Energy: 0.5344783499313515
Energy: 0.5348079806354813
Energy: 0.5344783499306022
Energy: 0.5382118628723963
Energy: 0.49419544056437104
Energy: 0.5382118628731455
Energy: 0.4941954405639964
Energy: 0.5382118628731455
Energy: 0.49419544056437104
Energy: 0.5199517768379186
Energy: 0.6026674297735989
Energy: 0.5199517768364201
Energy: 0.6026674297747227
Energy: 0.5199517768371694
Energy: 0.6026674297735989
Energy: 0.5630897451967385
Energy: 0.5367649721185913
Energy: 0.5630897451956145
Energy: 0.5367649721182167
Energy: 0.5630897451974877
Energy: 0.5367649721189659
Energy: 0.5563111096420206
Energy: 0.5228187529634989
Energy: 0.5563111096408967
Energy: 0.5228187529631244
Energy: 0.5563111096438936
Energy: 0.5228187529627497
Energy: 0.5102552513594869
Energy: 0.5289225275875628
Energy: 0.5102552513591122
Energy: 0.5289225275909343
Energy: 0.5102552513598615
Energy: 0.5289225275879375
Energy: 0.5527770408988337
Energy: 0.503925264636402
Energy: 0.5527770408861304
Energy: 0.5039252646360274
Energy: 0.5527770408992084
Energy: 0.5039252646360274
Energy: 0.49192476479903174
Energy: 0.5285271739436602
Energy: 0.49192476479903174
Energy: 0.5285271739444094
Energy: 0.49192476479790787
Energy: 0.5285271739444094
Energy: 0.5844309949875953
Energy: 0.5223604742272665
Energy: 0.5844309949857222
Energy: 0.5223604742272665
Energy: 0.5844309949879699
Energy: 0.5223604742272665
Energy: 0.519491881923985
Energy: 0.5300255495055397
Energy: 0.5194918819326015
Energy: 0.530025549505165
Energy: 0.5194918819314777
Energy: 0.530025549505165
Energy: 0.5029054513303602
Energy: 0.5388784791796747
Energy: 0.5029054513318587
Energy: 0.5388784791796747
Energy: 0.5029054513322334
Energy: 0.5388784791796747
Energy: 0.500456115511566
Energy: 0.5607260603293458
Energy: 0.5004561155100675
Energy: 0.5607260603293458
Energy: 0.5004561155119406
Energy: 0.5607260603289711
Energy: 0.5560693003459197
Energy: 0.499364110769469
Energy: 0.5560693003477929
Energy: 0.4993641107687197
Energy: 0.5560693003492914
Energy: 0.49936411076909437
Energy: 0.49767885150909924
Energy: 0.5603711627420468
Energy: 0.4976788515068514
Energy: 0.5603711627431707
Energy: 0.49767885150834995
Energy: 0.5603711627420468
Energy: 0.5674473734430496
Energy: 0.5037471483213449
Energy: 0.5674473734396779
Energy: 0.5037471483217196
Energy: 0.5674473734363064
Energy: 0.5037471483220942
Energy: 0.5055445195907975
Energy: 0.559286770392557
Energy: 0.5055445195892989
Energy: 0.5592867703921824
Energy: 0.5055445195892989
Energy: 0.5592867703933063
Energy: 0.5579192126897262
Energy: 0.5248982257970095
Energy: 0.5579192126893517
Energy: 0.5248982257966349
Energy: 0.5579192126893517
Energy: 0.5248982257966349
Energy: 0.5308984132265988
Energy: 0.49840596807273857
Energy: 0.5308984132258496
Energy: 0.4984059680731132
Energy: 0.5308984132262243
Energy: 0.4984059680731132
Energy: 0.5188773864381669
Energy: 0.6027299593338394
Energy: 0.5188773864381669
Energy: 0.6027299593349632
Energy: 0.5188773864385415
Energy: 0.602729959334214
Energy: 0.5148734468184573
Energy: 0.6308711554419961
Energy: 0.5148734468180827
Energy: 0.6308711554330051
Energy: 0.514873446817708
Energy: 0.630871155436002
Energy: 0.5254961893052432
Energy: 0.4911893769212827
Energy: 0.5254961893056179
Energy: 0.4911893769209081
Energy: 0.5254961893048686
Energy: 0.4911893769209081
Energy: 0.4978364533419687
Energy: 0.5562798219931876
Energy: 0.4978364533408448
Energy: 0.5562798219965251
Energy: 0.4978364533400956
Energy: 0.5562798219943114
Energy: 0.5711666762534762
Energy: 0.5157552920910686
Energy: 0.5711666762456089
Energy: 0.5157552920914433
Energy: 0.5711666762845361
Energy: 0.515755292091818
Energy: 0.5348140777070769
Energy: 0.5596605048640088
Energy: 0.5348140777063275
Energy: 0.5596605048643835
Energy: 0.5348140777070769
Energy: 0.559660504864758
Energy: 0.5347701084448001
Energy: 0.5595632905154665
Energy: 0.5347701084436762
Energy: 0.5595632905143766
Energy: 0.5347701084440508
Energy: 0.5595632905154665
Energy: 0.7829044084473733
Energy: 0.5157581101680734
Energy: 0.7829044084455002
Energy: 0.5157581101680734
Energy: 0.7829044084473733
Energy: 0.5157581101684481
Energy: 0.49784920603494565
Energy: 0.5539655226751575
Energy: 0.49784920603344707
Energy: 0.5539655226785292
Energy: 0.4978492060341964
Energy: 0.5539655226762814
Energy: 0.5259096757884539
Energy: 0.49114709684244023
Energy: 0.5259096757880795
Energy: 0.49114709684244023
Energy: 0.5259096757892032
Energy: 0.4911470968428148
Energy: 0.5148194261449441
Energy: 0.6271018772690141
Energy: 0.5148194261453187
Energy: 0.627101877280253
Energy: 0.514819426144195
Energy: 0.6271018772536544
Energy: 0.5188639102312779
Energy: 0.6023975480876199
Energy: 0.5188639102316526
Energy: 0.602397548086496
Energy: 0.5188639102324019
Energy: 0.6023975480887439
Energy: 0.5308552479645698
Energy: 0.49852572225522895
Energy: 0.530855247965319
Energy: 0.49852572225560365
Energy: 0.5308552479641951
Energy: 0.49852572225522895
Energy: 0.5579757567749932
Energy: 0.5251406566864582
Energy: 0.5579757567738695
Energy: 0.5251406566864582
Energy: 0.5579757567746187
Energy: 0.5251406566864582
Energy: 0.5055172247623535
Energy: 0.5595182242955853
Energy: 0.5055172247623535
Energy: 0.5595182242944614
Energy: 0.5055172247623535
Energy: 0.55951822429596
Energy: 0.5675027959427473
Energy: 0.5037434194551035
Energy: 0.567502795941998
Energy: 0.5037434194554781
Energy: 0.5675027959468681
Energy: 0.5037434194551035
Energy: 0.49765925384983595
Energy: 0.5604119934758899
Energy: 0.4976592538490867
Energy: 0.5604119934747659
Energy: 0.49765925384796283
Energy: 0.5604119934755153
Energy: 0.5560537044229832
Energy: 0.49930317516714035
Energy: 0.5560537044229832
Energy: 0.4993031751678896
Energy: 0.556053704422234
Energy: 0.499303175167515
Energy: 0.5004685474602913
Energy: 0.5606554096720678
Energy: 0.5004685474606659
Energy: 0.5606554096720678
Energy: 0.5004685474610405
Energy: 0.5606554096724425

minimum gb energy = 0.49114709684244023 eV
minimum distance =  2.40056943000728 Angstroms
sigma value = 67


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

Energy: 0.5637689441509756
Energy: 0.5473897719682222
Energy: 0.5637689441517153
Energy: 0.5473897719682222
Energy: 0.5637689441517153
Energy: 0.5473897719682222
Energy: 0.5574429391140405
Energy: 0.5351894863416116
Energy: 0.5574429391137844
Energy: 0.5351894863413554
Energy: 0.5574429391135283
Energy: 0.5351894863418677
Energy: 0.7631206311895754
Energy: 0.6568190656252153
Energy: 0.7631206311900591
Energy: 0.6568190656247032
Energy: 0.7631206311903151
Energy: 0.6568190656249592
Energy: 0.5574375885278868
Energy: 0.5352090647663285
Energy: 0.5574375885276307
Energy: 0.5352090647665844
Energy: 0.5574375885278868
Energy: 0.5352090647663285
Energy: 0.5637689441534793
Energy: 0.547389771970726
Energy: 0.5637689441537355
Energy: 0.5473897719709535
Energy: 0.5637689441534793
Energy: 0.547389771970726
Energy: 0.5574429391162882
Energy: 0.5351894863433756
Energy: 0.5574429391158044
Energy: 0.5351894863433756
Energy: 0.557442939116032
Energy: 0.5351894863433756
Energy: 0.7631206311900591
Energy: 0.656819065627463
Energy: 0.7631206311903151
Energy: 0.6568190656269792
Energy: 0.7631206311900591
Energy: 0.6568190656272068

minimum gb energy = 0.5351894863413554 eV
minimum distance =  2.41110588782783 Angstroms
sigma value = 3


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

Energy: 0.7412435579237195
Energy: 0.69198336793551
Energy: 0.7412435579274985
Energy: 0.6919833679358816
Energy: 0.741243557924401
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Energy: 0.6917870942571307
Energy: 0.647525131331375
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Energy: 0.6475251313310033
Energy: 0.6917870942564494
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Energy: 0.6887849858939926
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Energy: 0.6668699772382221
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Energy: 0.6668699772365495
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Energy: 0.6591909253326962
Energy: 0.7160591280799221
Energy: 0.6878615813609785
Energy: 0.716059128081285
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Energy: 0.6558293367818228
Energy: 0.6732463309544308
Energy: 0.6558293367784155
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Energy: 0.685085956488739
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Energy: 0.7183111068911613
Energy: 0.6612714750227922
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Energy: 0.6451939533488017
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Energy: 0.6451939533504742
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Energy: 0.6845164494975964
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Energy: 0.6544567672766505
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Energy: 0.6544567672848277
Energy: 0.6894729095892967
Energy: 0.6462690013553686
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Energy: 0.6894729095906597
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Energy: 0.6707284063475577
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Energy: 0.6707284063475577
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Energy: 0.6745186411268584
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Energy: 0.6745186411251859
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Energy: 0.6544973709553594
Energy: 0.7006140984045831
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Energy: 0.7006140984021672
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Energy: 0.645197354721671
Energy: 0.6715133082254734
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Energy: 0.6816934779496922
Energy: 0.6748539128677212
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Energy: 0.6591196164503752
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Energy: 0.6747378990113369
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Energy: 0.6837828602533469
Energy: 0.6543262882644447
Energy: 0.6837828602526655
Energy: 0.6543262882634535
Energy: 0.6837828602529752
Energy: 0.6838937879704702
Energy: 0.6738790926566804
Energy: 0.6838937879711517
Energy: 0.6738790926566804
Energy: 0.6838937879715233
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Energy: 0.667867117069657
Energy: 0.6384891139822496
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Energy: 0.6384891139833027
Energy: 0.6678671170689756
Energy: 0.6384891139826213
Energy: 0.6861761046267145
Energy: 0.6362795491167532
Energy: 0.6861761046253516
Energy: 0.6362795491178064
Energy: 0.6861761046264047
Energy: 0.6362795491191693
Energy: 0.6908213535867525
Energy: 0.6514822101344256
Energy: 0.6908213535867525
Energy: 0.6514822101347975
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Energy: 0.7072292635178684
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Energy: 0.6447923251029434
Energy: 0.6841171505076751
Energy: 0.6967628247868228
Energy: 0.6841171505080467
Energy: 0.6967628247871945
Energy: 0.6841171505097194
Energy: 0.6967628247868228
Energy: 0.6752920181353201
Energy: 0.6615907928294883
Energy: 0.675292018136683
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Energy: 0.6752920181363113
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Energy: 0.673861701417967
Energy: 0.6783086520556297
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Energy: 0.673861701417967
Energy: 0.6404729695385459
Energy: 0.7064141636830524
Energy: 0.6404729695392273
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Energy: 0.6404729695402804
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Energy: 0.700639181858946
Energy: 0.6404298307087686
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Energy: 0.703140270989751
Energy: 0.6739075708789415
Energy: 0.7031402709917953
Energy: 0.6739075708792512
Energy: 0.7031402709914236
Energy: 0.6739075708785699
Energy: 0.6464045041136488
Energy: 0.7056995844650067
Energy: 0.6464045041160028
Energy: 0.705699584464635
Energy: 0.6464045041150116
Energy: 0.7056995844653164
Energy: 0.7245086219370662
Energy: 0.6408904438141486
Energy: 0.7245086219377476
Energy: 0.6408904438134673
Energy: 0.7245086219343404
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Energy: 0.6476174486747617
Energy: 0.668378781636309
Energy: 0.6476174486740801
Energy: 0.6683787816353178
Energy: 0.6476174486716642
Energy: 0.6683787816359994
Energy: 0.6914917059932734
Energy: 0.636118678146977
Energy: 0.6914917059908574
Energy: 0.6361186781472867
Energy: 0.6914917059922202
Energy: 0.6361186781472867
Energy: 0.671450598585471
Energy: 0.6926076548649468
Energy: 0.6714505985837363
Energy: 0.6926076548649468
Energy: 0.671450598584108
Energy: 0.692607654864637
Energy: 0.7240916243955887
Energy: 0.641109372577672
Energy: 0.7240916243955887
Energy: 0.6411093725773622
Energy: 0.7240916243955887
Energy: 0.641109372577672
Energy: 0.6662946214902703
Energy: 0.669051259352604
Energy: 0.6662946214889074
Energy: 0.669051259352604
Energy: 0.6662946214885976
Energy: 0.6690512593519226
Energy: 0.6907819883586729
Energy: 0.641865689313641
Energy: 0.69078198835731
Energy: 0.6418656893115967
Energy: 0.6907819883583631
Energy: 0.6418656893109153
Energy: 0.6464062267982852
Energy: 0.709632403750177
Energy: 0.6464062268023738
Energy: 0.7096324037522213
Energy: 0.6464062267986569
Energy: 0.709632403750177
Energy: 0.6819878694063567
Energy: 0.6606199329350901
Energy: 0.6819878694060468
Energy: 0.6606199329357716
Energy: 0.6819878694077196
Energy: 0.6606199329333556
Energy: 0.6676306580540928
Energy: 0.6878490750344775
Energy: 0.6676306580527299
Energy: 0.687849075033796
Energy: 0.6676306580534115
Energy: 0.687849075033796

minimum gb energy = 0.636118678146977 eV
minimum distance =  2.33326026482195 Angstroms
sigma value = 81


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

Energy: 0.7653136038892362
Energy: 0.7033883584606861
Energy: 0.7383211190702398
Energy: 0.7033883584532041
Energy: 0.7653136038859627
Energy: 0.7033883584555422
Energy: 0.7443440893626426
Energy: 0.6758128005261325
Energy: 0.7443440893640456
Energy: 0.6758128005270677
Energy: 0.7443440893617074
Energy: 0.6758128005266001
Energy: 0.6993639399277595
Energy: 0.6089251093689784
Energy: 0.6997014421109401
Energy: 0.6089251093647696
Energy: 0.6993639399357092
Energy: 0.6089251093652372
Energy: 0.6481579426755363
Energy: 0.6715152510654836
Energy: 0.6481579426760039
Energy: 0.6715152510720304
Energy: 0.6481579426797448
Energy: 0.671515251072498
Energy: 0.7448523900302488
Energy: 0.6575387307406793
Energy: 0.7448523900316517
Energy: 0.6575387307374058
Energy: 0.7448523900335222
Energy: 0.6575387307374058
Energy: 0.6835546508399069
Energy: 0.7013523523075108
Energy: 0.6835546508408422
Energy: 0.7013523523103166
Energy: 0.6835546508413097
Energy: 0.7013523523098489
Energy: 0.6860965213663978
Energy: 0.7068954781733942
Energy: 0.6860403689760828
Energy: 0.7068954781743294
Energy: 0.6860965213678006
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Energy: 0.6997737443098357
Energy: 0.7117709426428503
Energy: 0.6997588904518306
Energy: 0.7117709426493971
Energy: 0.6997737443094105
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Energy: 0.7411641167897984
Energy: 0.6816617573995937
Energy: 0.7411641167902661
Energy: 0.6816617574019319
Energy: 0.7411641167912014
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Energy: 0.7482744898115148
Energy: 0.6897290717515855
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Energy: 0.7482744898115148
Energy: 0.6897290717576647
Energy: 0.7188062714470507
Energy: 0.6980862242944305
Energy: 0.7188062714461579
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Energy: 0.7188062714470507
Energy: 0.6980862242953657
Energy: 0.6684701972013171
Energy: 0.6946768033517434
Energy: 0.6684701972022524
Energy: 0.6946768033564197
Energy: 0.6684701972013171
Energy: 0.694676803355952
Energy: 0.7257935249977814
Energy: 0.7576680829672902
Energy: 0.7257935249940405
Energy: 0.7576680829644845
Energy: 0.7257935249917022
Energy: 0.7576680829640168
Energy: 0.6821955047860851
Energy: 0.6035348701429829
Energy: 0.6821955047870204
Energy: 0.6035348701387744
Energy: 0.6821955047888909
Energy: 0.6035348701392419
Energy: 0.6040269283051928
Energy: 0.6939399350223185
Energy: 0.6040269283056604
Energy: 0.693939935012966
Energy: 0.6040269283070634
Energy: 0.693939935012966
Energy: 0.6994610507264454
Energy: 0.6297418290818132
Energy: 0.6994610507250424
Energy: 0.6297418290790074
Energy: 0.6994610507250424
Energy: 0.6297418290785398
Energy: 0.7558965464222748
Energy: 0.6876564762611289
Energy: 0.7561892264625708
Energy: 0.6876564762625318
Energy: 0.7558965464246129
Energy: 0.6876564762629994
Energy: 0.6874471984727867
Energy: 0.776842905509848
Energy: 0.687463915397257
Energy: 0.7768429055065746
Energy: 0.6874471984695133
Energy: 0.7768429055051718
Energy: 0.6051795364188477
Energy: 0.701230794046691
Energy: 0.6051795364169772
Energy: 0.7012307940490291
Energy: 0.6051795364169772
Energy: 0.7012307940494967
Energy: 0.6718387830025012
Energy: 0.7414279365661971
Energy: 0.6718387830043717
Energy: 0.7414279365680676
Energy: 0.6718387830048392
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Energy: 0.6593485197271518
Energy: 0.7572759203860423
Energy: 0.6593485197322959
Energy: 0.7572759203907186
Energy: 0.6593485197304253
Energy: 0.7572759203902509
Energy: 0.7037013463669697
Energy: 0.6834196116650876
Energy: 0.6676318326611801
Energy: 0.6834196116613467
Energy: 0.7037013463697755
Energy: 0.6834196116618142
Energy: 0.7216442568939994
Energy: 0.5996860430963225
Energy: 0.6676416219509439
Energy: 0.5996860430930491
Energy: 0.7216442568874526
Energy: 0.5996860430939843
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Energy: 0.7391695755167228
Energy: 0.68171177654107
Energy: 0.7391695755148522
Energy: 0.6817117765415377
Energy: 0.7391695755148522
Energy: 0.7071831540920994
Energy: 0.7860959123992753
Energy: 0.7071831540911641
Energy: 0.7860959123978725
Energy: 0.707183154088826
Energy: 0.7860959123974048
Energy: 0.7066838979724255
Energy: 0.647118638313455
Energy: 0.706683897970555
Energy: 0.6471186383167283
Energy: 0.7066838979761665
Energy: 0.6471186383167283
Energy: 0.7192647246143822
Energy: 0.6868626085363744
Energy: 0.7193571692484996
Energy: 0.6868626085424535
Energy: 0.7192647246162527
Energy: 0.6868626085457269
Energy: 0.7002568071446463
Energy: 0.7475849542480067
Energy: 0.7002840923423043
Energy: 0.747584954250345
Energy: 0.7002568071441787
Energy: 0.747584954250345
Energy: 0.6036318990515482
Energy: 0.6582548520251121
Energy: 0.6036318990529511
Energy: 0.6582548520246445
Energy: 0.6036318990552894
Energy: 0.6582548520246445
Energy: 0.6713832495733859
Energy: 0.7047371189732389
Energy: 0.6713832495785298
Energy: 0.7047371189694978
Energy: 0.6713832495808679
Energy: 0.7047371189685626
Energy: 0.6926934983437226
Energy: 0.6990776105567833
Energy: 0.6926934983413845
Energy: 0.6990776105572508
Energy: 0.6926934983404492
Energy: 0.6990776105572508
Energy: 0.6683216826654028
Energy: 0.6802552331180544
Energy: 0.6683216826663381
Energy: 0.6802552331213277
Energy: 0.6683216826649352
Energy: 0.6802552331208602
Energy: 0.6691075315502208
Energy: 0.598985875630323
Energy: 0.669107531548818
Energy: 0.5989858756359344
Energy: 0.6691075315520914
Energy: 0.5989858756364022
Energy: 0.7203274917659784
Energy: 0.7816078844172607
Energy: 0.7202230822105848
Energy: 0.7816078844191312
Energy: 0.7203274917603669
Energy: 0.7816078844224046
Energy: 0.7579166954752456
Energy: 0.7342957458122447
Energy: 0.7579166954766486
Energy: 0.7342957458094389
Energy: 0.7579166954757133
Energy: 0.7342957458094389
Energy: 0.6997692952703334
Energy: 0.6656826502188586
Energy: 0.699769295268463
Energy: 0.6656826502137146
Energy: 0.6997692952651895
Energy: 0.6656826502137146
Energy: 0.6995921206128489
Energy: 0.7155240746611911
Energy: 0.699592120611446
Energy: 0.7155240746616587
Energy: 0.699592120611446
Energy: 0.7155240746621263

minimum gb energy = 0.598985875630323 eV
minimum distance =  2.30868318865324 Angstroms
sigma value = 43


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

Energy: 0.760166597852561
Energy: 0.6267162451861935
Energy: 0.7601665978519867
Energy: 0.6267162451861935
Energy: 0.760166597852561
Energy: 0.6267162451861935
Energy: 0.6502006288603107
Energy: 0.6199472814946106
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Energy: 0.6502006288603107
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Energy: 0.7045422336749123
Energy: 0.7202428877664114
Energy: 0.7045422336743379
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Energy: 0.7045422336743379
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Energy: 0.6259789518778992
Energy: 0.6519551801465177
Energy: 0.6259789518784735
Energy: 0.6519551801442199
Energy: 0.6259789518773248
Energy: 0.6519551801453688
Energy: 0.7039859460053203
Energy: 0.6797025172447793
Energy: 0.7039859460053203
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Energy: 0.7039859460058947
Energy: 0.6797025172459281
Energy: 0.6421788216109898
Energy: 0.6622139918479807
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Energy: 0.6622139918479807
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Energy: 0.662213991848555
Energy: 0.6404033482273641
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Energy: 0.6825617526060135
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Energy: 0.6707813090024083
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Energy: 0.6707813090012595
Energy: 0.6397907626443647
Energy: 0.670781309001834
Energy: 0.7408646410516674
Energy: 0.6184624987116344
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Energy: 0.740864641051093
Energy: 0.6184624987116344
Energy: 0.6610269647286096
Energy: 0.6577979637340242
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Energy: 0.6577979637334499
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Energy: 0.6592282342656901
Energy: 0.6667707217907884
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Energy: 0.6667707217907884
Energy: 0.6398094527110607
Energy: 0.6595213684117319
Energy: 0.6398094527110607
Energy: 0.659521368339958
Energy: 0.6398094527110607
Energy: 0.6595213683405324
Energy: 0.7248098037100972
Energy: 0.6633944519218319
Energy: 0.7248098037095226
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Energy: 0.7248098037100972
Energy: 0.6633944519224063
Energy: 0.6131285478422607
Energy: 0.6592339508511071
Energy: 0.6131285478416862
Energy: 0.6592339508511071
Energy: 0.6131285478416862
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Energy: 0.6714067666495503
Energy: 0.6832682612767137
Energy: 0.6714067666495503
Energy: 0.6832682612767137
Energy: 0.6714067666489759
Energy: 0.6832682612761394
Energy: 0.6579277800245434
Energy: 0.7187725991468412
Energy: 0.6579277800274154
Energy: 0.7187725991468412
Energy: 0.6579277800262665
Energy: 0.7187725991468412
Energy: 0.6777189520138073
Energy: 0.620825157419841
Energy: 0.6777189520155303
Energy: 0.6208251574192667
Energy: 0.6777189520138073
Energy: 0.620825157419841
Energy: 0.6991570979471848
Energy: 0.649489429515006
Energy: 0.6991570979471848
Energy: 0.6494894295144316
Energy: 0.6991570979471848
Energy: 0.6494894295144316
Energy: 0.6987793855985165
Energy: 0.6362455933422738
Energy: 0.6987793855979422
Energy: 0.6362455933428481
Energy: 0.6987793855979422
Energy: 0.6362455933428481
Energy: 0.677959129731381
Energy: 0.6207180681976324
Energy: 0.6779591297296577
Energy: 0.6207180681976324
Energy: 0.6779591297290833
Energy: 0.620718068197058
Energy: 0.6581669380552762
Energy: 0.659981221351925
Energy: 0.6581669380547017
Energy: 0.6599812213524994
Energy: 0.6581669380564249
Energy: 0.6599812213524994
Energy: 0.6926892632978787
Energy: 0.7175334140027051
Energy: 0.6926892632984532
Energy: 0.7175334140027051
Energy: 0.6926892632978787
Energy: 0.7175334140032795
Energy: 0.613416288693696
Energy: 0.6825978724532695
Energy: 0.6134162886948449
Energy: 0.6825978724532695
Energy: 0.6134162886948449
Energy: 0.682597872453844
Energy: 0.7229128368108673
Energy: 0.6624576744427562
Energy: 0.7229128368108673
Energy: 0.6624576744433306
Energy: 0.7229128368108673
Energy: 0.6624576744433306
Energy: 0.6393555805464798
Energy: 0.6426103526875425
Energy: 0.6393555805470541
Energy: 0.6426103526881168
Energy: 0.6393555805464798
Energy: 0.6426103526881168
Energy: 0.693153548906088
Energy: 0.6708826448824866
Energy: 0.6931535489066625
Energy: 0.6708826448824866
Energy: 0.693153548906088
Energy: 0.6708826448824866
Energy: 0.6566236323409762
Energy: 0.6198606497026408
Energy: 0.6566236323398273
Energy: 0.6198606497032152
Energy: 0.6566236323392529
Energy: 0.6198606497037896
Energy: 0.6848581422243015
Energy: 0.6954282745888042
Energy: 0.6848581422237272
Energy: 0.6954282745888042
Energy: 0.6848581422191319
Energy: 0.6954282745882298
Energy: 0.6395143825012286
Energy: 0.6709600766654448
Energy: 0.6395143825018029
Energy: 0.6709600766671678
Energy: 0.6395143825006542
Energy: 0.6709600766660191
Energy: 0.6740207307136583
Energy: 0.6597311943792299
Energy: 0.6740207307142326
Energy: 0.6597311943803787
Energy: 0.6740207307142326
Energy: 0.6597311943786556
Energy: 0.6434083204048096
Energy: 0.6617524919374674
Energy: 0.6434083204048096
Energy: 0.6617524919380419
Energy: 0.643408320405384
Energy: 0.6617524919380419

minimum gb energy = 0.6131285478416862 eV
minimum distance =  2.36391981134286 Angstroms
sigma value = 57


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

Energy: 0.6857942399019109
Energy: 0.6168212392770925
Energy: 0.6857942399004235
Energy: 0.6168212392770925
Energy: 0.6857942399019109
Energy: 0.6168212392770925
Energy: 0.651666353974706
Energy: 0.5852225852031172
Energy: 0.6516663539754496
Energy: 0.5852225852023736
Energy: 0.6516663539754496
Energy: 0.5852225852031172
Energy: 0.6704368399646222
Energy: 0.7143557099599576
Energy: 0.6704368399646222
Energy: 0.7143557099607013
Energy: 0.6704368399653658
Energy: 0.7143557099607013
Energy: 0.6356914441553946
Energy: 0.6785469116730991
Energy: 0.6356914441561383
Energy: 0.6785469116730991
Energy: 0.6356914441553946
Energy: 0.6785469116738428
Energy: 0.6659706513047727
Energy: 0.6768951198775669
Energy: 0.6659706513070041
Energy: 0.6768951198783107
Energy: 0.6659706513055165
Energy: 0.6768951198783107
Energy: 0.6688741668605319
Energy: 0.6294239665443337
Energy: 0.6688741668597882
Energy: 0.6294239665443337
Energy: 0.6688741668627632
Energy: 0.6294239665450774
Energy: 0.6749857475452311
Energy: 0.7098722343801016
Energy: 0.6749857475601057
Energy: 0.7098722343801016
Energy: 0.6749857475556433
Energy: 0.7098722343808453
Energy: 0.6359935819660676
Energy: 0.6399875817567102
Energy: 0.6359935819645801
Energy: 0.6399875817567102
Energy: 0.6359935819653239
Energy: 0.639987581757454
Energy: 0.6431984142623712
Energy: 0.5860219889087767
Energy: 0.643198414263115
Energy: 0.5860219889080329
Energy: 0.6431984142616275
Energy: 0.5860219889080329
Energy: 0.607844108463283
Energy: 0.6289674589721541
Energy: 0.6078441084640267
Energy: 0.6289674589721541
Energy: 0.6078441084640267
Energy: 0.6289674589721541
Energy: 0.6749047519666009
Energy: 0.6757064380817487
Energy: 0.6749047519658572
Energy: 0.6757064380824924
Energy: 0.6749047519666009
Energy: 0.6757064380817487
Energy: 0.6442405459158702
Energy: 0.699847643642876
Energy: 0.6442405459151265
Energy: 0.6998476436302327
Energy: 0.6442405459151265
Energy: 0.6998476436339512
Energy: 0.6990122261645806
Energy: 0.586183128603474
Energy: 0.6990122261645806
Energy: 0.586183128603474
Energy: 0.6990122261638368
Energy: 0.586183128603474
Energy: 0.7336438582448351
Energy: 0.5921217428066838
Energy: 0.7336438582448351
Energy: 0.5921217428074276
Energy: 0.7336438582433478
Energy: 0.5921217428066838
Energy: 0.6530436206906368
Energy: 0.5892838655192517
Energy: 0.6530436206906368
Energy: 0.5892838655207392
Energy: 0.6530436206913804
Energy: 0.5892838655207392
Energy: 0.6661345246272234
Energy: 0.6895045641496218
Energy: 0.6661345246264798
Energy: 0.6895045641496218
Energy: 0.6661345246272234
Energy: 0.6895045641503655
Energy: 0.6006609795113943
Energy: 0.649898126254148
Energy: 0.6006609795128817
Energy: 0.649898126254148
Energy: 0.6006609795113943
Energy: 0.649898126254148
Energy: 0.6733628028249766
Energy: 0.6796691378481076
Energy: 0.673362802824233
Energy: 0.6796691378510824
Energy: 0.6733628028257204
Energy: 0.679669137849595
Energy: 0.6005289303912841
Energy: 0.6499364765171544
Energy: 0.6005289303920278
Energy: 0.6499364765171544
Energy: 0.6005289303912841
Energy: 0.6499364765171544
Energy: 0.666264453402571
Energy: 0.689499475273714
Energy: 0.666264453402571
Energy: 0.6894994752744578
Energy: 0.666264453402571
Energy: 0.689499475273714
Energy: 0.653004359584867
Energy: 0.5892383046015696
Energy: 0.6530043595833797
Energy: 0.5892383046023134
Energy: 0.6530043595856108
Energy: 0.5892383046015696
Energy: 0.7337030669707222
Energy: 0.6321215264928626
Energy: 0.7337030669714659
Energy: 0.6321215264928626
Energy: 0.7337030669707222
Energy: 0.6321215264921188
Energy: 0.6990936770002797
Energy: 0.5863532547619049
Energy: 0.6990936770017672
Energy: 0.5863532547619049
Energy: 0.6990936770017672
Energy: 0.5863532547626487
Energy: 0.6442341427972037
Energy: 0.6998760323752641
Energy: 0.6442341427972037
Energy: 0.6998760323715455
Energy: 0.6442341427957163
Energy: 0.699876032373033

minimum gb energy = 0.5852225852023736 eV
minimum distance =  2.38359353353506 Angstroms
sigma value = 17


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

Energy: 0.6179314507937977
Energy: 0.5853293095204678
Energy: 0.6179314507969531
Energy: 0.5853293095204678
Energy: 0.6179314507948495
Energy: 0.585329309519416
Energy: 0.5789329334078452
Energy: 0.5661849598642865
Energy: 0.5789329334088971
Energy: 0.5661849598642865
Energy: 0.5789329334057416
Energy: 0.5661849598642865
Energy: 0.6630235447057522
Energy: 0.6585051289633933
Energy: 0.6630235447057522
Energy: 0.6585051289623415
Energy: 0.6630235447057522
Energy: 0.6585051289623415
Energy: 0.5641536642959717
Energy: 0.6545086652424937
Energy: 0.5641536642949199
Energy: 0.6545086652435455
Energy: 0.5641536642959717
Energy: 0.6545086652424937
Energy: 0.5546685759182297
Energy: 0.62922083843042
Energy: 0.5544997257225501
Energy: 0.6292208382085885
Energy: 0.5545005321904649
Energy: 0.6292208382180546
Energy: 0.6129777000109793
Energy: 0.5646813964775887
Energy: 0.6129777000099274
Energy: 0.5646813964775887
Energy: 0.6129777000099274
Energy: 0.5646813964775887
Energy: 0.5710763263871879
Energy: 0.5857756659774552
Energy: 0.571076326386136
Energy: 0.5857756659774552
Energy: 0.5710763263871879
Energy: 0.5857756659774552
Energy: 0.5640811701543818
Energy: 0.6390688902541529
Energy: 0.5640811701554336
Energy: 0.6390688902541529
Energy: 0.5640811701543818
Energy: 0.6390688902531012
Energy: 0.6421576874079583
Energy: 0.5654810645149242
Energy: 0.6421576874079583
Energy: 0.5654810645149242
Energy: 0.6421576874079583
Energy: 0.565481064515976
Energy: 0.6091821727578579
Energy: 0.5758418327139058
Energy: 0.6091821727578579
Energy: 0.5758418327139058
Energy: 0.6091821727578579
Energy: 0.5758418327139058
Energy: 0.5989811050505872
Energy: 0.5938638290216693
Energy: 0.5989811050505872
Energy: 0.5938638290216693
Energy: 0.5989811050505872
Energy: 0.5938638290216693
Energy: 0.6215869415198326
Energy: 0.5850957216172332
Energy: 0.6215869415114184
Energy: 0.5850957216172332
Energy: 0.6215869415219363
Energy: 0.5850957216172332
Energy: 0.5458995182922374
Energy: 0.6445418688945285
Energy: 0.5458995182911857
Energy: 0.6445418688945285
Energy: 0.5458995182922374
Energy: 0.6445418688945285
Energy: 0.6087865440193742
Energy: 0.6633861971795852
Energy: 0.6087865440183224
Energy: 0.6633861971795852
Energy: 0.6087865440193742
Energy: 0.6633861971795852
Energy: 0.612810264435251
Energy: 0.571668474507676
Energy: 0.6128102644373545
Energy: 0.571668474507676
Energy: 0.6128102644300158
Energy: 0.571668474507676
Energy: 0.6130548066296303
Energy: 0.5650876758322646
Energy: 0.6130548066296303
Energy: 0.5650876758333164
Energy: 0.6130548066306821
Energy: 0.5650876758322646
Energy: 0.6078985280291568
Energy: 0.6635073463922192
Energy: 0.607898528028105
Energy: 0.6635073463922192
Energy: 0.6078985280291568
Energy: 0.6635073463922192

minimum gb energy = 0.5458995182911857 eV
minimum distance =  2.36722433109336 Angstroms
sigma value = 17


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

Energy: 0.5626243891355389
Energy: 0.5467120276001546
Energy: 0.5626243891363512
Energy: 0.5467120276001546
Energy: 0.5626243891367574
Energy: 0.5467120276001546
Energy: 0.5639059909816421
Energy: 0.5292845616748815
Energy: 0.5639059909832668
Energy: 0.5292845616756938
Energy: 0.563905990981236
Energy: 0.5292845616748815
Energy: 0.609424887087298
Energy: 0.5811426941784147
Energy: 0.6094248870881103
Energy: 0.5811426941780086
Energy: 0.609424887087298
Energy: 0.5811426941780086
Energy: 0.5366644370404712
Energy: 0.5861700880181102
Energy: 0.536664437040065
Energy: 0.5861700880177041
Energy: 0.5366644370388465
Energy: 0.5861700880172979
Energy: 0.6276938088005856
Energy: 0.5294787693896791
Energy: 0.6276938088013979
Energy: 0.5294787693896791
Energy: 0.6276938088013979
Energy: 0.5294787693896791
Energy: 0.5954587438223383
Energy: 0.5361654046401388
Energy: 0.5954587438223383
Energy: 0.5361654046393266
Energy: 0.595458743823963
Energy: 0.5361654046397327
Energy: 0.5606082296019196
Energy: 0.5618106341575154
Energy: 0.5606082296027319
Energy: 0.5618106341587339
Energy: 0.5606082296015135
Energy: 0.5618106341571093
Energy: 0.6030007641452934
Energy: 0.5687490349616916
Energy: 0.6030007641416378
Energy: 0.5687490348995488
Energy: 0.603000764144481
Energy: 0.5687490349117337
Energy: 0.5760903454019228
Energy: 0.5409410903632422
Energy: 0.5760903454023291
Energy: 0.5409410903608052
Energy: 0.5760903454002982
Energy: 0.5409410903620238
Energy: 0.5568311348884714
Energy: 0.5119654715005718
Energy: 0.5568311348884714
Energy: 0.5119654715005718
Energy: 0.5568311348892837
Energy: 0.5119654715009779
Energy: 0.5126588631947596
Energy: 0.5773553673552134
Energy: 0.5126588631931349
Energy: 0.577355367356838
Energy: 0.5126588631943534
Energy: 0.577355367356838
Energy: 0.6102686807998322
Energy: 0.535153301378838
Energy: 0.6102686808010507
Energy: 0.5351533013784319
Energy: 0.6102686808002384
Energy: 0.5351533013776195
Energy: 0.6014240732455621
Energy: 0.5402755094505413
Energy: 0.601424073245156
Energy: 0.5402755094509475
Energy: 0.6014240732455621
Energy: 0.5402755094501351
Energy: 0.5500645657662651
Energy: 0.604210271174209
Energy: 0.5500645657674834
Energy: 0.6042102711746152
Energy: 0.5500645657662651
Energy: 0.604210271174209
Energy: 0.5820451750042381
Energy: 0.5607313534836758
Energy: 0.582045175003832
Energy: 0.5607313534832696
Energy: 0.5820451750054566
Energy: 0.5607313534836758
Energy: 0.5195595665632226
Energy: 0.59900394724938
Energy: 0.5195595665620041
Energy: 0.5990039472497862
Energy: 0.5195595665640349
Energy: 0.59900394724938
Energy: 0.5580610311050976
Energy: 0.5786066619416265
Energy: 0.558061031108347
Energy: 0.5786066619420326
Energy: 0.55806103110591
Energy: 0.5786066619420326
Energy: 0.5860823811921939
Energy: 0.5733433585578731
Energy: 0.5860823811942248
Energy: 0.5733433585562484
Energy: 0.5860823811909754
Energy: 0.5733433585570608
Energy: 0.5688348511552633
Energy: 0.5759667642616827
Energy: 0.5688348511540449
Energy: 0.5759667642616827
Energy: 0.568834851154451
Energy: 0.5759667642616827
Energy: 0.5578064819378101
Energy: 0.5826314236955384
Energy: 0.5578064819361855
Energy: 0.5826314236959446
Energy: 0.5578064819353732
Energy: 0.5826314236967569
Energy: 0.5688504720996076
Energy: 0.5759424785949654
Energy: 0.5688504720996076
Energy: 0.5759424785945592
Energy: 0.5688504720983891
Energy: 0.5759424785941529
Energy: 0.5858117369987466
Energy: 0.5732940513461191
Energy: 0.5858117369975281
Energy: 0.5732940513469315
Energy: 0.5858117369938726
Energy: 0.5732940513432759
Energy: 0.5580338334033741
Energy: 0.578697108399531
Energy: 0.5580338334009373
Energy: 0.5786971083991249
Energy: 0.5580338334021557
Energy: 0.5786971083991249
Energy: 0.5195982048022717
Energy: 0.6207601398768813
Energy: 0.5195982048038963
Energy: 0.6207601398776937
Energy: 0.5195982048030839
Energy: 0.6207601398780999
Energy: 0.5820296355677317
Energy: 0.5608915242614052
Energy: 0.5820296355665132
Energy: 0.5608915242614052
Energy: 0.5820296355677317
Energy: 0.5608915242614052
Energy: 0.5500772825800825
Energy: 0.604260538551664
Energy: 0.550077282578864
Energy: 0.604260538551664
Energy: 0.5500772825784578
Energy: 0.604260538551664
Energy: 0.6013717561047006
Energy: 0.5405632618916971
Energy: 0.6013717561059191
Energy: 0.5405632618912909
Energy: 0.6013717561038883
Energy: 0.5405632618912909
Energy: 0.6102961806969555
Energy: 0.5350049351315943
Energy: 0.6102961806969555
Energy: 0.5350049351311882
Energy: 0.6102961806965492
Energy: 0.5350049351311882
Energy: 0.5126370836391685
Energy: 0.5773467606400324
Energy: 0.5126370836391685
Energy: 0.5773467606400324
Energy: 0.5126370836391685
Energy: 0.5773467606400324
Energy: 0.5570308344591745
Energy: 0.614691511438126
Energy: 0.5570308344591745
Energy: 0.614691511438126
Energy: 0.5570308344603929
Energy: 0.614691511438126
Energy: 0.5763655768779821
Energy: 0.5410229473865626
Energy: 0.5763655768783882
Energy: 0.5410229473869688
Energy: 0.5763655768787944
Energy: 0.5410229473865626
Energy: 0.602987991398852
Energy: 0.5684115978377413
Energy: 0.602987991398852
Energy: 0.568411597836929
Energy: 0.6029879914000704
Energy: 0.5684115978324611
Energy: 0.5606108922918924
Energy: 0.5619325707781652
Energy: 0.5606108922906738
Energy: 0.5619325707773527
Energy: 0.5606108922906738
Energy: 0.5619325707781652
Energy: 0.595326461656389
Energy: 0.5370732666004479
Energy: 0.595326461656389
Energy: 0.5370732666004479
Energy: 0.595326461656389
Energy: 0.537073266600854
Energy: 0.6274178049796674
Energy: 0.5295844971515797
Energy: 0.6274178049808858
Energy: 0.5295844971511736
Energy: 0.6274178049796674
Energy: 0.5295844971511736
Energy: 0.5367404947067466
Energy: 0.5861438740525934
Energy: 0.5367404947051589
Energy: 0.586143874051781
Energy: 0.5367404947055281
Energy: 0.5861438740525934
Energy: 0.6094154118508187
Energy: 0.5808917956205605
Energy: 0.6094154118512248
Energy: 0.5808917956209666
Energy: 0.6094154118496001
Energy: 0.5808917956209666
Energy: 0.5639000322810014
Energy: 0.5301555499200367
Energy: 0.5639000322810014
Energy: 0.5301555499196304
Energy: 0.563900032280189
Energy: 0.5301555499200367
Energy: 0.5626243891387882
Energy: 0.54671202759853
Energy: 0.5626243891396006
Energy: 0.54671202759853
Energy: 0.5626243891420375
Energy: 0.54671202759853
Energy: 0.5639059909840791
Energy: 0.5292845616740691
Energy: 0.5639059909848915
Energy: 0.5292845616752876
Energy: 0.5639059909844852
Energy: 0.529284561673663
Energy: 0.6094248870856734
Energy: 0.581142694181664
Energy: 0.6094248870868919
Energy: 0.5811426941820702
Energy: 0.6094248870852672
Energy: 0.581142694181664
Energy: 0.5366644370408772
Energy: 0.5944800543947277
Energy: 0.5366644370412833
Energy: 0.5944800543947277
Energy: 0.5366644370388465
Energy: 0.5944800543947277
Energy: 0.6276938088058657
Energy: 0.5294787693965839
Energy: 0.6276938088050533
Energy: 0.5294787693965839
Energy: 0.6276938088046471
Energy: 0.5294787693957714

minimum gb energy = 0.5119654715005718 eV
minimum distance =  2.3904753396409 Angstroms
sigma value = 57


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

Energy: 0.5234966854478439
Energy: 0.507144687904908
Energy: 0.5234966854432145
Energy: 0.5071446879055693
Energy: 0.5234966854445372
Energy: 0.5071446879055693
Energy: 0.51419224613336
Energy: 0.501074841205675
Energy: 0.5141922461300534
Energy: 0.5010748412050137
Energy: 0.5141922461320374
Energy: 0.5010748412050137
Energy: 0.5746956056372746
Energy: 0.540904320674605
Energy: 0.574695605635952
Energy: 0.540904320674605
Energy: 0.5746956056366133
Energy: 0.5409043206739438
Energy: 0.4832978670888053
Energy: 0.5537044702435084
Energy: 0.4832978670888053
Energy: 0.5537044702435084
Energy: 0.4832978670874827
Energy: 0.5537044702435084
Energy: 0.5874065004439978
Energy: 0.4726514882992614
Energy: 0.5874065004433365
Energy: 0.4726514882992614
Energy: 0.5874065004453204
Energy: 0.4726514882999227
Energy: 0.5543284774296011
Energy: 0.5023869545456231
Energy: 0.5543284774322464
Energy: 0.5023869545456231
Energy: 0.5543284774315851
Energy: 0.5023869545456231
Energy: 0.4818764239970151
Energy: 0.5354232555483918
Energy: 0.4818764239963537
Energy: 0.5354232555477305
Energy: 0.4818764239970151
Energy: 0.5354232555490531
Energy: 0.5176538505390207
Energy: 0.5197348215490135
Energy: 0.5176538505648125
Energy: 0.48215815050820615
Energy: 0.5176538505337299
Energy: 0.519720424944146
Energy: 0.5120568697877127
Energy: 0.5033521182651408
Energy: 0.5120568697870513
Energy: 0.5033521182651408
Energy: 0.5120568697870513
Energy: 0.5033521182651408
Energy: 0.5164151216835062
Energy: 0.5155314348987255
Energy: 0.5164151216821835
Energy: 0.5155314348993868
Energy: 0.5164151216821835
Energy: 0.5155314348993868
Energy: 0.48205053852414836
Energy: 0.532860718882229
Energy: 0.4820505385248097
Energy: 0.5328607188802449
Energy: 0.48205053852282564
Energy: 0.532860718882229
Energy: 0.5331447887013725
Energy: 0.48284096349271194
Energy: 0.5331447887033564
Energy: 0.48284096349271194
Energy: 0.5331447887007111
Energy: 0.48284096349271194
Energy: 0.5133375017300652
Energy: 0.5803512746479197
Energy: 0.5133375017294037
Energy: 0.5803512746472583
Energy: 0.5133375017294037
Energy: 0.5803512746479197
Energy: 0.48345126780467923
Energy: 0.537332489666798
Energy: 0.48345126780401787
Energy: 0.537332489666798
Energy: 0.48345126780467923
Energy: 0.537332489668782
Energy: 0.5610605583525126
Energy: 0.5036638562061194
Energy: 0.561060558353174
Energy: 0.5036638562067807
Energy: 0.5610605583505286
Energy: 0.5036638562054581
Energy: 0.5120095621136589
Energy: 0.5149357500919277
Energy: 0.5120095621136589
Energy: 0.514935750092589
Energy: 0.5120095621136589
Energy: 0.5149357500919277
Energy: 0.5198020930761088
Energy: 0.5804837028862451
Energy: 0.5198020930761088
Energy: 0.5804837028862451
Energy: 0.5198020930747861
Energy: 0.5804837028862451
Energy: 0.5455480614333799
Energy: 0.503174375094811
Energy: 0.5455480614333799
Energy: 0.5031743750941496
Energy: 0.5455480614333799
Energy: 0.503174375094811
Energy: 0.49235747844909267
Energy: 0.5502145756226364
Energy: 0.49235747844975397
Energy: 0.5502145756226364
Energy: 0.4923574784504154
Energy: 0.5502145756226364
Energy: 0.49501077810252087
Energy: 0.5528342063637434
Energy: 0.49501077810318217
Energy: 0.5528342063637434
Energy: 0.49501077810318217
Energy: 0.552834206363082
Energy: 0.5521275348568297
Energy: 0.6597336713994266
Energy: 0.5521275348555069
Energy: 0.6597336713994266
Energy: 0.552127534857491
Energy: 0.6597336713994266
Energy: 0.4947375574605763
Energy: 0.6055204798738107
Energy: 0.4947375574585923
Energy: 0.605520479874472
Energy: 0.4947375574612376
Energy: 0.605520479874472
Energy: 0.5205846973750716
Energy: 0.5373411208806177
Energy: 0.5205846973770556
Energy: 0.5373411208806177
Energy: 0.5205846973744103
Energy: 0.5373411208812792
Energy: 0.5314152948895825
Energy: 0.5451163006399968
Energy: 0.531415294888921
Energy: 0.5451163006406583
Energy: 0.5314152948882597
Energy: 0.5451163006413197
Energy: 0.5217062228978763
Energy: 0.6476415266613081
Energy: 0.521706199030478
Energy: 0.6476415266606468
Energy: 0.5217061797665375
Energy: 0.6476415266613081
Energy: 0.5109414354359331
Energy: 0.5371918113907543
Energy: 0.5109414354385784
Energy: 0.5371918113907543
Energy: 0.5109414354365944
Energy: 0.5371918113907543
Energy: 0.49154085859238983
Energy: 0.6036646986475545
Energy: 0.49154085859172847
Energy: 0.6036646986468931
Energy: 0.49154085859437385
Energy: 0.6036646986468931

minimum gb energy = 0.4726514882992614 eV
minimum distance =  2.33023176621416 Angstroms
sigma value = 43


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

Energy: 0.5392034114468098
Energy: 0.4504821670973661
Energy: 0.5392034114477734
Energy: 0.4504821670973661
Energy: 0.5392034114472916
Energy: 0.45048216709784805
Energy: 0.5118547716981492
Energy: 0.44947477179664436
Energy: 0.5118547716986311
Energy: 0.4494747717951988
Energy: 0.5118547716981492
Energy: 0.4494747717951988
Energy: 0.49584393166637447
Energy: 0.4840117208081801
Energy: 0.49584393166637447
Energy: 0.4840117208081801
Energy: 0.49584393166685636
Energy: 0.4840117208081801
Energy: 0.4497507786450799
Energy: 0.4721273564180063
Energy: 0.449750778644598
Energy: 0.47212735641752435
Energy: 0.44975077864411617
Energy: 0.47212735641704257
Energy: 0.4910820734500075
Energy: 0.41598332638860597
Energy: 0.4910820734500075
Energy: 0.41598332638764235
Energy: 0.4910820734500075
Energy: 0.41598332638860597
Energy: 0.47369289478757126
Energy: 0.4390989038047928
Energy: 0.473692894788535
Energy: 0.4390989038047928
Energy: 0.47369289478805315
Energy: 0.4390989038047928
Energy: 0.4508487243648363
Energy: 0.4602524790853512
Energy: 0.45084872436339074
Energy: 0.4602524790848693
Energy: 0.45084872436435436
Energy: 0.4602524790853512
Energy: 0.514434386508577
Energy: 0.40760633655367706
Energy: 0.514434386508577
Energy: 0.40760633655367706
Energy: 0.5144343865071315
Energy: 0.40760633655367706
Energy: 0.45749349765345015
Energy: 0.43691192675119445
Energy: 0.45749349765345015
Energy: 0.43691192675167634
Energy: 0.45749349765345015
Energy: 0.43691192675119445
Energy: 0.49233930680141996
Energy: 0.4477988139846073
Energy: 0.49233930680141996
Energy: 0.4477988139836436
Energy: 0.4923393068004563
Energy: 0.4477988139846073
Energy: 0.5303121178970844
Energy: 0.45300745381503404
Energy: 0.530312117898048
Energy: 0.4530074538159978
Energy: 0.5303121178966025
Energy: 0.45300745381358853
Energy: 0.43169865431270255
Energy: 0.4373397387250061
Energy: 0.43169865431222065
Energy: 0.43733973872452414
Energy: 0.43169865431270255
Energy: 0.4373397387250061
Energy: 0.4915709067684909
Energy: 0.4297279667521565
Energy: 0.49157090676704546
Energy: 0.4297279667521565
Energy: 0.49157090676704546
Energy: 0.4297279667521565
Energy: 0.5352603234101255
Energy: 0.47889079545757357
Energy: 0.5352603234106074
Energy: 0.47889079545805546
Energy: 0.5352603234091619
Energy: 0.47889079545709173
Energy: 0.44585906755851773
Energy: 0.48019033637439484
Energy: 0.44585906755803584
Energy: 0.48019033637439484
Energy: 0.44585906755803584
Energy: 0.48019033637439484
Energy: 0.495321545865996
Energy: 0.4757935832824972
Energy: 0.49532154586503235
Energy: 0.4757935832824972
Energy: 0.4953215458655142
Energy: 0.4757935832824972
Energy: 0.5325715459998496
Energy: 0.4763413483243528
Energy: 0.5325715459993677
Energy: 0.4763413483233891
Energy: 0.5325715459993677
Energy: 0.47634134832387093
Energy: 0.46043265854269455
Energy: 0.43216859742241565
Energy: 0.4604326585417308
Energy: 0.4321685974228975
Energy: 0.4604326585417308
Energy: 0.43216859742241565
Energy: 0.4400773738382744
Energy: 0.49901130359913154
Energy: 0.4400773738373107
Energy: 0.49901130359913154
Energy: 0.4400773738368289
Energy: 0.49901130359913154
Energy: 0.43796433338992546
Energy: 0.434399937002575
Energy: 0.43796433339040736
Energy: 0.43439993700112944
Energy: 0.43796433338992546
Energy: 0.4343999370020931
Energy: 0.486517570749405
Energy: 0.43975134579737973
Energy: 0.486517570749405
Energy: 0.43975134579689784
Energy: 0.4865175707498868
Energy: 0.43975134579737973
Energy: 0.4524632861560366
Energy: 0.4900301841994703
Energy: 0.4524632861555548
Energy: 0.4900301841989884
Energy: 0.4524632861560366
Energy: 0.4900301841989884
Energy: 0.4606961209526793
Energy: 0.4920360284824611
Energy: 0.4606961209521975
Energy: 0.4920360284824611
Energy: 0.4606961209526793
Energy: 0.4920360284829429
Energy: 0.4704731370355108
Energy: 0.4384990869475039
Energy: 0.4704731370359927
Energy: 0.4384990869475039
Energy: 0.47047313703502897
Energy: 0.4384990869475039
Energy: 0.421045507396216
Energy: 0.43663311936179544
Energy: 0.42104550739477037
Energy: 0.43663311936131355
Energy: 0.42104550739525226
Energy: 0.43663311936179544
Energy: 0.4305821151803688
Energy: 0.47945469336809277
Energy: 0.4305821151813325
Energy: 0.479454693373393
Energy: 0.4305821151803688
Energy: 0.479454693373393
Energy: 0.4694732015108608
Energy: 0.43200972358771234
Energy: 0.4694732015108608
Energy: 0.43200972358578493
Energy: 0.46947320150941535
Energy: 0.43200972358289386
Energy: 0.40346852559754337
Energy: 0.4837202098125841
Energy: 0.40346852559754337
Energy: 0.4837202098116204
Energy: 0.40346852559754337
Energy: 0.4837202098111385
Energy: 0.4312134293303547
Energy: 0.4551005388173375
Energy: 0.4312134293318003
Energy: 0.4551005388173375
Energy: 0.43121342933131845
Energy: 0.4551005388173375
Energy: 0.44231784986756206
Energy: 0.43667423495352126
Energy: 0.4423178498670802
Energy: 0.43667423495400304
Energy: 0.4423178498661165
Energy: 0.43667423495400304
Energy: 0.40141253642951846
Energy: 0.484155672328744
Energy: 0.401412536430964
Energy: 0.48415567232826207
Energy: 0.40141253642855473
Energy: 0.48415567232826207
Energy: 0.432291675010449
Energy: 0.4474808676236225
Energy: 0.4322916750114127
Energy: 0.4474808676236225
Energy: 0.432291675010449
Energy: 0.4474808676236225
Energy: 0.42901170151450985
Energy: 0.4370672270860469
Energy: 0.429011701514028
Energy: 0.43706722708363765
Energy: 0.4290117015154736
Energy: 0.4370672270846014
Energy: 0.5313724780025852
Energy: 0.47954685636644834
Energy: 0.5313724780016216
Energy: 0.479546856364521
Energy: 0.5313724780025852
Energy: 0.479546856364521
Energy: 0.4330163502476043
Energy: 0.4324270386529054
Energy: 0.4330163502476043
Energy: 0.4324270386524235
Energy: 0.4330163502476043
Energy: 0.43242703865338716
Energy: 0.40083720648187887
Energy: 0.4830052951150643
Energy: 0.40083720648187887
Energy: 0.4830052951150643
Energy: 0.40083720648187887
Energy: 0.4830052951150643

minimum gb energy = 0.40083720648187887 eV
minimum distance =  2.33089392250249 Angstroms
sigma value = 81


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

Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.3150951132757584
Energy: 0.031326137212063274
Energy: 0.3150951132757584
Energy: 0.031326137215604115
Energy: 0.3150951132757584
Energy: 0.031326137215604115
Energy: 0.3151156717494018
Energy: 0.0322362925220743
Energy: 0.3151156717511722
Energy: 0.032236292520303876
Energy: 0.3151156717511722
Energy: 0.032236292520303876
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.3150951132757584
Energy: 0.031326137215604115
Energy: 0.31509511327929923
Energy: 0.03132613721737454
Energy: 0.3150951132757584
Energy: 0.03132613721737454
Energy: 0.3151156717494018
Energy: 0.03223629252915598
Energy: 0.3151156717511722
Energy: 0.03223629253623767
Energy: 0.3151156717511722
Energy: 0.03223629253269683
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.3150951132757584
Energy: 0.03132613721914496
Energy: 0.3150951132757584
Energy: 0.03132613721914496
Energy: 0.31509511328104955
Energy: 0.03132613722091538
Energy: 0.3151156717511722
Energy: 0.03223629254154894
Energy: 0.31511567175294264
Energy: 0.03223629253977851
Energy: 0.31511567175294264
Energy: 0.03223629253977851
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467
Energy: 0.029086221552463435
Energy: 0.05858457921598467

minimum gb energy = 0.029086221552463435 eV
minimum distance =  2.53061252073476 Angstroms
sigma value = 3


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

Energy: 0.4274817118991171
Energy: 0.39407906515701796
Energy: 0.4274817118991171
Energy: 0.39407906515701796
Energy: 0.42748171189964695
Energy: 0.39407906515701796
Energy: 0.40223972550988185
Energy: 0.4041657626421196
Energy: 0.4022397255093521
Energy: 0.4041657626421196
Energy: 0.40223972550988185
Energy: 0.4041657626421196
Energy: 0.4340677882878597
Energy: 0.40315321767604584
Energy: 0.4340677882873299
Energy: 0.4031532176765757
Energy: 0.43406778828838954
Energy: 0.4031532176765757
Energy: 0.41689627712219285
Energy: 0.3853295904278648
Energy: 0.416896277121663
Energy: 0.3853295904278648
Energy: 0.4168962771211332
Energy: 0.3853295904278648
Energy: 0.3509192362720774
Energy: 0.40475015243597984
Energy: 0.35091923627313704
Energy: 0.40475015243545004
Energy: 0.35091923627260724
Energy: 0.40475015243545004
Energy: 0.42038810718547065
Energy: 0.4204237780441346
Energy: 0.4203881071865303
Energy: 0.4204237780441346
Energy: 0.4203881071849409
Energy: 0.42042377804360476
Energy: 0.426308477722545
Energy: 0.39509285217510626
Energy: 0.42630847772201513
Energy: 0.39509285217510626
Energy: 0.42630847772148533
Energy: 0.39509285217510626
Energy: 0.3494845242224676
Energy: 0.40503132354156096
Energy: 0.3494845242229973
Energy: 0.40503132354156096
Energy: 0.3494845242224676
Energy: 0.40503132354156096
Energy: 0.4281753694067975
Energy: 0.43007051195209106
Energy: 0.4281753694073273
Energy: 0.4300705119515612
Energy: 0.4281753694067975
Energy: 0.4300705119515612
Energy: 0.38796787641846525
Energy: 0.38589713442253054
Energy: 0.38796787641793545
Energy: 0.3858971344230604
Energy: 0.38796787641899505
Energy: 0.38589713442253054
Energy: 0.3725138938723006
Energy: 0.39242831450623916
Energy: 0.3725138938728304
Energy: 0.39242831450623916
Energy: 0.3725138938728304
Energy: 0.39242831450623916
Energy: 0.4404861942700305
Energy: 0.4475285045769237
Energy: 0.4404861942700305
Energy: 0.4475285045769237
Energy: 0.4404861942695007
Energy: 0.4475285045769237
Energy: 0.41751927180668
Energy: 0.3658635285795847
Energy: 0.4175192718072099
Energy: 0.3658635285806443
Energy: 0.41751927180668
Energy: 0.3658635285801145
Energy: 0.39245204023886443
Energy: 0.4393806206476998
Energy: 0.39245204023886443
Energy: 0.43938062064716993
Energy: 0.392452040239924
Energy: 0.4393806206476998
Energy: 0.42343942467080203
Energy: 0.4351022750252624
Energy: 0.42343942467027224
Energy: 0.4351022750252624
Energy: 0.42343942467080203
Energy: 0.4351022750252624
Energy: 0.41676162454327004
Energy: 0.35421156403638415
Energy: 0.41676162454168064
Energy: 0.3542115640369139
Energy: 0.4167616245427402
Energy: 0.3542115640369139
Energy: 0.32119125519978825
Energy: 0.44347642985825464
Energy: 0.32119125520031805
Energy: 0.44347642985825464
Energy: 0.32119125519925845
Energy: 0.44347642985825464
Energy: 0.4037790517396369
Energy: 0.4129941462427546
Energy: 0.4037790517396369
Energy: 0.4129941462427546
Energy: 0.4037790517396369
Energy: 0.4129941462427546
Energy: 0.4170728400758803
Energy: 0.3504997840004769
Energy: 0.41707284007641005
Energy: 0.35049978400100673
Energy: 0.41707284007535045
Energy: 0.3504997840004769
Energy: 0.40874157575107006
Energy: 0.42423594319125907
Energy: 0.40874157575159975
Energy: 0.42423594319019947
Energy: 0.40874157575107006
Energy: 0.42423594319019947
Energy: 0.40442418798789015
Energy: 0.39972943891331203
Energy: 0.40442418798789015
Energy: 0.39972943891331203
Energy: 0.4044241879868305
Energy: 0.39972943891331203
Energy: 0.4035448262900572
Energy: 0.4015571856989529
Energy: 0.4035448262895274
Energy: 0.4015571856989529
Energy: 0.4035448262900572
Energy: 0.4015571856989529
Energy: 0.4076461393233298
Energy: 0.4104425294515091
Energy: 0.4076461393228
Energy: 0.4104425294515091
Energy: 0.4076461393228
Energy: 0.4104425294515091
Energy: 0.412894954524112
Energy: 0.34104210599729295
Energy: 0.4128949545246418
Energy: 0.34104210599676316
Energy: 0.412894954524112
Energy: 0.34104210599782275
Energy: 0.4179414991921657
Energy: 0.4210972119590854
Energy: 0.4179414991921657
Energy: 0.4210972119590854
Energy: 0.4179414991921657
Energy: 0.4210972119590854
Energy: 0.40403785700004097
Energy: 0.41987866667166424
Energy: 0.40403785700057077
Energy: 0.41987866667166424
Energy: 0.40403785700004097
Energy: 0.41987866667166424
Energy: 0.42335077564753304
Energy: 0.3410638689691768
Energy: 0.42335077564753304
Energy: 0.34106386896864693
Energy: 0.42335077564700324
Energy: 0.3410638689691768
Energy: 0.4243950945706176
Energy: 0.4369137017009044
Energy: 0.4243950945706176
Energy: 0.4369137017009044
Energy: 0.4243950945706176
Energy: 0.4369137017009044
Energy: 0.400949777550465
Energy: 0.3998047699814816
Energy: 0.40094977755152467
Energy: 0.3998047699820114
Energy: 0.400949777550465
Energy: 0.3998047699814816
Energy: 0.42580853155896786
Energy: 0.3672931421724731
Energy: 0.4258085315594977
Energy: 0.3672931421724731
Energy: 0.42580853155843806
Energy: 0.36729314217300296
Energy: 0.4429766709168705
Energy: 0.42770982998508494
Energy: 0.4429766709174003
Energy: 0.42770982998561474
Energy: 0.4429766709174003
Energy: 0.42770982998561474
Energy: 0.38164112197114136
Energy: 0.4199906052720416
Energy: 0.38164112197114136
Energy: 0.4199906052715117
Energy: 0.38164112197167116
Energy: 0.4199906052720416
Energy: 0.4457359291092394
Energy: 0.4081685111763071
Energy: 0.44573592911029897
Energy: 0.4081685111763071
Energy: 0.4457359291092394
Energy: 0.4081685111763071

minimum gb energy = 0.32119125519925845 eV
minimum distance =  2.39370437661897 Angstroms
sigma value = 67


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

Energy: 0.5427288012996941
Energy: 0.5404112317406237
Energy: 0.5427288012981843
Energy: 0.5404112317398687
Energy: 0.5427288012989393
Energy: 0.5404112317398687
Energy: 0.505450485235522
Energy: 0.5159969735104181
Energy: 0.505450485234012
Energy: 0.5159969735096633
Energy: 0.505450485235522
Energy: 0.5159969735096633
Energy: 0.5537549408325007
Energy: 0.5323649026723845
Energy: 0.5537549408325007
Energy: 0.5323649026723845
Energy: 0.5537549408325007
Energy: 0.5323649026731394
Energy: 0.538687897158909
Energy: 0.5173037824549066
Energy: 0.5386878971596639
Energy: 0.5173037824556614
Energy: 0.538687897158909
Energy: 0.5173037824556614
Energy: 0.4589913360972294
Energy: 0.49465673322590425
Energy: 0.4589913360949646
Energy: 0.49465673322590425
Energy: 0.4589913360949646
Energy: 0.49465673322590425
Energy: 0.5381499830435834
Energy: 0.5375703147285689
Energy: 0.5381499830450931
Energy: 0.5375703147293237
Energy: 0.5381499830435834
Energy: 0.5375703147285689
Energy: 0.5371428229608011
Energy: 0.4965466493246114
Energy: 0.537142822960046
Energy: 0.4965466493246114
Energy: 0.5371428229592913
Energy: 0.4965466493246114
Energy: 0.48526289607257306
Energy: 0.4962730466507472
Energy: 0.4852628960718181
Energy: 0.4962730466515022
Energy: 0.4852628960703083
Energy: 0.4962730466507472
Energy: 0.5532007535047396
Energy: 0.5624703983395555
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Energy: 0.5624703983395555
Energy: 0.5532007535047396
Energy: 0.5624703983388005
Energy: 0.5360550196753331
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Energy: 0.536055019676088
Energy: 0.4693029689052891
Energy: 0.536055019676088
Energy: 0.469302968906044
Energy: 0.5088831494851985
Energy: 0.5392541117238847
Energy: 0.5088831494859535
Energy: 0.5392541117238847
Energy: 0.5088831494844437
Energy: 0.5392541117238847
Energy: 0.5025352284487351
Energy: 0.5248013167803276
Energy: 0.5025352284487351
Energy: 0.5248013167803276
Energy: 0.5025352284494901
Energy: 0.5248013167795726
Energy: 0.5305301147394551
Energy: 0.5051412762456954
Energy: 0.5305301147394551
Energy: 0.5051412762449404
Energy: 0.5305301147394551
Energy: 0.5051412762449404
Energy: 0.4979181458074359
Energy: 0.5362803311844374
Energy: 0.4979181458074359
Energy: 0.5362803311844374
Energy: 0.4979181458074359
Energy: 0.5362803311844374
Energy: 0.4958871098775071
Energy: 0.4978623006016004
Energy: 0.4958871098767522
Energy: 0.4978623006023552
Energy: 0.4958871098775071
Energy: 0.4978623006016004
Energy: 0.49451177886945635
Energy: 0.5133270655944505
Energy: 0.49451177886870146
Energy: 0.5133270655944505
Energy: 0.49451177886945635
Energy: 0.5133270655944505
Energy: 0.5162140757458616
Energy: 0.5366236630338871
Energy: 0.5162140757458616
Energy: 0.5366236630338871
Energy: 0.5162140757458616
Energy: 0.5366236630338871
Energy: 0.5025372059125942
Energy: 0.49581259361647334
Energy: 0.5025372059125942
Energy: 0.4958125936172283
Energy: 0.5025372059118394
Energy: 0.49581259361647334
Energy: 0.5322709405790309
Energy: 0.5403418943438152
Energy: 0.5322709405775211
Energy: 0.5403418943438152
Energy: 0.5322709405797859
Energy: 0.5403418943438152
Energy: 0.45454441663196027
Energy: 0.5387280448543884
Energy: 0.4545444166327152
Energy: 0.5387280448551435
Energy: 0.45454441663196027
Energy: 0.5387280448551435
Energy: 0.546684435901989
Energy: 0.4706212174550969
Energy: 0.5466844359012342
Energy: 0.4706212174558518
Energy: 0.5466844359012342
Energy: 0.4706212174566068
Energy: 0.5539216401743775
Energy: 0.5637299414702055
Energy: 0.5539216401736227
Energy: 0.5637299414702055
Energy: 0.5539216401743775
Energy: 0.5637299414702055
Energy: 0.5030079764528991
Energy: 0.5269874586143464
Energy: 0.5030079764528991
Energy: 0.5269874586135914
Energy: 0.5030079764528991
Energy: 0.5269874586143464

minimum gb energy = 0.45454441663196027 eV
minimum distance =  2.3977922599451 Angstroms
sigma value = 33


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

Energy: 0.6131139491575881
Energy: 0.5477871638031598
Energy: 0.6131139491585459
Energy: 0.5477871638031598
Energy: 0.6131139491585459
Energy: 0.5477871638031598
Energy: 0.5679894012962331
Energy: 0.5997920893449221
Energy: 0.5679894012952753
Energy: 0.5997920893444432
Energy: 0.5679894012962331
Energy: 0.5997920893449221
Energy: 0.5969811477191503
Energy: 0.5992450572507577
Energy: 0.5969811477186715
Energy: 0.5992450572507577
Energy: 0.5969811477191503
Energy: 0.5992450572502788
Energy: 0.6104381145079238
Energy: 0.5921429968984947
Energy: 0.6104381145079238
Energy: 0.5921429968984947
Energy: 0.6104381145079238
Energy: 0.5921429968984947
Energy: 0.5512292717397653
Energy: 0.5763425946497874
Energy: 0.5512292717397653
Energy: 0.5763425946493086
Energy: 0.5512292717397653
Energy: 0.5763425946493086
Energy: 0.6359798465684
Energy: 0.6172809822390904
Energy: 0.6359798465693578
Energy: 0.6172809822390904
Energy: 0.6359798465679211
Energy: 0.6172809822390904
Energy: 0.5638686064270002
Energy: 0.5570580590416842
Energy: 0.5638686064260425
Energy: 0.5570580590416842
Energy: 0.5638686064265213
Energy: 0.5570580590416842
Energy: 0.5747670558585468
Energy: 0.6172863689580657
Energy: 0.5747670558561523
Energy: 0.6172863689571079
Energy: 0.5747670558590257
Energy: 0.6172863689571079
Energy: 0.6079386035781537
Energy: 0.6134186638108864
Energy: 0.6079386035786326
Energy: 0.6134186638108864
Energy: 0.6079386035781537
Energy: 0.6134186638108864
Energy: 0.5998709970069609
Energy: 0.5950113841312124
Energy: 0.5998709970079187
Energy: 0.5950113841312124
Energy: 0.5998709970060029
Energy: 0.5950113841307336
Energy: 0.61988430213041
Energy: 0.6009685719946605
Energy: 0.6198843021313678
Energy: 0.6009685719946605
Energy: 0.61988430213041
Energy: 0.6009685719941816
Energy: 0.5654211823064944
Energy: 0.5759667595217965
Energy: 0.5654211823060155
Energy: 0.5759667595217965
Energy: 0.5654211823060155
Energy: 0.5759667595217965
Energy: 0.6104055795898601
Energy: 0.5685994314070906
Energy: 0.6104055795908179
Energy: 0.5685994314070906
Energy: 0.6104055795903389
Energy: 0.5685994314070906
Energy: 0.5777512481702652
Energy: 0.5976059170902888
Energy: 0.577751248171223
Energy: 0.5976059170902888
Energy: 0.577751248171702
Energy: 0.5976059170902888
Energy: 0.5723407443369741
Energy: 0.574323850261274
Energy: 0.572340744337453
Energy: 0.574323850261274
Energy: 0.572340744337453
Energy: 0.574323850261274
Energy: 0.610949869319278
Energy: 0.6064901028218733
Energy: 0.610949869319278
Energy: 0.6064901028213944
Energy: 0.610949869318799
Energy: 0.6064901028218733
Energy: 0.5518834869757907
Energy: 0.5985696578153193
Energy: 0.5518834869762695
Energy: 0.5985696578157983
Energy: 0.5518834869757907
Energy: 0.5985696578153193
Energy: 0.6081887907808684
Energy: 0.6059086893881925
Energy: 0.6081887907813472
Energy: 0.6059086893881925
Energy: 0.6081887907794317
Energy: 0.6059086893877136
Energy: 0.5637634592126184
Energy: 0.5643842246655261
Energy: 0.5637634592135763
Energy: 0.5643842246650471
Energy: 0.5637634592130973
Energy: 0.5643842246650471
Energy: 0.5747414468420151
Energy: 0.5995656798267522
Energy: 0.5747414468448885
Energy: 0.5995656798272311
Energy: 0.5747414468434517
Energy: 0.5995656798272311
Energy: 0.6043379241641251
Energy: 0.6033501396177884
Energy: 0.6043379241641251
Energy: 0.6033501396177884
Energy: 0.604337924164604
Energy: 0.6033501396177884
Energy: 0.5723088913117316
Energy: 0.5276512921586523
Energy: 0.5723088913112527
Energy: 0.5276512921591312
Energy: 0.572308891310295
Energy: 0.5276512921591312
Energy: 0.6014624816867546
Energy: 0.6010194688811591
Energy: 0.6014624816867546
Energy: 0.6010194688806804
Energy: 0.6014624816862757
Energy: 0.6010194688806804
Energy: 0.5999654901619819
Energy: 0.5741121874081045
Energy: 0.5999654901615029
Energy: 0.5741121874081045
Energy: 0.5999654901619819
Energy: 0.5741121874081045
Energy: 0.5660459031846234
Energy: 0.5823045438329143
Energy: 0.5660459031836657
Energy: 0.5823045438329143
Energy: 0.5660459031855812
Energy: 0.5823045438329143
Energy: 0.6019985744885867
Energy: 0.6043802574571764
Energy: 0.6019985744857133
Energy: 0.6043802574571764
Energy: 0.6019985744861922
Energy: 0.6043802574571764
Energy: 0.5639953119368886
Energy: 0.5742321018571876
Energy: 0.5639953119383254
Energy: 0.5742321018571876
Energy: 0.5639953119359308
Energy: 0.5742321018571876
Energy: 0.606053213829917
Energy: 0.6445518318314405
Energy: 0.6060532138308748
Energy: 0.6445518318314405
Energy: 0.6060532138313538
Energy: 0.6445518318314405
Energy: 0.5737941314125551
Energy: 0.5766360575350349
Energy: 0.5737941314120761
Energy: 0.5766360575350349
Energy: 0.5737941314130339
Energy: 0.5766360575355138
Energy: 0.5590931616465344
Energy: 0.5566668523008256
Energy: 0.5590931616465344
Energy: 0.5566668523003467
Energy: 0.5590931616470134
Energy: 0.5566668523008256
Energy: 0.6452291521418961
Energy: 0.6317716510897674
Energy: 0.6452291521414172
Energy: 0.6317716510897674
Energy: 0.6452291521418961
Energy: 0.6317716510892887
Energy: 0.5505117682775568
Energy: 0.5994903920112614
Energy: 0.550511768276599
Energy: 0.5994903920107825
Energy: 0.550511768276599
Energy: 0.5994903920112614
Energy: 0.6048511180053083
Energy: 0.5852995621813392
Energy: 0.6048511180033926
Energy: 0.585299562181818
Energy: 0.6048511180057872
Energy: 0.585299562181818
Energy: 0.5726777809622523
Energy: 0.5996014130533176
Energy: 0.5726777809617732
Energy: 0.5996014130533176
Energy: 0.5726777809636888
Energy: 0.5996014130537964
Energy: 0.5737667380560837
Energy: 0.5969531773810738
Energy: 0.5737667380565626
Energy: 0.5969531773810738
Energy: 0.5737667380575205
Energy: 0.596953177380595
Energy: 0.6066610038204718
Energy: 0.5718144330038453
Energy: 0.6066610038223875
Energy: 0.5718144330043242
Energy: 0.606661003819993
Energy: 0.5718144330043242
Energy: 0.5626304103369445
Energy: 0.5669948594354844
Energy: 0.5626304103369445
Energy: 0.5669948594354844
Energy: 0.5626304103374233
Energy: 0.5669948594354844

minimum gb energy = 0.5276512921586523 eV
minimum distance =  2.37826208675414 Angstroms
sigma value = 41


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

Energy: 0.721077411347086
Energy: 0.7153859546337604
Energy: 0.721077411347086
Energy: 0.7153859546337604
Energy: 0.7210774113483935
Energy: 0.7153859546337604
Energy: 0.6819237983070336
Energy: 0.7034835220874642
Energy: 0.6819237983057261
Energy: 0.7034835220874642
Energy: 0.6819237983057261
Energy: 0.7034835220874642
Energy: 0.7585037307224777
Energy: 0.7013454899839122
Energy: 0.7585037307211702
Energy: 0.7013454899839122
Energy: 0.7585037307224777
Energy: 0.7013454899839122
Energy: 0.7178534432644554
Energy: 0.701656597547598
Energy: 0.7178534432644554
Energy: 0.701656597547598
Energy: 0.7178534432644554
Energy: 0.701656597547598
Energy: 0.6696588832420313
Energy: 0.7153325855815457
Energy: 0.6696588832420313
Energy: 0.7153325855815457
Energy: 0.6696588832420313
Energy: 0.7153325855815457
Energy: 0.7380053744741024
Energy: 0.7362116378403741
Energy: 0.7380053744754098
Energy: 0.7362116378403741
Energy: 0.7380053744754098
Energy: 0.7362116378403741
Energy: 0.706170756362127
Energy: 0.6817959402351369
Energy: 0.706170756362127
Energy: 0.6817959402351369
Energy: 0.7061707563634346
Energy: 0.6817959402351369
Energy: 0.6992237601675424
Energy: 0.7045522664438786
Energy: 0.6992237601675424
Energy: 0.7045522664451861
Energy: 0.6992237601675424
Energy: 0.7045522664451861
Energy: 0.6818342575877305
Energy: 0.6828417948650384
Energy: 0.6818342575877305
Energy: 0.6828417948650384
Energy: 0.6818342575877305
Energy: 0.6828417948650384
Energy: 0.7075027038231774
Energy: 0.6964358696183135
Energy: 0.7075027038231774
Energy: 0.6964358696183135
Energy: 0.7075027038218697
Energy: 0.6964358696183135
Energy: 0.6810909641183518
Energy: 0.7015959530033726
Energy: 0.6810909641170443
Energy: 0.7015959530033726
Energy: 0.6810909641183518
Energy: 0.7015959530033726
Energy: 0.695377953167885
Energy: 0.7037743158668393
Energy: 0.6953779531665775
Energy: 0.7037743158668393
Energy: 0.695377953167885
Energy: 0.7037743158668393
Energy: 0.7127190721162495
Energy: 0.7230272186135942
Energy: 0.7127190721162495
Energy: 0.7230272186135942
Energy: 0.7127190721162495
Energy: 0.7230272186135942
Energy: 0.6678651455211104
Energy: 0.7047500268576019
Energy: 0.6678651455211104
Energy: 0.7047500268589094
Energy: 0.6678651455211104
Energy: 0.7047500268576019

minimum gb energy = 0.6678651455211104 eV
minimum distance =  2.35735525756992 Angstroms
sigma value = 11


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

Energy: 0.8255959228542011
Energy: 0.8041987834779323
Energy: 0.8255959228536266
Energy: 0.8041987834779323
Energy: 0.8255959228547756
Energy: 0.8041987834779323
Energy: 0.7643723222723685
Energy: 0.7870357545517588
Energy: 0.7643723222735173
Energy: 0.7870357545517588
Energy: 0.7643723222723685
Energy: 0.7870357545511844
Energy: 0.8312976689518036
Energy: 0.7810097891365538
Energy: 0.8312976689529522
Energy: 0.7810097891365538
Energy: 0.8312976689518036
Energy: 0.7810097891365538
Energy: 0.784734140709052
Energy: 0.7798057955723156
Energy: 0.7847341407101748
Energy: 0.7798057955723156
Energy: 0.7847341407096264
Energy: 0.7798057955723156
Energy: 0.8083106581996565
Energy: 0.7859190826933038
Energy: 0.8083106581985077
Energy: 0.7859190826933038
Energy: 0.8083106581996565
Energy: 0.7859190826933038
Energy: 0.784098814955191
Energy: 0.7916919568459725
Energy: 0.784098814955191
Energy: 0.7916919568465468
Energy: 0.7840988149546168
Energy: 0.7916919568459725
Energy: 0.7863616002226462
Energy: 0.7816609280187012
Energy: 0.786361600222072
Energy: 0.7816609280187012
Energy: 0.7863616002214975
Energy: 0.7816609280187012
Energy: 0.7811441986470704
Energy: 0.7858276293429386
Energy: 0.7811441986476447
Energy: 0.785827629343513
Energy: 0.781144198646496
Energy: 0.7858276293423644
Energy: 0.7841513876715291
Energy: 0.786887457745102
Energy: 0.7841513876721034
Energy: 0.786887457745102
Energy: 0.7841513876709547
Energy: 0.786887457745102
Energy: 0.7776990901175025
Energy: 0.7963493452395409
Energy: 0.7776990901186512
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Energy: 0.7776990901180768
Energy: 0.7963493452395409
Energy: 0.7721580835435521
Energy: 0.788904666736125
Energy: 0.7721580835435521
Energy: 0.788904666736125
Energy: 0.7721580835435521
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Energy: 0.8061717656702426
Energy: 0.7961614876456791
Energy: 0.806171765669094
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Energy: 0.8061717656696682
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Energy: 0.7842944796474945
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Energy: 0.8130050548445577
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Energy: 0.8130050548451321
Energy: 0.7670607038910993
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Energy: 0.7710995789324101
Energy: 0.7690314341412937
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Energy: 0.7872192369277055
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Energy: 0.7882013786780651
Energy: 0.8079315952299947
Energy: 0.7882013786792139
Energy: 0.8079315952305691
Energy: 0.7882013786774905
Energy: 0.8079315952305691
Energy: 0.7829949485217752
Energy: 0.7795459363159787
Energy: 0.7829949485229242
Energy: 0.7795459363159787
Energy: 0.7829949485223497
Energy: 0.7795459363154043
Energy: 0.7815919121869193
Energy: 0.7862509897076456
Energy: 0.7815919121869193
Energy: 0.78625098970822
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Energy: 0.7862509897076456
Energy: 0.7642973945738746
Energy: 0.7747553807997022
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Energy: 0.7747553808002766
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Energy: 0.7777075897133077
Energy: 0.8012446973773183
Energy: 0.7777075897138821
Energy: 0.8012446973773183
Energy: 0.7777075897127332
Energy: 0.8012446973767439
Energy: 0.793430746234722
Energy: 0.7819176770348599
Energy: 0.7934307462341478
Energy: 0.7819176770348599
Energy: 0.793430746234722
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Energy: 0.799778296078072
Energy: 0.7838156019502114
Energy: 0.7997782960786465
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Energy: 0.799778296078072
Energy: 0.7838156019507858
Energy: 0.7796106674375451
Energy: 0.7922366414106179
Energy: 0.7796106674369707
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Energy: 0.7796106674369707
Energy: 0.7922366414106179
Energy: 0.7715876679062809
Energy: 0.7856002197690799
Energy: 0.7715876679068552
Energy: 0.7856002197690799
Energy: 0.7715876679062809
Energy: 0.7856002197696544
Energy: 0.783907728152625
Energy: 0.81781106882864
Energy: 0.7839077281520506
Energy: 0.8178110688280654
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Energy: 0.8178110688280654
Energy: 0.7843480767521699
Energy: 0.7738145450811971
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Energy: 0.7738145450811971
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Energy: 0.7738145450811971
Energy: 0.7891938807421504
Energy: 0.767848799367215
Energy: 0.7891938807421504
Energy: 0.7678487993666405
Energy: 0.7891938807427248
Energy: 0.767848799367215
Energy: 0.7658774791884149
Energy: 0.7647946479192113
Energy: 0.7658774791878404
Energy: 0.7647946479186368
Energy: 0.7658774791889893
Energy: 0.7647946479192113
Energy: 0.7787443455779799
Energy: 0.8240327273417277
Energy: 0.7787443455768311
Energy: 0.8240327273423022
Energy: 0.7787443455774055
Energy: 0.8240327273423022

minimum gb energy = 0.7642973945738746 eV
minimum distance =  2.32876584453301 Angstroms
sigma value = 57


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

Energy: 0.7640891561166593
Energy: 0.7885630729712442
Energy: 0.7640891561176816
Energy: 0.7885630729712442
Energy: 0.7640891561176816
Energy: 0.7885630729712442
Energy: 0.7669698458512599
Energy: 0.7901345128267355
Energy: 0.7669698458502376
Energy: 0.7901345128246912
Energy: 0.7669698458512599
Energy: 0.7901345128257132
Energy: 0.8210755545261165
Energy: 0.7908422053500996
Energy: 0.8210755545261165
Energy: 0.7908422053500996
Energy: 0.8210755545261165
Energy: 0.7908422053500996
Energy: 0.7541452768317414
Energy: 0.992850357491309
Energy: 0.7541452768307192
Energy: 0.992850357491309
Energy: 0.7541452768317414
Energy: 0.992850357491309
Energy: 0.8211101881750248
Energy: 0.7906775025608204
Energy: 0.8211101881760471
Energy: 0.7906775025608204
Energy: 0.8211101881760471
Energy: 0.7906775025608204
Energy: 0.7669524841644713
Energy: 0.7901365239232929
Energy: 0.7669524841634492
Energy: 0.7901365239232929
Energy: 0.766952484162427
Energy: 0.7901365239232929
Energy: 0.7640891561187036
Energy: 0.7885630729743107
Energy: 0.7640891561197258
Energy: 0.7885630729743107
Energy: 0.7640891561207479
Energy: 0.7885630729753328
Energy: 0.7669698458512599
Energy: 0.7901345128277575
Energy: 0.7669698458502376
Energy: 0.7901345128267355
Energy: 0.7669698458502376
Energy: 0.7901345128277575
Energy: 0.8210755545271385
Energy: 0.7908422053490773
Energy: 0.8210755545271385
Energy: 0.7908422053490773
Energy: 0.8210755545271385
Energy: 0.7908422053490773
Energy: 0.7541452768327636
Energy: 0.9431774285109136
Energy: 0.7541452768317414
Energy: 1.0805297647086
Energy: 0.7541452768317414
Energy: 0.9473628205617802
Energy: 0.8211101881750248
Energy: 0.7906775025608204
Energy: 0.8211101881750248
Energy: 0.7906775025608204
Energy: 0.8211101881750248
Energy: 0.7906775025608204
Energy: 0.7669524841603826
Energy: 0.790136523922271
Energy: 0.7669524841614049
Energy: 0.790136523922271
Energy: 0.7669524841603826
Energy: 0.7901365239212487
Energy: 0.7640891561176816
Energy: 0.7885630729712442
Energy: 0.7640891561176816
Energy: 0.7885630729712442
Energy: 0.7640891561176816
Energy: 0.7885630729712442
Energy: 0.7669698458512599
Energy: 0.7901345128267355
Energy: 0.7669698458512599
Energy: 0.7901345128257132
Energy: 0.766969845852282
Energy: 0.7901345128267355
Energy: 0.8210755545261165
Energy: 0.7908422053500996
Energy: 0.8210755545261165
Energy: 0.7908422053500996
Energy: 0.8210755545261165
Energy: 0.7908422053500996
Energy: 0.7541452768317414
Energy: 0.8372007125745612
Energy: 0.7541452768307192
Energy: 0.8372007125745612
Energy: 0.7541452768327636
Energy: 0.837200712573539
Energy: 0.8211101881750248
Energy: 0.7906775025608204
Energy: 0.8211101881760471
Energy: 0.7906775025618425
Energy: 0.8211101881760471
Energy: 0.7906775025618425

minimum gb energy = 0.7541452768307192 eV
minimum distance =  2.35276780228958 Angstroms
sigma value = 9


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

Energy: 0.8053154781013128
Energy: 0.7927451321161431
Energy: 0.8053154781013128
Energy: 0.7927451321161431
Energy: 0.8053154781013128
Energy: 0.7927451321161431
Energy: 0.8172401816596178
Energy: 0.8002727421396688
Energy: 0.8172401816587833
Energy: 0.8002727421396688
Energy: 0.8172401816596178
Energy: 0.8002727421396688
Energy: 0.830658912755458
Energy: 0.8003126702540483
Energy: 0.8306589127562929
Energy: 0.8003126702540483
Energy: 0.8306589127546236
Energy: 0.8003126702540483
Energy: 0.7805464728178315
Energy: 0.8736717251995701
Energy: 0.7805464728161623
Energy: 0.8736717251995701
Energy: 0.7805464728169969
Energy: 0.8736717251995701
Energy: 0.8221420051120756
Energy: 0.8081900113660612
Energy: 0.8221420051120756
Energy: 0.8081900113660612
Energy: 0.8221420051120756
Energy: 0.8081900113668958
Energy: 0.8388936409747686
Energy: 0.7849978727032606
Energy: 0.8388936409739342
Energy: 0.7849978727040952
Energy: 0.8388936409747686
Energy: 0.7849978727040952
Energy: 0.7789533566035725
Energy: 0.8505417582491165
Energy: 0.7789533566027378
Energy: 0.8505417582491165
Energy: 0.7789533566035725
Energy: 0.8505417582491165
Energy: 0.803413754328565
Energy: 0.8368431566921358
Energy: 0.8034137543277305
Energy: 0.8368431566929705
Energy: 0.8034137543277305
Energy: 0.8368431566929705
Energy: 0.8639931454183775
Energy: 0.8079950813444275
Energy: 0.8639931454192121
Energy: 0.8079950813444275
Energy: 0.8639931454183775
Energy: 0.8079950813444275
Energy: 0.7804683567286488
Energy: 0.8190920443691695
Energy: 0.7804683567269797
Energy: 0.8190920443691695
Energy: 0.7804683567286488
Energy: 0.8190920443691695
Energy: 0.8150331154590466
Energy: 0.8170953612549539
Energy: 0.8150331154598811
Energy: 0.8170953612557884
Energy: 0.8150331154598811
Energy: 0.8170953612549539
Energy: 0.8439152565251381
Energy: 0.7843528711245081
Energy: 0.8439152565251381
Energy: 0.7843528711253426
Energy: 0.8439152565251381
Energy: 0.7843528711253426
Energy: 0.7845464204101014
Energy: 0.8677231384399385
Energy: 0.7845464204109358
Energy: 0.8677231384399385
Energy: 0.7845464204101014
Energy: 0.8677231384399385
Energy: 0.8068784245541183
Energy: 0.8241756874555918
Energy: 0.8068784245557873
Energy: 0.8241756874555918
Energy: 0.8068784245541183
Energy: 0.8241756874555918
Energy: 0.8524377823415943
Energy: 0.7831207669100118
Energy: 0.8524377823407595
Energy: 0.7831207669108463
Energy: 0.852437782339925
Energy: 0.7831207669100118
Energy: 0.8076417203899178
Energy: 0.8346369374929314
Energy: 0.8076417203890832
Energy: 0.8346369374937662
Energy: 0.8076417203890832
Energy: 0.8346369374937662
Energy: 0.811665434019956
Energy: 0.8457452863456085
Energy: 0.8116654340182866
Energy: 0.8457452863456085
Energy: 0.8116654340182866
Energy: 0.8457452863456085
Energy: 0.9018628778500994
Energy: 0.7844985487946061
Energy: 0.9018628778500994
Energy: 0.7844985487946061
Energy: 0.901862877849265
Energy: 0.7844985487946061
Energy: 0.7917894692708537
Energy: 0.8238270262654349
Energy: 0.7917894692708537
Energy: 0.8238270262654349
Energy: 0.7917894692708537
Energy: 0.8238270262654349
Energy: 0.7909153079464692
Energy: 0.7947050176533581
Energy: 0.7909153079448
Energy: 0.7947050176533581
Energy: 0.7909153079456347
Energy: 0.7947050176533581
Energy: 0.8526755323254374
Energy: 0.789084527435886
Energy: 0.8526755323246028
Energy: 0.789084527435886
Energy: 0.8526755323246028
Energy: 0.7890845274366827

minimum gb energy = 0.7789533566027378 eV
minimum distance =  2.34670646372621 Angstroms
sigma value = 27


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

Energy: 0.8305505465865561
Energy: 0.796184166954066
Energy: 0.8305505465872597
Energy: 0.7961841669568799
Energy: 0.8305505465872597
Energy: 0.7961841669554728
Energy: 0.8302401085878254
Energy: 0.7835815861352866
Energy: 0.830240108588529
Energy: 0.7835815861352866
Energy: 0.830240108588529
Energy: 0.7835815861352866
Energy: 0.8011967626396953
Energy: 0.782895237024968
Energy: 0.8011967626403989
Energy: 0.782895237024968
Energy: 0.8011967626403989
Energy: 0.782895237024968
Energy: 0.7642775856448755
Energy: 0.7782215485742847
Energy: 0.7642775856441719
Energy: 0.7782215485714709
Energy: 0.764277585645579
Energy: 0.7782215485679532
Energy: 0.7787034114893296
Energy: 0.8417004479752352
Energy: 0.7787034114949576
Energy: 0.8417004479752352
Energy: 0.7787034114942541
Energy: 0.8417004479745317
Energy: 0.8327205072747093
Energy: 0.8143933136682092
Energy: 0.8327205072747093
Energy: 0.8143933136682092
Energy: 0.8327205072747093
Energy: 0.8143933136682092
Energy: 0.7656275034729175
Energy: 0.8371036428373138
Energy: 0.7656275034729175
Energy: 0.8371036428373138
Energy: 0.7656275034743244
Energy: 0.8371036428366102
Energy: 0.7848415015294817
Energy: 0.8065011794224427
Energy: 0.7848415015294817
Energy: 0.8065011794224427
Energy: 0.7848415015301852
Energy: 0.8065011794224427
Energy: 0.8196838379181646
Energy: 0.7657066102065117
Energy: 0.8196838379181646
Energy: 0.7657066102065117
Energy: 0.8196838379181646
Energy: 0.7657066102065117
Energy: 0.8174652286674065
Energy: 0.8100303703918634
Energy: 0.8174652286674065
Energy: 0.8100303703918634
Energy: 0.8174652286681099
Energy: 0.8100303703918634
Energy: 0.836140648650839
Energy: 0.791866561275643
Energy: 0.836140648650839
Energy: 0.7918665612749396
Energy: 0.8361406486501355
Energy: 0.7918665612742362
Energy: 0.8386485177069296
Energy: 0.7658496244290137
Energy: 0.8386485177076012
Energy: 0.7658496244283104
Energy: 0.8386485177069296
Energy: 0.7658496244283104
Energy: 0.798868405634974
Energy: 0.7826442520132899
Energy: 0.7988684056356775
Energy: 0.7826442520132899
Energy: 0.798868405634974
Energy: 0.7826442520132899
Energy: 0.7654927322716379
Energy: 0.8235995401208281
Energy: 0.7654927322730449
Energy: 0.8235995401208281
Energy: 0.7654927322723414
Energy: 0.8235995401208281
Energy: 0.8240556221847044
Energy: 0.8131785743976263
Energy: 0.8240556221854081
Energy: 0.8131785743976263
Energy: 0.824055622182594
Energy: 0.8131785743976263
Energy: 0.7925272830004283
Energy: 0.8313111534311923
Energy: 0.7925272830011315
Energy: 0.8313111534304888
Energy: 0.7925272830011315
Energy: 0.8313111534304888
Energy: 0.77576286367716
Energy: 0.7996629215408242
Energy: 0.7757628636764563
Energy: 0.7996629215408242
Energy: 0.77576286367716
Energy: 0.7996629215408242
Energy: 0.7847387119489085
Energy: 0.7831808768233857
Energy: 0.7847387119503155
Energy: 0.7831808768240892
Energy: 0.7847387119496121
Energy: 0.7831808768240892
Energy: 0.7794820216131858
Energy: 0.7737282405757181
Energy: 0.7794820216124824
Energy: 0.7737282405757181
Energy: 0.7794820216131858
Energy: 0.7737282405757181
Energy: 0.8305505465872597
Energy: 0.7961841669561763
Energy: 0.8305505465865561
Energy: 0.796184166954066
Energy: 0.8305505465865561
Energy: 0.7961841669533624
Energy: 0.830240108588529
Energy: 0.7835815861381006
Energy: 0.8302401085892325
Energy: 0.7835815861381006
Energy: 0.8302401085892325
Energy: 0.7835815861381006
Energy: 0.8011967626411023
Energy: 0.7828952370242643
Energy: 0.8011967626396953
Energy: 0.7828952370242643
Energy: 0.8011967626403989
Energy: 0.7828952370242643
Energy: 0.764277585642765
Energy: 0.7782215485700638
Energy: 0.764277585642765
Energy: 0.7782215485693603
Energy: 0.7642775856420935
Energy: 0.7782215485693603
Energy: 0.7787034114928472
Energy: 0.8417004479717177
Energy: 0.7787034114942541
Energy: 0.8417004479717177
Energy: 0.7787034114935507
Energy: 0.8417004479717177
Energy: 0.8327205072718953
Energy: 0.8143933136703198
Energy: 0.8327205072718953
Energy: 0.8143933136703198
Energy: 0.8327205072725986
Energy: 0.8143933136710232

minimum gb energy = 0.7642775856420935 eV
minimum distance =  2.34309285112432 Angstroms
sigma value = 19


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

Energy: 0.7770921636735881
Energy: 0.8058034947817679
Energy: 0.7770921636741953
Energy: 0.8058034947817679
Energy: 0.7770921636741953
Energy: 0.8058034947817679
Energy: 0.7716141054402443
Energy: 0.7700302103075787
Energy: 0.7716141054408515
Energy: 0.7700302103075787
Energy: 0.7716141054402443
Energy: 0.7700302103075787
Energy: 0.8000233243390766
Energy: 0.7401110223532775
Energy: 0.8000233243390766
Energy: 0.7401110223532775
Energy: 0.8000233243390766
Energy: 0.7401110223532775
Energy: 0.7500312676915691
Energy: 0.7898088666305308
Energy: 0.7500312676921765
Energy: 0.7898088666311383
Energy: 0.750031267690962
Energy: 0.7898088666311383
Energy: 0.769588502728139
Energy: 0.7738483145506116
Energy: 0.7695885027269245
Energy: 0.7738483145506116
Energy: 0.769588502728139
Energy: 0.7738483145506116
Energy: 0.7812501341079778
Energy: 0.7541186771800166
Energy: 0.7812501341079778
Energy: 0.7541186771800166
Energy: 0.7812501341073707
Energy: 0.7541186771800166
Energy: 0.7492294903971494
Energy: 0.7877916080084854
Energy: 0.7492294903971494
Energy: 0.7877916080084854
Energy: 0.7492294903971494
Energy: 0.7877916080096998
Energy: 0.7668248726718567
Energy: 0.7963925825249273
Energy: 0.7668248726712495
Energy: 0.7963925825249273
Energy: 0.7668248726718567
Energy: 0.7963925825249273
Energy: 0.8153763610645868
Energy: 0.7443758186703547
Energy: 0.815376361065194
Energy: 0.7443758186697476
Energy: 0.815376361065194
Energy: 0.7443758186697476
Energy: 0.7679286075797486
Energy: 0.7659190885588809
Energy: 0.7679286075785341
Energy: 0.7659190885588809
Energy: 0.7679286075797486
Energy: 0.7659190885588809
Energy: 0.7456664885675144
Energy: 0.8116232100647363
Energy: 0.7456664885681217
Energy: 0.8116232100647363
Energy: 0.7456664885675144
Energy: 0.8116232100647363
Energy: 0.7781482373168003
Energy: 0.7444338258144584
Energy: 0.7781482373161931
Energy: 0.7444338258144584
Energy: 0.7781482373168003
Energy: 0.7444338258150656
Energy: 0.7532701342467446
Energy: 0.7535617805872932
Energy: 0.7532701342467446
Energy: 0.7535617805872932
Energy: 0.7532701342473519
Energy: 0.7535617805872932
Energy: 0.7476259921561451
Energy: 0.7907470699298992
Energy: 0.7476259921555379
Energy: 0.7907470699298992
Energy: 0.7476259921555379
Energy: 0.7907470699298992
Energy: 0.7832859560713469
Energy: 0.7484860068910696
Energy: 0.7832859560719542
Energy: 0.7484860068910696
Energy: 0.7832859560713469
Energy: 0.7484860068910696
Energy: 0.8127691088798032
Energy: 0.7398079497871294
Energy: 0.8127691088810177
Energy: 0.7398079497871294
Energy: 0.8127691088804105
Energy: 0.7398079497871294
Energy: 0.7499782621160281
Energy: 0.7876195324190126
Energy: 0.7499782621154208
Energy: 0.7876195324190126
Energy: 0.7499782621160281
Energy: 0.7876195324190126
Energy: 0.7774463218039047
Energy: 0.7869762136186175
Energy: 0.777446321804512
Energy: 0.7869762136186175
Energy: 0.777446321804512
Energy: 0.7869762136191971
Energy: 0.7965058249914874
Energy: 0.7545124020575589
Energy: 0.8327256999104864
Energy: 0.7545124020575589
Energy: 0.8327256999092719
Energy: 0.7545124020581662
Energy: 0.7507323821297682
Energy: 0.7842154577537024
Energy: 0.7507323821297682
Energy: 0.7842154577537024
Energy: 0.7507323821303754
Energy: 0.7842154577537024
Energy: 0.743054655739485
Energy: 0.8001584599276124
Energy: 0.743054655739485
Energy: 0.8001584599276124
Energy: 0.743054655739485
Energy: 0.8001584599276124
Energy: 0.8245134301558231
Energy: 0.7403712205167474
Energy: 0.8245134301558231
Energy: 0.7403712205167474
Energy: 0.8245134301552157
Energy: 0.7403712205167474
Energy: 0.7792076590344773
Energy: 0.7600026725245876
Energy: 0.77920765903387
Energy: 0.760002672525195
Energy: 0.7792076590350846
Energy: 0.7600026725258022
Energy: 0.7784005324108842
Energy: 0.8081171833069547
Energy: 0.7784005324114914
Energy: 0.8081171833069547
Energy: 0.7784005324114914
Energy: 0.8081171833063474
Energy: 0.8038591146720442
Energy: 0.7462837656286958
Energy: 0.8038591146714368
Energy: 0.7462837656286958
Energy: 0.8038591146720442
Energy: 0.7462837656286958
Energy: 0.7648875985188786
Energy: 0.7553572450514093
Energy: 0.7648875985182714
Energy: 0.7553572450514093
Energy: 0.7648875985188786
Energy: 0.7553572450520167
Energy: 0.7522011984720723
Energy: 0.8090695125039922
Energy: 0.7436886068438738
Energy: 0.8090695125045994
Energy: 0.7522011984720723
Energy: 0.8090695125039922
Energy: 0.780900739947893
Energy: 0.7592925834146989
Energy: 0.7809007399485002
Energy: 0.759292583415306
Energy: 0.7809007399491075
Energy: 0.7592925834140916
Energy: 0.7996902948837977
Energy: 0.7538397134674352
Energy: 0.7996902948844049
Energy: 0.7538397134680423
Energy: 0.7996902948831904
Energy: 0.7538397134674352

minimum gb energy = 0.7398079497871294 eV
minimum distance =  2.31978132930738 Angstroms
sigma value = 101


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

Energy: 0.7548387991459112
Energy: 0.7676579034310655
Energy: 0.7548387991459112
Energy: 0.7676579034310655
Energy: 0.7548387991459112
Energy: 0.7676579034310655
Energy: 0.7602746605850275
Energy: 0.7450134175135337
Energy: 0.7602746605844938
Energy: 0.745013417513
Energy: 0.7602746605855614
Energy: 0.745013417513
Energy: 0.7535802656062984
Energy: 0.7100780055249755
Energy: 0.7535802656057646
Energy: 0.7100780055255091
Energy: 0.7535802656062984
Energy: 0.7100780055255091
Energy: 0.7057236890581042
Energy: 0.772714792129624
Energy: 0.705723689056503
Energy: 0.772714792129624
Energy: 0.7057236890575705
Energy: 0.772714792129624
Energy: 0.7364772983099186
Energy: 0.7281468393171037
Energy: 0.7364772983099186
Energy: 0.7281468393176376
Energy: 0.7364772983109862
Energy: 0.7281468393176376
Energy: 0.7575351786647659
Energy: 0.710301933325479
Energy: 0.7575351786663673
Energy: 0.710301933325479
Energy: 0.7575351786658336
Energy: 0.710301933325479
Energy: 0.721648078561766
Energy: 0.7615044206884531
Energy: 0.7216480785590971
Energy: 0.7615044206884531
Energy: 0.7216480785612323
Energy: 0.7615044206884531
Energy: 0.7097468608985584
Energy: 0.7562425891237419
Energy: 0.7097468608996261
Energy: 0.7562425891242756
Energy: 0.7097468608990923
Energy: 0.7562425891237419
Energy: 0.7573548584088979
Energy: 0.706041651378932
Energy: 0.7573548584099655
Energy: 0.706041651378932
Energy: 0.7573548584099655
Energy: 0.706041651378932
Energy: 0.7379247478996332
Energy: 0.7620081129663151
Energy: 0.7379247478996332
Energy: 0.7620081129663151
Energy: 0.7379247478996332
Energy: 0.7620081129663151
Energy: 0.710575936838439
Energy: 0.8427924005627873
Energy: 0.7105759368389728
Energy: 0.842792400563321
Energy: 0.7105759368389728
Energy: 0.842792400563321
Energy: 0.7704005255707818
Energy: 0.7442790060833061
Energy: 0.770400525570248
Energy: 0.7442790060849074
Energy: 0.770400525570248
Energy: 0.7442790060833061
Energy: 0.7511957844917162
Energy: 0.7099068647744833
Energy: 0.75119578449225
Energy: 0.7099068647744833
Energy: 0.7511957844911824
Energy: 0.7099068647744833
Energy: 0.7403292557776702
Energy: 0.7678529323192983
Energy: 0.740329255778204
Energy: 0.7678529323192983
Energy: 0.740329255778204
Energy: 0.7678529323192983
Energy: 0.75821001546521
Energy: 0.7247124873041528
Energy: 0.75821001546521
Energy: 0.7247124873046866
Energy: 0.7582100154662776
Energy: 0.7247124873041528
Energy: 0.7532860387846934
Energy: 0.7095022693900214
Energy: 0.7532860387836258
Energy: 0.7095022693905552
Energy: 0.7532860387846934
Energy: 0.7095022693900214
Energy: 0.7086762857100775
Energy: 0.771224874909584
Energy: 0.7086762857095437
Energy: 0.7712248749111853
Energy: 0.7086762857095437
Energy: 0.7712248749106515
Energy: 0.7097731348147809
Energy: 0.7272174176720675
Energy: 0.7097731348147809
Energy: 0.7272174176720675
Energy: 0.7097731348147809
Energy: 0.7272174176720675
Energy: 0.7581023380518686
Energy: 0.7061039306602268
Energy: 0.7581023380529361
Energy: 0.7061039306602268
Energy: 0.7581023380540037
Energy: 0.7061039306602268
Energy: 0.7353851449888177
Energy: 0.7609975662842045
Energy: 0.7353851449893515
Energy: 0.7609975662842045
Energy: 0.7353851449888177
Energy: 0.7609975662842045
Energy: 0.7094685567921855
Energy: 0.8463442028124138
Energy: 0.7094685567927193
Energy: 0.8463442028129476
Energy: 0.7094685567921855
Energy: 0.8463442028124138
Energy: 0.7647487170523721
Energy: 0.7083769740869639
Energy: 0.7647487170507706
Energy: 0.7083769740869639
Energy: 0.7647487170513045
Energy: 0.7083769740869639
Energy: 0.7771849762159699
Energy: 0.7094395078969177
Energy: 0.777184976215436
Energy: 0.7094395078969177
Energy: 0.7771849762159699
Energy: 0.7094395078963839
Energy: 0.705631167651468
Energy: 0.7833299406666467
Energy: 0.7056311676504005
Energy: 0.7833299406666467
Energy: 0.705631167651468
Energy: 0.7833299406666467
Energy: 0.7669150012551889
Energy: 0.7218768154790449
Energy: 0.7669150012557227
Energy: 0.7218768154785112
Energy: 0.7669150012562566
Energy: 0.7218768154785112
Energy: 0.749189735323674
Energy: 0.7094973709684329
Energy: 0.7491897353204713
Energy: 0.7094973709684329
Energy: 0.7491897353226065
Energy: 0.7094973709689667
Energy: 0.7402757201162682
Energy: 0.7691503753178244
Energy: 0.7402757201152006
Energy: 0.7691503753183582
Energy: 0.7402757201168021
Energy: 0.769150375318892
Energy: 0.7402649743928021
Energy: 0.7487012967304811
Energy: 0.740264974393336
Energy: 0.7487012967299473
Energy: 0.740264974393336
Energy: 0.7487012967310149
Energy: 0.7850704714125185
Energy: 0.7064022229695092
Energy: 0.7850704714130523
Energy: 0.7064022229695092
Energy: 0.7850704714125185
Energy: 0.7064022229695092
Energy: 0.7094573465632793
Energy: 0.7697223306542303
Energy: 0.7094573465632793
Energy: 0.7697223306542303
Energy: 0.7094573465632793
Energy: 0.7697223306536967
Energy: 0.7090003387449679
Energy: 0.7613677215500667
Energy: 0.7090003387460355
Energy: 0.7613677215500667
Energy: 0.7090003387449679
Energy: 0.7613677215500667
Energy: 0.7737446218603676
Energy: 0.7089756398968655
Energy: 0.7737446218603676
Energy: 0.7089756398968655
Energy: 0.7737446218598337
Energy: 0.7089756398968655
Energy: 0.7642238375168945
Energy: 0.7090527559049333
Energy: 0.7642238375168945
Energy: 0.7090527559054671
Energy: 0.7642238375163606
Energy: 0.7090527559054671

minimum gb energy = 0.7056311676504005 eV
minimum distance =  2.32529004540382 Angstroms
sigma value = 33


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

Energy: 0.015605359800515107
Energy: 0.5818368254335646
Energy: 0.015605359800096228
Energy: 0.5818368254331211
Energy: 0.015605359800096228
Energy: 0.5818368254335646
Energy: 0.016933769060936986
Energy: 0.21548078435542936
Energy: 0.016933769060518106
Energy: 0.21548078435542936
Energy: 0.016933769060936986
Energy: 0.21548078435501047
Energy: 0.8567735362909862
Energy: 0.21556415683419525
Energy: 0.8567735362788633
Energy: 0.21556415684589922
Energy: 0.8567735362823374
Energy: 0.21556415684111907
Energy: 0.016933769060074585
Energy: 0.21548078435629175
Energy: 0.016933769060074585
Energy: 0.21548078435629175
Energy: 0.016933769059631065
Energy: 0.2154807843558729

minimum gb energy = 0.015605359800096228 eV
minimum distance =  2.5457500713016 Angstroms
sigma value = 1