Model name: model_name=Sim_LAMMPS_ADP_StarikovGordeevLysogorskiy_2020_SiAuAl__SM_113843830602_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.025435209274292
cohesive_energy=3.381271244149137
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
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: 0.011923471106374888
Energy: 0.19039347020032546
Energy: 0.1903934702014912
Energy: 0.011923471106374888
Energy: 0.1903934702014912
Energy: 0.19039347020032546
Energy: 0.011923471106374888
Energy: 0.19039347020032546
Energy: 0.19039347020032546
Energy: 0.011923471106374888
Energy: 0.18983940765620463
Energy: 0.01257702275610508
Energy: 0.19061410447360105
Energy: 0.18983940765620463
Energy: 0.01257702275610508
Energy: 0.19061410447360105
Energy: 0.18983940765620463
Energy: 0.01257702275610508
Energy: 0.19061410447360105
Energy: 0.18983940765620463
Energy: 0.4636430399794069
Energy: 0.12012062464989576
Energy: 0.12012062464989576
Energy: 0.4636430399864015
Energy: 0.12012062464873001
Energy: 0.12012062464989576
Energy: 0.4636430400167114
Energy: 0.12012062464989576
Energy: 0.12012062464873001
Energy: 0.4636430399805726
Energy: 0.18983940765620463
Energy: 0.19061410447360105
Energy: 0.01257702275610508
Energy: 0.18983940765620463
Energy: 0.19061410447243524
Energy: 0.01257702275610508
Energy: 0.18983940765620463
Energy: 0.19061410447360105
Energy: 0.01257702275610508
Energy: 0.18983940765620463
Energy: 0.011923471106374888
Energy: 0.19039347020032546
Energy: 0.1903934702014912
Energy: 0.011923471106374888
Energy: 0.19039347020032546
Energy: 0.1903934702014912
Energy: 0.011923471106374888
Energy: 0.1903934702014912
Energy: 0.19039347020032546
Energy: 0.011923471106374888
Energy: 0.18983940765620463
Energy: 0.01257702275610508
Energy: 0.19061410447360105
Energy: 0.18983940765620463
Energy: 0.01257702275610508
Energy: 0.19061410447360105
Energy: 0.18983940765620463
Energy: 0.01257702275610508
Energy: 0.19061410447360105
Energy: 0.18983940765620463
Energy: 0.46364303998756723
Energy: 0.12012062464873001
Energy: 0.12012062464873001
Energy: 0.4636430399910645
Energy: 0.12012062464989576
Energy: 0.12012062464989576
Energy: 0.4636430399840699
Energy: 0.12012062464873001
Energy: 0.12012062464873001
Energy: 0.4636430399840699

minimum gb energy = 0.011923471106374888 eV
minimum distance =  2.65525276715558 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 0.5148717299864007
Energy: 0.6184999283565215
Energy: 0.6182547072470895
Energy: 0.4890896241506049
Energy: 0.6184999283565215
Energy: 0.6182547072479463
Energy: 0.5148717299864007
Energy: 0.6184999283568069
Energy: 0.6182547072473752
Energy: 0.4890896241506049
Energy: 0.5402829380903921
Energy: 0.4961540352825996
Energy: 0.5852047197315482
Energy: 0.5402829388727574
Energy: 0.49615403528231417
Energy: 0.5852047181953729
Energy: 0.5402829391410482
Energy: 0.4961540352825996
Energy: 0.5852047147919357
Energy: 0.5402829383135912
Energy: 0.5499159011051203
Energy: 0.6139322575546147
Energy: 0.6242503474118232
Energy: 0.5423770513140034
Energy: 0.6139322575546147
Energy: 0.6242503474126798
Energy: 0.5499159011048348
Energy: 0.6139322575549003
Energy: 0.6242503474123942
Energy: 0.5423770513140034
Energy: 0.6240822876577957
Energy: 0.6525545786296578
Energy: 0.4659460579160841
Energy: 0.6240822876580813
Energy: 0.6525545786296578
Energy: 0.46594605791579863
Energy: 0.6240822876580813
Energy: 0.6525545786290866
Energy: 0.46594605791579863
Energy: 0.6240822876577957
Energy: 0.4471656864318281
Energy: 0.6344627123179819
Energy: 0.6066488261212146
Energy: 0.4471656864318281
Energy: 0.6399813840659762
Energy: 0.6093019884639165
Energy: 0.4471656864315425
Energy: 0.6344627123182673
Energy: 0.6066488261212146
Energy: 0.4471656864315425
Energy: 0.6336433947281607
Energy: 0.47229559769917107
Energy: 0.5796901182134927
Energy: 0.6336433947281607
Energy: 0.4722955976971723
Energy: 0.579690118212636
Energy: 0.6336433947281607
Energy: 0.47229559769917107
Energy: 0.5796901182117793
Energy: 0.6336433947284461
Energy: 0.6049185496470797
Energy: 0.5606478917461721
Energy: 0.6368390623970787
Energy: 0.604918549648222
Energy: 0.5606478917581394
Energy: 0.6368390623965076
Energy: 0.6049185496479363
Energy: 0.5606478917752726
Energy: 0.6368390623967931
Energy: 0.604918549648222
Energy: 0.6036665693191184
Energy: 0.5971150905780377
Energy: 0.49273095630494723
Energy: 0.6036665693191184
Energy: 0.5971150905780377
Energy: 0.492703183908664
Energy: 0.6036665693188328
Energy: 0.5971150905780377
Energy: 0.4927309563052328
Energy: 0.6036665693191184
Energy: 0.4659771560717114
Energy: 0.6189698322307262
Energy: 0.6279866695898415
Energy: 0.49357439751126053
Energy: 0.6189698322312973
Energy: 0.6279866695904127
Energy: 0.4659771560717114
Energy: 0.6189698322307262
Energy: 0.6279866695892705
Energy: 0.49357439751126053
Energy: 0.6141187064540421
Energy: 0.6328977836327999
Energy: 0.48811241683572104
Energy: 0.6399746397102609
Energy: 0.6328977836322288
Energy: 0.5371748931316416
Energy: 0.6141187064543276
Energy: 0.6328977836325145
Energy: 0.48811241683486445
Energy: 0.6399746397096898
Energy: 0.6185711244062734
Energy: 0.4965909211423578
Energy: 0.5415885834645098
Energy: 0.6185711244059877
Energy: 0.49659092114264336
Energy: 0.5415885834645098
Energy: 0.6185711244062734
Energy: 0.49659092114264336
Energy: 0.5415885834642242
Energy: 0.6185711244059877
Energy: 0.6182509060383722
Energy: 0.6183040376924065
Energy: 0.4658478257008086
Energy: 0.6182509060383722
Energy: 0.6183040376938344
Energy: 0.46584782570109423
Energy: 0.6182509060380865
Energy: 0.6183040376806989
Energy: 0.46584782570137967
Energy: 0.6182509060380865
Energy: 0.49965618829560277
Energy: 0.6285611356019833
Energy: 0.5219006184347723
Energy: 0.49965618829560277
Energy: 0.6279183177757093
Energy: 0.521900618435058
Energy: 0.49965618829588826
Energy: 0.6285611356022688
Energy: 0.5219006184347723
Energy: 0.49965618829588826
Energy: 0.5610190638609368
Energy: 0.5930144027648224
Energy: 0.6061178525163032
Energy: 0.5610190638603657
Energy: 0.591794796137443
Energy: 0.6061178525160177
Energy: 0.5610190638603657
Energy: 0.593014402765108
Energy: 0.6061178525140187
Energy: 0.5610190638609368
Energy: 0.6048308727647709
Energy: 0.46588761453728583
Energy: 0.6041872546977763
Energy: 0.6048308727650564
Energy: 0.46588761453728583
Energy: 0.6041872546977763
Energy: 0.6048308727650564
Energy: 0.46588761453728583
Energy: 0.6041872546977763
Energy: 0.6048308727650564
Energy: 0.5933673673550393
Energy: 0.5871011627237417
Energy: 0.4960993421806595
Energy: 0.5933673673544682
Energy: 0.5871011627245983
Energy: 0.4960418405752705
Energy: 0.5933673673541826
Energy: 0.5871011627240273
Energy: 0.4960993421806595
Energy: 0.5933673673544682
Energy: 0.5183719072289276
Energy: 0.5218744103324573
Energy: 0.6344781191102185
Energy: 0.5183719072292131
Energy: 0.5218744103318861
Energy: 0.6344781191102185
Energy: 0.5183719072292131
Energy: 0.5218744103321716
Energy: 0.6344781191102185
Energy: 0.5183719072289276
Energy: 0.5184795704046011
Energy: 0.646142466157309
Energy: 0.6183497830437121
Energy: 0.491097915836348
Energy: 0.6461424661575946
Energy: 0.6183497830439978
Energy: 0.5184795704048868
Energy: 0.6461424661578801
Energy: 0.6183497830439978
Energy: 0.4910979158366336
Energy: 0.6165363246720683
Energy: 0.492741717437614
Energy: 0.6159033470880384
Energy: 0.616536324667214
Energy: 0.492741717437614
Energy: 0.6159033470880384
Energy: 0.6165363246729251
Energy: 0.492741717437614
Energy: 0.6159033470880384
Energy: 0.6165363246680706
Energy: 0.6182892877510123
Energy: 0.6546907148945127
Energy: 0.5166565550929706
Energy: 0.6182892877510123
Energy: 0.6546907148953695
Energy: 0.5166565550929706
Energy: 0.6182892877507268
Energy: 0.6546907148939416
Energy: 0.5166565550929706
Energy: 0.6182892877501557
Energy: 0.6343737303845537
Energy: 0.5013405072707164
Energy: 0.47239169715648993
Energy: 0.6343737303845537
Energy: 0.5012444503237578
Energy: 0.47239169715648993
Energy: 0.6343737303842681
Energy: 0.5013405072701453
Energy: 0.4723916971556333
Energy: 0.6343737303845537
Energy: 0.44719627694275393
Energy: 0.6085583838341905
Energy: 0.6339877730739554
Energy: 0.44719627694275393
Energy: 0.6136100357536596
Energy: 0.594206379546892
Energy: 0.44719627694275393
Energy: 0.608558383833905
Energy: 0.6339877730745265
Energy: 0.44719627694275393
Energy: 0.6050329921794141
Energy: 0.4660322397810355
Energy: 0.6041345814811211
Energy: 0.6050329921794141
Energy: 0.4660322397810355
Energy: 0.6041345814811211
Energy: 0.6050329921791285
Energy: 0.4660322397813211
Energy: 0.6041345814814066
Energy: 0.6050329921791285
Energy: 0.5133174989733819
Energy: 0.6252011774060734
Energy: 0.5608804257277754
Energy: 0.5133174989736675
Energy: 0.6252011774060734
Energy: 0.560880425728061
Energy: 0.5133174989733819
Energy: 0.6252011774063589
Energy: 0.5608804257283465
Energy: 0.5133174989733819
Energy: 0.5155310332816898
Energy: 0.5952357920135556
Energy: 0.4964656556961426
Energy: 0.5155310332788343
Energy: 0.5952357920129844
Energy: 0.496392251304123
Energy: 0.5155310332788343
Energy: 0.5952357920129844
Energy: 0.49646565569557155
Energy: 0.5155310332782632
Energy: 0.4657538437802118
Energy: 0.6184999283565215
Energy: 0.6182547072482318
Energy: 0.4918923469708119
Energy: 0.6184999283565215
Energy: 0.6182547072468041
Energy: 0.46575384377992624
Energy: 0.6184999283565215
Energy: 0.6182547072488029
Energy: 0.4918923469708119
Energy: 0.5402829383666782
Energy: 0.4961540352825996
Energy: 0.5852047168647184
Energy: 0.5402829385265364
Energy: 0.49615403528231417
Energy: 0.5852047161851005
Energy: 0.5402829382839196
Energy: 0.4961540352828852
Energy: 0.5852047170299761
Energy: 0.5402829387331736
Energy: 0.5807419899951651
Energy: 0.6139322575546147
Energy: 0.6242503474121086
Energy: 0.573599816272773
Energy: 0.6139322575546147
Energy: 0.6242503474121086
Energy: 0.5807419899954508
Energy: 0.6139322575549003
Energy: 0.6242503474123942
Energy: 0.573599816272773
Energy: 0.6240822876580813
Energy: 0.6525545786293723
Energy: 0.4659460579160841
Energy: 0.6240822876580813
Energy: 0.6525545786293723
Energy: 0.46594605791579863
Energy: 0.6240822876580813
Energy: 0.6525545786290866
Energy: 0.46594605791579863
Energy: 0.6240822876577957

minimum gb energy = 0.4471656864315425 eV
minimum distance =  2.53157987717647 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 0.5645437332774851
Energy: 0.4760082835195486
Energy: 0.47611913379959947
Energy: 0.5294714998858291
Energy: 0.4760082835195486
Energy: 0.47611913379959947
Energy: 0.5645437332788784
Energy: 0.4760082835195486
Energy: 0.4761191337982061
Energy: 0.5294714998858291
Energy: 0.47661950473495096
Energy: 0.5635597381722486
Energy: 0.4760387639651911
Energy: 0.4766195047363444
Energy: 0.5635597381722486
Energy: 0.4760387638677066
Energy: 0.47661950473495096
Energy: 0.5635597381722486
Energy: 0.4760387639651911
Energy: 0.47661950473495096
Energy: 0.5566471376853012
Energy: 0.5644188179106546
Energy: 0.4727691647590098
Energy: 0.5610804619744759
Energy: 0.5644188179092613
Energy: 0.4727691647590098
Energy: 0.5566471376839078
Energy: 0.5644188179092613
Energy: 0.4727691647590098
Energy: 0.5610804619744759
Energy: 0.5375738831333629
Energy: 0.537828828617175
Energy: 0.47516211449036727
Energy: 0.5324418959027277
Energy: 0.5326202753436372
Energy: 0.47516211449036727
Energy: 0.5375738831333629
Energy: 0.5378288286185683
Energy: 0.475162114488974
Energy: 0.532441895904121
Energy: 0.5244905691051855
Energy: 0.5879642796022914
Energy: 0.5260796589663105
Energy: 0.5509406297733718
Energy: 0.5879642796022914
Energy: 0.5260796589649172
Energy: 0.5244905691079722
Energy: 0.5879642796022914
Energy: 0.5260796589635237
Energy: 0.5509406297761331
Energy: 0.4719761830999937
Energy: 0.5561476317199511
Energy: 0.5759372617288965
Energy: 0.4719761830999937
Energy: 0.5561476317185576
Energy: 0.5759372617288965
Energy: 0.4719761830986003
Energy: 0.5561476317171643
Energy: 0.5759372617288965
Energy: 0.4719761830999937
Energy: 0.475417655191282
Energy: 0.5293023406597226
Energy: 0.4727784019979817
Energy: 0.475417655191282
Energy: 0.5361792773160597
Energy: 0.4727784019993751
Energy: 0.475417655191282
Energy: 0.5293023406611159
Energy: 0.4727784019993751
Energy: 0.475417655191282
Energy: 0.480417664491625
Energy: 0.5960495161909127
Energy: 0.561668185355609
Energy: 0.4804176644944117
Energy: 0.5960495161895195
Energy: 0.5616681853570022
Energy: 0.4804176644971985
Energy: 0.5960495161909127
Energy: 0.5616681853570022
Energy: 0.48041766449580514
Energy: 0.47266975120831417
Energy: 0.5467296448402934
Energy: 0.5512875618441225
Energy: 0.47266975120831417
Energy: 0.557780502666589
Energy: 0.5512875618441225
Energy: 0.47266975120831417
Energy: 0.5467296448416868
Energy: 0.5512875618455159
Energy: 0.47266975120970756
Energy: 0.47270083715227984
Energy: 0.5407251984270414
Energy: 0.5414128770404114
Energy: 0.47270083715088645
Energy: 0.5345480516959403
Energy: 0.5352374721756356
Energy: 0.47270083715227984
Energy: 0.5407251984284347
Energy: 0.5414128770404114
Energy: 0.4727008371536732
Energy: 0.5730477848097492
Energy: 0.5629494136062716
Energy: 0.6828627796376573
Energy: 0.5730477848097492
Energy: 0.5629417969008083
Energy: 0.6828627796376573
Energy: 0.5730477848083557
Energy: 0.5629494136062716
Energy: 0.6828627796376573
Energy: 0.5730477848097492
Energy: 0.5522341413204296
Energy: 0.4729419644296559
Energy: 0.5578468331083768
Energy: 0.5522341413190361
Energy: 0.47294196443104924
Energy: 0.5578468331097701
Energy: 0.5522341413162495
Energy: 0.47294196442686914
Energy: 0.5578468331083768
Energy: 0.5522341413190361
Energy: 0.502843375562104
Energy: 0.47276250723287205
Energy: 0.5436653834699912
Energy: 0.5028433755607107
Energy: 0.47276250723426544
Energy: 0.5429586176227493
Energy: 0.5028433755607107
Energy: 0.47276250723426544
Energy: 0.5436653834699912
Energy: 0.502843375562104
Energy: 0.5597290082289366
Energy: 0.48083544783640597
Energy: 0.4806894456345863
Energy: 0.5597290082289366
Energy: 0.4808354478377993
Energy: 0.4806894456345863
Energy: 0.5597290082303299
Energy: 0.48083544783640597
Energy: 0.48068944563319294
Energy: 0.5597290082289366
Energy: 0.5307993115273033
Energy: 0.5313188849902948
Energy: 0.5364597629439344
Energy: 0.53079931152591
Energy: 0.5313188849889015
Energy: 0.5426462043743333
Energy: 0.53079931152591
Energy: 0.5313188849889015
Energy: 0.5364597629439344
Energy: 0.53079931152591
Energy: 0.5696884927806845
Energy: 0.5032617172859666
Energy: 0.5362718941333532
Energy: 0.5696884927806845
Energy: 0.5032617172845731
Energy: 0.5419297188830344
Energy: 0.5696884927792909
Energy: 0.5032617172845731
Energy: 0.5362718941347465
Energy: 0.5696884927806845
Energy: 0.5692657198241634
Energy: 0.6573882725017532
Energy: 0.5620494614619672
Energy: 0.5692657198241634
Energy: 0.6573882725017532
Energy: 0.5617428414659366
Energy: 0.5692657198255567
Energy: 0.6573882725003851
Energy: 0.5620494614619672
Energy: 0.5692657198255567
Energy: 0.5498897314591054
Energy: 0.5085493992642689
Energy: 0.4744118280569316
Energy: 0.5371946377986404
Energy: 0.5085493992642689
Energy: 0.47441182805832494
Energy: 0.5498897314604988
Energy: 0.5085493992628755
Energy: 0.47441182805832494
Energy: 0.5371946377986404
Energy: 0.5491834481228187
Energy: 0.5294162011216068
Energy: 0.521165143189233
Energy: 0.5372366722647238
Energy: 0.5294162011230003
Energy: 0.5144058694173986
Energy: 0.5491834481200321
Energy: 0.5294162011216068
Energy: 0.521165143189233
Energy: 0.5372366722633306
Energy: 0.48019159944337386
Energy: 0.5616929343768423
Energy: 0.595472811048316
Energy: 0.48019159944198053
Energy: 0.5616929343782356
Energy: 0.5954728110469226
Energy: 0.48019159944198053
Energy: 0.5616929343768423
Energy: 0.595472811048316
Energy: 0.48019159944337386
Energy: 0.5422595571999516
Energy: 0.5435371783893495
Energy: 0.5282124379923033
Energy: 0.5360984701219821
Energy: 0.5383684177368759
Energy: 0.5282124379936967
Energy: 0.5422595571999516
Energy: 0.5435371783879813
Energy: 0.5282124379923033
Energy: 0.5360984701205886
Energy: 0.5432983417029433
Energy: 0.5435417505805227
Energy: 0.5038118605501943
Energy: 0.5369806923880095
Energy: 0.543541750581916
Energy: 0.503811860548801
Energy: 0.5432983417043368
Energy: 0.5435417505805227
Energy: 0.503811860548801
Energy: 0.536980692389403
Energy: 0.5598452335156585
Energy: 0.49004656310390765
Energy: 0.5573458181763788
Energy: 0.5598365722335569
Energy: 0.4900465630064232
Energy: 0.5573458181763788
Energy: 0.5598452335128719
Energy: 0.4900465631053011
Energy: 0.5573458181763788
Energy: 0.5598365722321634
Energy: 0.5254216525269169
Energy: 0.5423300651343422
Energy: 0.47245009601787435
Energy: 0.5254216525255235
Energy: 0.5429961822830152
Energy: 0.4724500960164809
Energy: 0.5254216525255235
Energy: 0.5423300651343422
Energy: 0.47245009601787435
Energy: 0.5254216525269169
Energy: 0.5617082366833213
Energy: 0.5444292338398998
Energy: 0.5296280358680983
Energy: 0.5507447007968707
Energy: 0.5447449976247821
Energy: 0.5296280358667049
Energy: 0.5617082366833213
Energy: 0.5444292338398998
Energy: 0.5296280358680983
Energy: 0.5507447007968707
Energy: 0.47657104673852513
Energy: 0.47617089176068195
Energy: 0.5633546094596827
Energy: 0.47657104673852513
Energy: 0.47617089175928856
Energy: 0.5633546094596827
Energy: 0.47657104673852513
Energy: 0.47617089175789523
Energy: 0.5633546094610761
Energy: 0.47657104673852513
Energy: 0.47191528831792173
Energy: 0.5362703331701477
Energy: 0.535139051743972
Energy: 0.4719152883193151
Energy: 0.5423757967121655
Energy: 0.542565431554513
Energy: 0.4719152883193151
Energy: 0.5362703331687544
Energy: 0.5351390517453655
Energy: 0.47191528831792173
Energy: 0.4725980023542463
Energy: 0.529231325146672
Energy: 0.5659872899979745
Energy: 0.4725980023542463
Energy: 0.513334352089744
Energy: 0.5659872899979745
Energy: 0.4725980023542463
Energy: 0.5292313251438853
Energy: 0.565987289999368
Energy: 0.4725980023542463
Energy: 0.557089767239237
Energy: 0.5616735340951968
Energy: 0.4898644206551281
Energy: 0.557089767239237
Energy: 0.5616874829699589
Energy: 0.48986442065234137
Energy: 0.557089767239237
Energy: 0.5616735340951968
Energy: 0.4898644206537348
Energy: 0.5570897672378436
Energy: 0.4719806251457054
Energy: 0.47244229989392844
Energy: 0.5364101949371328
Energy: 0.47198062514431205
Energy: 0.47244229989392844
Energy: 0.5294767214646582
Energy: 0.4719806251457054
Energy: 0.47244229989392844
Energy: 0.5364101949385007
Energy: 0.47198062514709876
Energy: 0.47211663390169406
Energy: 0.5215573841063108
Energy: 0.5763780329306564
Energy: 0.47211663390448083
Energy: 0.5215573841132776
Energy: 0.576378032929263
Energy: 0.47211663390169406
Energy: 0.5215573841313913
Energy: 0.5763780329320498
Energy: 0.4721166339030875
Energy: 0.5476973927838673
Energy: 0.521524862285566
Energy: 0.47475417909870776
Energy: 0.5476973927824739
Energy: 0.5215248622841726
Energy: 0.4747541790973144
Energy: 0.5476973927838673
Energy: 0.5215248622841726
Energy: 0.4747541790973144
Energy: 0.5476973927852606
Energy: 0.5376231110369954
Energy: 0.47449704665362724
Energy: 0.5326060077553972
Energy: 0.5324578797169176
Energy: 0.4744970466550207
Energy: 0.5378626528626177
Energy: 0.5376231110383889
Energy: 0.47449704665362724
Energy: 0.5326060077553972
Energy: 0.5324578797183109
Energy: 0.5700502735881525
Energy: 0.4727559962230818
Energy: 0.5473239183414527
Energy: 0.5700502735881525
Energy: 0.4727559962244751
Energy: 0.5401436822315601
Energy: 0.5700502735867591
Energy: 0.4727559962244751
Energy: 0.5473239183400593
Energy: 0.5700502735867591
Energy: 0.5287584829559266
Energy: 0.5630602474746744
Energy: 0.5633743341789553
Energy: 0.5287584829559266
Energy: 0.5630602474732811
Energy: 0.5634065420287118
Energy: 0.5287584829559266
Energy: 0.5630602474746744
Energy: 0.5633743341803487
Energy: 0.5287584829559266
Energy: 0.5645437332788784
Energy: 0.4760082835195486
Energy: 0.47611913379959947
Energy: 0.5294714998858291
Energy: 0.4760082835195486
Energy: 0.47611913379959947
Energy: 0.5645437332788784
Energy: 0.47600828352094204
Energy: 0.4761191337982061
Energy: 0.5294714998858291
Energy: 0.47661950473495096
Energy: 0.5635597381708553
Energy: 0.4760387639275957
Energy: 0.47661950473495096
Energy: 0.5635597381722486
Energy: 0.47603876409750956
Energy: 0.47661950473495096
Energy: 0.5635597381722486
Energy: 0.47603876396101097
Energy: 0.47661950473495096
Energy: 0.5566471376853012
Energy: 0.5644188179092613
Energy: 0.4727691647590098
Energy: 0.5610804619758692
Energy: 0.5644188179092613
Energy: 0.4727691647590098
Energy: 0.5566471376839078
Energy: 0.5644188179106546
Energy: 0.4727691647590098
Energy: 0.5610804619744759
Energy: 0.5375738831333629
Energy: 0.537828828617175
Energy: 0.47516211449036727
Energy: 0.5324418959027277
Energy: 0.5326202753436372
Energy: 0.47516211449036727
Energy: 0.5375738831333629
Energy: 0.5378288286185683
Energy: 0.47516211449036727
Energy: 0.532441895904121
Energy: 0.5244905691065789
Energy: 0.5879642796036846
Energy: 0.5260796589649172
Energy: 0.5509406297733718
Energy: 0.5879642796022914
Energy: 0.5260796589635237
Energy: 0.5244905691065789
Energy: 0.5879642796022914
Energy: 0.5260796589663105
Energy: 0.5509406297747651
Energy: 0.471976183101387
Energy: 0.5561476317199511
Energy: 0.5759372617288965
Energy: 0.4719761830999937
Energy: 0.5561476317185576
Energy: 0.5759372617288965
Energy: 0.4719761830986003
Energy: 0.5561476317185576
Energy: 0.5759372617288965
Energy: 0.4719761830999937
Energy: 0.4754176551926754
Energy: 0.5293023406597226
Energy: 0.4727784019979817
Energy: 0.475417655191282
Energy: 0.5361792773174531
Energy: 0.4727784019993751
Energy: 0.475417655191282
Energy: 0.5293023406611159
Energy: 0.4727784019993751
Energy: 0.475417655191282
Energy: 0.4804176644971985
Energy: 0.5960495161909127
Energy: 0.5616681853570022
Energy: 0.48041766449580514
Energy: 0.5960495161909127
Energy: 0.5616681853570022
Energy: 0.48041766449301837
Energy: 0.5960495161909127
Energy: 0.5616681853570022
Energy: 0.48041766449301837
Energy: 0.47266975120831417
Energy: 0.5467296448402934
Energy: 0.5512875618441225
Energy: 0.47266975120831417
Energy: 0.557780502666589
Energy: 0.5512875618455159
Energy: 0.47266975120831417
Energy: 0.5467296448416868
Energy: 0.5512875618455159
Energy: 0.47266975120970756
Energy: 0.47270083715227984
Energy: 0.5407251984270414
Energy: 0.5414128770390181
Energy: 0.47270083715088645
Energy: 0.5345480516959403
Energy: 0.5352374721756356
Energy: 0.47270083715227984
Energy: 0.5407251984284347
Energy: 0.5414128770404114
Energy: 0.4727008371536732
Energy: 0.5730477848097492
Energy: 0.5629494136062716
Energy: 0.6828627796376573
Energy: 0.5730477848097492
Energy: 0.5629417969008083
Energy: 0.6828627796376573
Energy: 0.5730477848097492
Energy: 0.5629494136062716
Energy: 0.6828627796376573
Energy: 0.5730477848097492
Energy: 0.5522341413204296
Energy: 0.4729419644296559
Energy: 0.5578468331083768
Energy: 0.5522341413190361
Energy: 0.47294196443104924
Energy: 0.5578468331097701
Energy: 0.5522341413176427
Energy: 0.47294196442826253
Energy: 0.5578468331083768
Energy: 0.5522341413190361
Energy: 0.502843375562104
Energy: 0.47276250723287205
Energy: 0.5436653834699912
Energy: 0.5028433755607107
Energy: 0.47276250723426544
Energy: 0.5429586176227493
Energy: 0.5028433755607107
Energy: 0.47276250723426544
Energy: 0.5436653834699912
Energy: 0.5028433755607107
Energy: 0.5597290082289366
Energy: 0.48083544783640597
Energy: 0.48068944563319294
Energy: 0.5597290082303299
Energy: 0.4808354478377993
Energy: 0.4806894456345863
Energy: 0.5597290082303299
Energy: 0.48083544783640597
Energy: 0.48068944563319294
Energy: 0.5597290082289366
Energy: 0.53079931152591
Energy: 0.5313188849902948
Energy: 0.5364597629439344
Energy: 0.53079931152591
Energy: 0.5313188849889015
Energy: 0.5426462043743333
Energy: 0.5307993115245164
Energy: 0.5313188849889015
Energy: 0.5364597629453278
Energy: 0.53079931152591
Energy: 0.5696884927806845
Energy: 0.5032617172859666
Energy: 0.5362718941333532
Energy: 0.5696884927806845
Energy: 0.5032617172845731
Energy: 0.5419297188830344
Energy: 0.5696884927806845
Energy: 0.5032617172845731
Energy: 0.5362718941347465
Energy: 0.5696884927792909
Energy: 0.5692657198241634
Energy: 0.6573882725031465
Energy: 0.562049461460574
Energy: 0.5692657198241634
Energy: 0.6573882725017532
Energy: 0.5617428414659366
Energy: 0.5692657198255567
Energy: 0.6573882725003851
Energy: 0.5620494614633607
Energy: 0.5692657198241634
Energy: 0.5498897314591054
Energy: 0.5085493992642689
Energy: 0.4744118280569316
Energy: 0.5371946377986404
Energy: 0.5085493992642689
Energy: 0.4744118280555382
Energy: 0.5498897314604988
Energy: 0.5085493992628755
Energy: 0.47441182805832494
Energy: 0.5371946377986404
Energy: 0.5491834481228187
Energy: 0.5294162011216068
Energy: 0.521165143189233
Energy: 0.5372366722647238
Energy: 0.5294162011230003
Energy: 0.5144058694173986
Energy: 0.5491834481200321
Energy: 0.5294162011230003
Energy: 0.521165143189233
Energy: 0.5372366722633306
Energy: 0.48019159944337386
Energy: 0.5616929343768423
Energy: 0.595472811048316
Energy: 0.48019159944198053
Energy: 0.5616929343768423
Energy: 0.5954728110469226
Energy: 0.48019159944198053
Energy: 0.5616929343768423
Energy: 0.595472811048316
Energy: 0.48019159944337386
Energy: 0.5422595571999516
Energy: 0.5435371783893495
Energy: 0.5282124379936967
Energy: 0.5360984701205886
Energy: 0.5383684177368759
Energy: 0.5282124379936967
Energy: 0.5422595571999516
Energy: 0.5435371783879813
Energy: 0.5282124379923033
Energy: 0.5360984701205886
Energy: 0.5432983417029433
Energy: 0.5435417505805227
Energy: 0.5038118605501943
Energy: 0.536980692389403
Energy: 0.5435417505833093
Energy: 0.5038118605501943
Energy: 0.5432983417043368
Energy: 0.543541750581916
Energy: 0.503811860548801
Energy: 0.536980692389403
Energy: 0.5598452335156585
Energy: 0.49004656322925944
Energy: 0.5573458181763788
Energy: 0.5598365722321634
Energy: 0.49004656331699037
Energy: 0.5573458181763788
Energy: 0.5598452335128719
Energy: 0.49004656313453626
Energy: 0.5573458181763788
Energy: 0.5598365722335569

minimum gb energy = 0.47191528831792173 eV
minimum distance =  2.52929192137414 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

Energy: 0.5693486708337444
Energy: 0.6074191663846744
Energy: 0.607393742533276
Energy: 0.5628298803977165
Energy: 0.6074191663838742
Energy: 0.6073937425321614
Energy: 0.5693486708356308
Energy: 0.6074191663835597
Energy: 0.6073937425310754
Energy: 0.5628298803977165
Energy: 0.5775102812903983
Energy: 0.5195732986118741
Energy: 0.5518405349723321
Energy: 0.5775102812918272
Energy: 0.5195732986137603
Energy: 0.5518405349715604
Energy: 0.5775102812921415
Energy: 0.5195732986156466
Energy: 0.5518405349688738
Energy: 0.5775102812905697
Energy: 0.5888582143115285
Energy: 0.5402126165919928
Energy: 0.5518862815575959
Energy: 0.5888582143107569
Energy: 0.5402126165919928
Energy: 0.5518862815583963
Energy: 0.5888582143093278
Energy: 0.5402126165907352
Energy: 0.5518862815597966
Energy: 0.5888582143108997
Energy: 0.557587487544045
Energy: 0.5574887314780794
Energy: 0.5197261002363237
Energy: 0.5575874875456169
Energy: 0.5574887314788798
Energy: 0.5197261002368095
Energy: 0.557587487544045
Energy: 0.5574887314798228
Energy: 0.5197261002363237
Energy: 0.557587487542616
Energy: 0.534519198052287
Energy: 0.5628327537763693
Energy: 0.5845251431253413
Energy: 0.5345191980514867
Energy: 0.5628327537744829
Energy: 0.5845251431270848
Energy: 0.5345191980510293
Energy: 0.5628327537736827
Energy: 0.5845251431286568
Energy: 0.534519198051801
Energy: 0.5529880478214692
Energy: 0.5967072845605091
Energy: 0.5600359268711337
Energy: 0.5529831785855839
Energy: 0.5967072845600232
Energy: 0.5600359268701905
Energy: 0.5529880478202116
Energy: 0.5967072845589372
Energy: 0.5600359268691044
Energy: 0.5529831785862127
Energy: 0.5708932810648675
Energy: 0.5191002625795705
Energy: 0.5960552562768748
Energy: 0.5708932810653533
Energy: 0.5191002625803421
Energy: 0.5960552562768748
Energy: 0.5708932810670682
Energy: 0.5191002625797134
Energy: 0.59605525627516
Energy: 0.5708932810669254
Energy: 0.5645838327449205
Energy: 0.5667969672130694
Energy: 0.530071942797151
Energy: 0.5629852751231053
Energy: 0.5667969672141842
Energy: 0.5300719427962078
Energy: 0.5645838327436629
Energy: 0.5667969672126122
Energy: 0.5300719427951218
Energy: 0.5629852751259062
Energy: 0.5611304719304175
Energy: 0.5915027106577003
Energy: 0.5895554811998334
Energy: 0.5610325040220416
Energy: 0.5915027106578719
Energy: 0.5895554811999763
Energy: 0.5611304719311891
Energy: 0.591502710659901
Energy: 0.5895554812010908
Energy: 0.561032504022356
Energy: 0.527625315433585
Energy: 0.5431680939636611
Energy: 0.5524479060036465
Energy: 0.5277378156840915
Energy: 0.5431680939669763
Energy: 0.552447906006333
Energy: 0.527625315433585
Energy: 0.543168093966662
Energy: 0.552447906006333
Energy: 0.5277378156837771
Energy: 0.5952281810289264
Energy: 0.5992135769098967
Energy: 0.5693906763610798
Energy: 0.5952632030574898
Energy: 0.5992135769114688
Energy: 0.5692712676365056
Energy: 0.5952281810284691
Energy: 0.5992135769127263
Energy: 0.5693906763617086
Energy: 0.595263203060805
Energy: 0.5692548644900243
Energy: 0.5651425948853059
Energy: 0.5461554332087449
Energy: 0.5692548644883095
Energy: 0.5651425944480258
Energy: 0.5461554332068586
Energy: 0.5692548644883095
Energy: 0.5651425945424554
Energy: 0.5461554332063727
Energy: 0.5692548644892527
Energy: 0.5543577155833975
Energy: 0.545607169623714
Energy: 0.5280582184771906
Energy: 0.5543577155824544
Energy: 0.5456071696238856
Energy: 0.5280582184776479
Energy: 0.5543577155837119
Energy: 0.545607169623714
Energy: 0.5280582184803344
Energy: 0.5543577155849695
Energy: 0.5810269913095374
Energy: 0.5953173545458289
Energy: 0.5496018011335304
Energy: 0.5810269913085941
Energy: 0.595317354544743
Energy: 0.5496018011341591
Energy: 0.5810269913087657
Energy: 0.5953173545450573
Energy: 0.5496018011341591
Energy: 0.5810269913093944
Energy: 0.5235525599663375
Energy: 0.5614409580571668
Energy: 0.5765980313300078
Energy: 0.5235525599635081
Energy: 0.5614409580582813
Energy: 0.5765980313307795
Energy: 0.5235525599638226
Energy: 0.5614409580571668
Energy: 0.5765980313307795
Energy: 0.5240942452719857
Energy: 0.5718090118150349
Energy: 0.5183537117209301
Energy: 0.5717406465056742
Energy: 0.57180901181332
Energy: 0.5183537942782256
Energy: 0.5717406465066175
Energy: 0.5718090118166067
Energy: 0.5183537117204728
Energy: 0.5717406465061317
Energy: 0.5718090118152064
Energy: 0.5593955825188374
Energy: 0.6022458678147607
Energy: 0.5495900817978586
Energy: 0.5593955825177513
Energy: 0.6022458678146178
Energy: 0.549590081799602
Energy: 0.5593955825175799
Energy: 0.6022458678135032
Energy: 0.5495900817981729
Energy: 0.5593955825175799
Energy: 0.5856496460472745
Energy: 0.570575623449866
Energy: 0.5434865360175429
Energy: 0.5856496460461886
Energy: 0.5705756234501804
Energy: 0.5434865360167711
Energy: 0.5856496460453884
Energy: 0.570575623449866
Energy: 0.5434865360151993
Energy: 0.5856496460460171
Energy: 0.5196669393205829
Energy: 0.5572621899292922
Energy: 0.5575446564673628
Energy: 0.5196669393190109
Energy: 0.5572605695677256
Energy: 0.5575134705529439
Energy: 0.519666939317439
Energy: 0.5572621899305499
Energy: 0.5575446564646763
Energy: 0.5196669393193253
Energy: 0.58417146653584
Energy: 0.5370187228176849
Energy: 0.5617423812324618
Energy: 0.5841714665349254
Energy: 0.5370187228150268
Energy: 0.561742381234491
Energy: 0.5841714665386694
Energy: 0.5370187228140838
Energy: 0.5617423812329191
Energy: 0.5841714665378976
Energy: 0.5478143197640969
Energy: 0.5923786176083805
Energy: 0.5776190706233445
Energy: 0.5478143197603244
Energy: 0.5923786176082376
Energy: 0.57761907062303
Energy: 0.5478143197618962
Energy: 0.5923786176076089
Energy: 0.5776190706225441
Energy: 0.5478143197620677
Energy: 0.5913089493840004
Energy: 0.5716622124195377
Energy: 0.5630015780358893
Energy: 0.5913089493844862
Energy: 0.5716622124201665
Energy: 0.5630015780363468
Energy: 0.5913089493833715
Energy: 0.571662212422367
Energy: 0.5630015780388617
Energy: 0.5913089493832288
Energy: 0.5340767062314363
Energy: 0.5574046110914864
Energy: 0.5704922295689245
Energy: 0.5340767062311219
Energy: 0.5574046110940015
Energy: 0.5704922295682958
Energy: 0.5340767062318935
Energy: 0.5574046110927439
Energy: 0.5704922295668667
Energy: 0.534076706233637
Energy: 0.5705926221431785
Energy: 0.5515946057421451
Energy: 0.5680838466087572
Energy: 0.5705926221436645
Energy: 0.55159460573963
Energy: 0.5680838466063851
Energy: 0.5705926221446076
Energy: 0.551594605737115
Energy: 0.5680838466103292
Energy: 0.57059262214335
Energy: 0.557962663753704
Energy: 0.5442388910014544
Energy: 0.5576136346784271
Energy: 0.5579626637549615
Energy: 0.5442388910033408
Energy: 0.5576136346798274
Energy: 0.5579626637565335
Energy: 0.5442388910050555
Energy: 0.5576136346784271
Energy: 0.5579626637559046
Energy: 0.555211583182482
Energy: 0.5480942789550407
Energy: 0.5749583849881713
Energy: 0.5552115831829393
Energy: 0.5480942789544121
Energy: 0.5749583849891144
Energy: 0.5552115831819961
Energy: 0.5480942789545549
Energy: 0.5749583849872282
Energy: 0.5552115831823105
Energy: 0.5971300231368952
Energy: 0.5655847506588642
Energy: 0.5539928742125406
Energy: 0.5971300231364093
Energy: 0.5655847506574351
Energy: 0.5539857945274269
Energy: 0.5971300231359521
Energy: 0.5655847506593213
Energy: 0.5539928742147413
Energy: 0.5971300231364093
Energy: 0.5201720464902554
Energy: 0.5759929173738898
Energy: 0.5590962903000939
Energy: 0.5201720464866256
Energy: 0.5759929173743757
Energy: 0.5590962903029234
Energy: 0.5201720464852253
Energy: 0.5759929173742042
Energy: 0.5590962903044953
Energy: 0.520172046488512
Energy: 0.5518363535148367
Energy: 0.562835601152523
Energy: 0.5630532125700314
Energy: 0.5518363535143793
Energy: 0.562835601152523
Energy: 0.56371005380261
Energy: 0.5518363535145223
Energy: 0.5628356011522087
Energy: 0.5630532125701743
Energy: 0.5518363535146937
Energy: 0.5920135718246348
Energy: 0.580390687960938
Energy: 0.561358368895524
Energy: 0.592013571825435
Energy: 0.5803906879595375
Energy: 0.5613394164268357
Energy: 0.5920135718235487
Energy: 0.5803906879571654
Energy: 0.5613583688983536
Energy: 0.59201357182292
Energy: 0.5729078911024474
Energy: 0.5748705900535116
Energy: 0.5276504199170943
Energy: 0.5729078911024474
Energy: 0.5748705900542834
Energy: 0.5274152531198885
Energy: 0.5729078911038479
Energy: 0.5748705900533402
Energy: 0.5276504199191235
Energy: 0.5729078911033906
Energy: 0.6305342083851633
Energy: 0.5595251029764903
Energy: 0.6099660006632308
Energy: 0.623537490350228
Energy: 0.5595251029782051
Energy: 0.6099660006616587
Energy: 0.6305342083864207
Energy: 0.5595251029790053
Energy: 0.6099660006613445
Energy: 0.6235374903500565
Energy: 0.6087726212857506
Energy: 0.5824480645456737
Energy: 0.5718686350286113
Energy: 0.6026230487486621
Energy: 0.5824480645464454
Energy: 0.5652945328488544
Energy: 0.6087726212844932
Energy: 0.5824480645469312
Energy: 0.571868635028154
Energy: 0.6026230487488051
Energy: 0.5459970592136606
Energy: 0.5214083990566506
Energy: 0.5541799379263865
Energy: 0.5459970592155468
Energy: 0.5214083990567936
Energy: 0.5541799379268724
Energy: 0.5459970592155468
Energy: 0.5214083990589942
Energy: 0.5541799379256149
Energy: 0.5459970592136606
Energy: 0.5952787206660936
Energy: 0.5790014534189184
Energy: 0.5805666047371111
Energy: 0.5952787206643501
Energy: 0.579001453418604
Energy: 0.5805666047381972
Energy: 0.595278720663264
Energy: 0.5790014534182896
Energy: 0.5805666047380543
Energy: 0.5952787206654647
Energy: 0.5561615181108237
Energy: 0.5637607081890271
Energy: 0.5198226798117409
Energy: 0.556161518111138
Energy: 0.5637607081882554
Energy: 0.5198226798125125
Energy: 0.5561615181103378
Energy: 0.5637607081885698
Energy: 0.5198226798111121
Energy: 0.5561615181109666
Energy: 0.5182239565037842
Energy: 0.5858709025231424
Energy: 0.6072881717351605
Energy: 0.5182295621156454
Energy: 0.5858709025225137
Energy: 0.607288171736561
Energy: 0.5182239565044128
Energy: 0.5858709025223708
Energy: 0.6072881717342173
Energy: 0.5182295621140736
Energy: 0.6025676443765072
Energy: 0.5244487181389381
Energy: 0.5591554783193076
Energy: 0.6025676443769932
Energy: 0.52444871814051
Energy: 0.5591554783177356
Energy: 0.6025676443763643
Energy: 0.52444871814051
Energy: 0.5591554783188217
Energy: 0.6025676443768216
Energy: 0.5529897233827786
Energy: 0.5481626181123412
Energy: 0.55206919392159
Energy: 0.5604751470377776
Energy: 0.5481626181131415
Energy: 0.552069193920504
Energy: 0.5600454074041404
Energy: 0.5481626181147133
Energy: 0.5520691939200182
Energy: 0.5600454074041404
Energy: 0.5571226740867411
Energy: 0.5576225312322308
Energy: 0.5197089186679923
Energy: 0.5573536552814086
Energy: 0.5579670972625451
Energy: 0.5197089186681637
Energy: 0.5571226740873698
Energy: 0.5576225312320879
Energy: 0.5197089186686209
Energy: 0.5573536552806369
Energy: 0.569859832838756
Energy: 0.5629917929151438
Energy: 0.5835427901836846
Energy: 0.5698598328395562
Energy: 0.5629917929152867
Energy: 0.5835427901822842
Energy: 0.5698598328403278
Energy: 0.5629917929143436
Energy: 0.5835427901846277
Energy: 0.5698598328393847
Energy: 0.5777488519310743
Energy: 0.5768631383597046
Energy: 0.5477363148217397
Energy: 0.5777488519312457
Energy: 0.5768631383579897
Energy: 0.5477363148217397
Energy: 0.5777488519277875
Energy: 0.5768631383575039
Energy: 0.5477363148206535
Energy: 0.5777488519276159
Energy: 0.572200427904078
Energy: 0.5636731483531101
Energy: 0.5962257440777914
Energy: 0.5722004279009342
Energy: 0.5636731483553108
Energy: 0.5962257440798205
Energy: 0.5722004279007913
Energy: 0.5636731483541961
Energy: 0.5962257440810782
Energy: 0.5722004279045638
Energy: 0.5632611852159274
Energy: 0.5706762207080939
Energy: 0.528322870791773
Energy: 0.5632611852137267
Energy: 0.570676220710609
Energy: 0.5283228707898867
Energy: 0.5632611852137267
Energy: 0.5706762207115521
Energy: 0.5283228707900582
Energy: 0.5632611852162418
Energy: 0.558400708610636
Energy: 0.5679077006408946
Energy: 0.5722275241857466
Energy: 0.5584007086095498
Energy: 0.5679077006427807
Energy: 0.5722275241849464
Energy: 0.5584007086089211
Energy: 0.56790770064058
Energy: 0.5722275241843177
Energy: 0.5584007086093784
Energy: 0.5298328438436468
Energy: 0.5575623430874832
Energy: 0.5581387892623493
Energy: 0.529832843844733
Energy: 0.5575623430877976
Energy: 0.5581387892629781
Energy: 0.5298328438436468
Energy: 0.5575623430889123
Energy: 0.5581387892618634
Energy: 0.5298328438422178
Energy: 0.5482091618238364
Energy: 0.5384196309433968
Energy: 0.5597308654785393
Energy: 0.5482091618260371
Energy: 0.5384098466740898
Energy: 0.5597308654799683
Energy: 0.5482091618260371
Energy: 0.5384196309447973
Energy: 0.559730865480597
Energy: 0.5482091618272946
Energy: 0.5831734098701155
Energy: 0.5387387392737242
Energy: 0.5970256836046717
Energy: 0.583173409872002
Energy: 0.5387330010064246
Energy: 0.5970256836032712
Energy: 0.5831734098718303
Energy: 0.5387387392729525
Energy: 0.5970256836051576
Energy: 0.5831734098702585
Energy: 0.5764215715037555
Energy: 0.5590829920605737
Energy: 0.5206106035926613
Energy: 0.5764215715037555
Energy: 0.5590829920619742
Energy: 0.5206106035966054
Energy: 0.5764215715032696
Energy: 0.5590829920615169
Energy: 0.5206106035976915
Energy: 0.5764215715040698
Energy: 0.5628444144039977
Energy: 0.5824160180558928
Energy: 0.5513885856096005
Energy: 0.5628444144022543
Energy: 0.5823981139220028
Energy: 0.5513885856089717
Energy: 0.5628444144027402
Energy: 0.5824160180566931
Energy: 0.551388585609286
Energy: 0.5628444144044551
Energy: 0.581550900528431
Energy: 0.5770767879523231
Energy: 0.5919232687857539
Energy: 0.5815509005287454
Energy: 0.5770778705201164
Energy: 0.5919232687854395
Energy: 0.5815509005290598
Energy: 0.5770767879523231
Energy: 0.5919232687851251
Energy: 0.5815509005286024
Energy: 0.5743009611524214
Energy: 0.5273100678915701
Energy: 0.5733753131247123
Energy: 0.5743009611505351
Energy: 0.5274246980639321
Energy: 0.5733753131257984
Energy: 0.5743009611507066
Energy: 0.5273100678907985
Energy: 0.5733753131264271
Energy: 0.5743009611521069

minimum gb energy = 0.5182239565037842 eV
minimum distance =  2.51314089314715 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.5168170125740599
Energy: 0.5584127798755696
Energy: 0.5584751058760402
Energy: 0.4961564065557981
Energy: 0.5584127798755696
Energy: 0.5584751058776593
Energy: 0.5168170125740599
Energy: 0.5584127798755696
Energy: 0.5584751058771195
Energy: 0.4961564065557981
Energy: 0.5867503177780493
Energy: 0.4968372746953524
Energy: 0.5908477023747429
Energy: 0.5867503177780493
Energy: 0.4968372746953524
Energy: 0.5908477023742031
Energy: 0.5867503177780493
Energy: 0.4968372746953524
Energy: 0.5908477023774411
Energy: 0.586750317778589
Energy: 0.5282171000664062
Energy: 0.5370884083489067
Energy: 0.5009667326249063
Energy: 0.5282171000669214
Energy: 0.537088408348367
Energy: 0.5008263497227274
Energy: 0.5282171000664062
Energy: 0.537088408348367
Energy: 0.5009667326249063
Energy: 0.5282171000664062
Energy: 0.5785472351987829
Energy: 0.6010972130072171
Energy: 0.5032414555250386
Energy: 0.5785472351993227
Energy: 0.6010972130077566
Energy: 0.5032414555250386
Energy: 0.5785472351993227
Energy: 0.6010972130066774
Energy: 0.5032414555255783
Energy: 0.5785472351987829
Energy: 0.5469802768382134
Energy: 0.5424625877290665
Energy: 0.5262646201024425
Energy: 0.5469802773182774
Energy: 0.5424625877296061
Energy: 0.5262646201019028
Energy: 0.5469802770647665
Energy: 0.5424625877296061
Energy: 0.5262646201024425
Energy: 0.5469802772670356
Energy: 0.49762297980231707
Energy: 0.6071866515166485
Energy: 0.5818877138434911
Energy: 0.49762297980231707
Energy: 0.6071866515166485
Energy: 0.5818877138434911
Energy: 0.49762297980231707
Energy: 0.6071866515166485
Energy: 0.5818877138434911
Energy: 0.49762297980231707
Energy: 0.5464279477974051
Energy: 0.537847098240715
Energy: 0.5580980460718341
Energy: 0.5464279477974051
Energy: 0.537847098240715
Energy: 0.5580980460712945
Energy: 0.5464279477974051
Energy: 0.537847098240715
Energy: 0.5580980460712945
Energy: 0.5464279477974051
Energy: 0.5642645568382573
Energy: 0.49683145787036137
Energy: 0.49725764855070353
Energy: 0.5642645568382573
Energy: 0.49683145787036137
Energy: 0.49725764855070353
Energy: 0.5642645568382573
Energy: 0.4968314578698217
Energy: 0.49725764855070353
Energy: 0.5642645568382573
Energy: 0.549314549210886
Energy: 0.597431861473558
Energy: 0.5379505543598876
Energy: 0.549314549210886
Energy: 0.5974318614730182
Energy: 0.5375307770139772
Energy: 0.549314549210886
Energy: 0.597431861473558
Energy: 0.5379505543593479
Energy: 0.549314549210886
Energy: 0.5343927155959103
Energy: 0.5846392110832054
Energy: 0.6226153841236101
Energy: 0.514099225673875
Energy: 0.584639211083745
Energy: 0.6226153841246892
Energy: 0.5343927155959103
Energy: 0.584639211083745
Energy: 0.6226153841246892
Energy: 0.514099225673875
Energy: 0.5389516299433561
Energy: 0.5240858686380974
Energy: 0.5867543327709157
Energy: 0.5252199706768206
Energy: 0.5240858686132737
Energy: 0.5554927926153886
Energy: 0.5389516299433561
Energy: 0.5240858686213684
Energy: 0.586754332770376
Energy: 0.5252199706768206
Energy: 0.585159970423937
Energy: 0.503285151067487
Energy: 0.5606340687344893
Energy: 0.585159970423937
Energy: 0.503285151067487
Energy: 0.5606340687350291
Energy: 0.585159970423937
Energy: 0.503285151067487
Energy: 0.5606340687350291
Energy: 0.585159970423937
Energy: 0.5488185937286049
Energy: 0.5015635977415582
Energy: 0.6204630260350343
Energy: 0.5488185937291445
Energy: 0.5015635977415582
Energy: 0.6204630260344947
Energy: 0.5488185937286049
Energy: 0.5015635977415582
Energy: 0.6204630260350343
Energy: 0.5488185937286049
Energy: 0.564223808107222
Energy: 0.5571629453614999
Energy: 0.4971309434184965
Energy: 0.564223808107222
Energy: 0.5571629453614999
Energy: 0.4971309434190362
Energy: 0.5642238081077617
Energy: 0.5571629453614999
Energy: 0.4971309434190362
Energy: 0.5642238081077617
Energy: 0.4961564065557981
Energy: 0.5584127798761093
Energy: 0.5584751058781988
Energy: 0.4961564065557981
Energy: 0.5584127798761093
Energy: 0.5584751058776593
Energy: 0.4961564065557981
Energy: 0.5584127798761093
Energy: 0.5584751058760402
Energy: 0.4961564065557981

minimum gb energy = 0.4961564065557981 eV
minimum distance =  2.62021331441239 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.5149474348579202
Energy: 0.4897621751527944
Energy: 0.4901589151898218
Energy: 0.4987625733553819
Energy: 0.489762175155307
Energy: 0.4901589151912684
Energy: 0.5149474348564353
Energy: 0.48976217515340353
Energy: 0.49015891519252475
Energy: 0.4987625733553819
Energy: 0.48182726121921327
Energy: 0.43399410297015056
Energy: 0.4815644868342496
Energy: 0.4818272612133506
Energy: 0.43399410296912266
Energy: 0.481564486832765
Energy: 0.4818272612123227
Energy: 0.43399410297015056
Energy: 0.48156448683089964
Energy: 0.48182726121944164
Energy: 0.4995337261371805
Energy: 0.4361082433425143
Energy: 0.4656368506466372
Energy: 0.4995337261403403
Energy: 0.43610824333958303
Energy: 0.4655743639379623
Energy: 0.499533726140759
Energy: 0.43610824334125814
Energy: 0.46563685064244964
Energy: 0.4952806675868904
Energy: 0.4460940935449439
Energy: 0.4456291715131605
Energy: 0.44889948063007995
Energy: 0.44609409320483756
Energy: 0.44562917151715775
Energy: 0.44895374568207735
Energy: 0.44609409267492045
Energy: 0.4456291715138077
Energy: 0.4488994806321738
Energy: 0.44609409292880103
Energy: 0.4620602542360633
Energy: 0.543273712178122
Energy: 0.44982480572119743
Energy: 0.46206025423750996
Energy: 0.5432737121787691
Energy: 0.44980855951869203
Energy: 0.4620602542433725
Energy: 0.5432737121800253
Energy: 0.4498248057247759
Energy: 0.4620602542416974
Energy: 0.44329807794910897
Energy: 0.5008230987087988
Energy: 0.4987622338214313
Energy: 0.44329807795013687
Energy: 0.5008230987041925
Energy: 0.49876223382268764
Energy: 0.44329807795097437
Energy: 0.50082309870168
Energy: 0.4987622338204035
Energy: 0.4432980779505556
Energy: 0.44252074342311853
Energy: 0.43550843022427405
Energy: 0.4915423105723764
Energy: 0.44252074341976855
Energy: 0.4355084302263678
Energy: 0.49154231057782033
Energy: 0.44252074342041564
Energy: 0.4355084302207336
Energy: 0.4915423105761452
Energy: 0.44252074342395603
Energy: 0.4885665729807206
Energy: 0.44390135982013107
Energy: 0.49043817083462093
Energy: 0.48856657298113926
Energy: 0.4438988618951189
Energy: 0.4904381708377426
Energy: 0.48856657298281436
Energy: 0.4439013598220345
Energy: 0.49043817083964597
Energy: 0.4885665729823956
Energy: 0.49942879024467846
Energy: 0.5685481779618494
Energy: 0.5050673078017055
Energy: 0.4994287902459348
Energy: 0.5685481779580805
Energy: 0.5050673078017055
Energy: 0.4994287902449069
Energy: 0.568548177953893
Energy: 0.5050673078037612
Energy: 0.49942879024384096
Energy: 0.4440539275816634
Energy: 0.49302903847486734
Energy: 0.4624477179549589
Energy: 0.44405392758124457
Energy: 0.4930290384708701
Energy: 0.46244771795621525
Energy: 0.44405392758440426
Energy: 0.4930290384727735
Energy: 0.4624477179564436
Energy: 0.44405392758250084
Energy: 0.44228229365705346
Energy: 0.4486336603635915
Energy: 0.44870921980329453
Energy: 0.44228229365937566
Energy: 0.44862141115773096
Energy: 0.4487064638555557
Energy: 0.44228229366146943
Energy: 0.4486336603650761
Energy: 0.44870921980436057
Energy: 0.4422822936597944
Energy: 0.44391380162447547
Energy: 0.5112154590112771
Energy: 0.4810754766789073
Energy: 0.4439138016198691
Energy: 0.5111425010040521
Energy: 0.4810754766780698
Energy: 0.4439138016194504
Energy: 0.5112154590087645
Energy: 0.48107547667765105
Energy: 0.4439138016236379
Energy: 0.510487557566521
Energy: 0.44543031972784414
Energy: 0.5254091780218781
Energy: 0.5104875575614958
Energy: 0.4454298427863517
Energy: 0.5254091780243906
Energy: 0.510487557559402
Energy: 0.44543031972597885
Energy: 0.5254091780248094
Energy: 0.5104875575654549
Energy: 0.4894463601911637
Energy: 0.49035343548598814
Energy: 0.44005721496920125
Energy: 0.4894463601905546
Energy: 0.49035343548598814
Energy: 0.4400572149687825
Energy: 0.48944636018846077
Energy: 0.4903534354851507
Energy: 0.44005721496668865
Energy: 0.4894463601892983
Energy: 0.43436312225519247
Energy: 0.4926835664463019
Energy: 0.4543137013597541
Energy: 0.43436312225123336
Energy: 0.4926835664458831
Energy: 0.4543137013555664
Energy: 0.43436312225290835
Energy: 0.49268356644649225
Energy: 0.45431370135617555
Energy: 0.4343631222550021
Energy: 0.4365986132135885
Energy: 0.4900576969414656
Energy: 0.5030171069108077
Energy: 0.43659861321945115
Energy: 0.4900576969437878
Energy: 0.5030171069114167
Energy: 0.43659861322280125
Energy: 0.4900576969471379
Energy: 0.5030171069122542
Energy: 0.4365986132165198
Energy: 0.46163826484853165
Energy: 0.4907837862008889
Energy: 0.4596106524878658
Energy: 0.461638264847047
Energy: 0.49078378620317303
Energy: 0.4596106524895408
Energy: 0.4616382648426691
Energy: 0.4907837862025639
Energy: 0.4596106524893124
Energy: 0.4616382648430878
Energy: 0.4655205469413795
Energy: 0.48999182259234847
Energy: 0.4471246623076506
Energy: 0.46552054694198863
Energy: 0.48999182259527974
Energy: 0.4471246623076506
Energy: 0.4655205469417983
Energy: 0.48999182259486107
Energy: 0.447124662306813
Energy: 0.4655205469413795
Energy: 0.485854476821493
Energy: 0.4892462584180925
Energy: 0.43532360459626
Energy: 0.4858544768241958
Energy: 0.48924625841957714
Energy: 0.43532360459961006
Energy: 0.4858544768269368
Energy: 0.4892462584214426
Energy: 0.43532360459709757
Energy: 0.4858544768244243
Energy: 0.4711409126422142
Energy: 0.49834621828004055
Energy: 0.4346514112943032
Energy: 0.4710478076747229
Energy: 0.4983462182804593
Energy: 0.4346514112984527
Energy: 0.4711409126417955
Energy: 0.4983462182804593
Energy: 0.43465141130119367
Energy: 0.47104780767578874
Energy: 0.4398232796072584
Energy: 0.48946133199268677
Energy: 0.45826899343453
Energy: 0.43982464194531845
Energy: 0.48946133199519937
Energy: 0.4582689939663125
Energy: 0.4398232796055833
Energy: 0.4894613319970647
Energy: 0.4582689930080076
Energy: 0.43982464194764076
Energy: 0.5166473144736972
Energy: 0.4401676032007804
Energy: 0.5011818939615759
Energy: 0.5166473144789506
Energy: 0.4401676031992957
Energy: 0.5011818939579974
Energy: 0.5166473144797882
Energy: 0.44016760320222703
Energy: 0.501181893956132
Energy: 0.5166473144760193
Energy: 0.4350353309658213
Energy: 0.5249166171403375
Energy: 0.4424201829795876
Energy: 0.43503533096684927
Energy: 0.5249166171397284
Energy: 0.44242018297897856
Energy: 0.43503533096475544
Energy: 0.524916617138472
Energy: 0.4424201829810342
Energy: 0.43503533096707764
Energy: 0.4487190923741344
Energy: 0.44860004991843244
Energy: 0.44248439048745014
Energy: 0.4487190923764566
Energy: 0.44860004992513247
Energy: 0.44248439048912525
Energy: 0.44871909237622826
Energy: 0.4486000499203358
Energy: 0.4424843904872217
Energy: 0.44871909237455315
Energy: 0.4702062745596944
Energy: 0.5463831182635189
Energy: 0.4428734908668801
Energy: 0.47020627455676306
Energy: 0.5463831182635189
Energy: 0.4428734908658523
Energy: 0.47020627455843805
Energy: 0.5463831182593315
Energy: 0.4428734908672989
Energy: 0.470206274561179
Energy: 0.5186061361687941
Energy: 0.49900361242613284
Energy: 0.49902988922677194
Energy: 0.5026040082193259
Energy: 0.4990036124255237
Energy: 0.49902988922802816
Energy: 0.5186061361744665
Energy: 0.4990036124242675
Energy: 0.49902988922741914
Energy: 0.5026040082170419
Energy: 0.4972747560697612
Energy: 0.435141617447185
Energy: 0.4806860587516426
Energy: 0.49727475607185495
Energy: 0.4351416174446725
Energy: 0.48068605874410497
Energy: 0.4972747560697612
Energy: 0.43514161744364466
Energy: 0.4806860587466175
Energy: 0.49727475606766736
Energy: 0.4787576299993699
Energy: 0.4406333223911581
Energy: 0.4416324369130598
Energy: 0.4787576299926698
Energy: 0.44063332239199554
Energy: 0.44156274898085657
Energy: 0.4787576299909948
Energy: 0.44063332239325187
Energy: 0.4416324369128315
Energy: 0.4787576299968574
Energy: 0.5035416635372784
Energy: 0.524373413844842
Energy: 0.445160771349139
Energy: 0.5035416635362124
Energy: 0.524373413823295
Energy: 0.4455421152477776
Energy: 0.5035416635374687
Energy: 0.5243734138076107
Energy: 0.4451607713476543
Energy: 0.5035416635368596
Energy: 0.45068504613507604
Energy: 0.6168599396668066
Energy: 0.4624378108455921
Energy: 0.4506850461388448
Energy: 0.6168599396641038
Energy: 0.462437810848333
Energy: 0.45068504613736016
Energy: 0.6168599396642943
Energy: 0.4624378108455921
Energy: 0.45068504613401017
Energy: 0.459561509967334
Energy: 0.4492462797932696
Energy: 0.44899337009442103
Energy: 0.45956150996314654
Energy: 0.44924627979304105
Energy: 0.4489933700959057
Energy: 0.4595615099610527
Energy: 0.4492462797932696
Energy: 0.4489933700990273
Energy: 0.45956150996543066
Energy: 0.4414220290438176
Energy: 0.5101254188959115
Energy: 0.4799155166059944
Energy: 0.44142202904358924
Energy: 0.510125418896749
Energy: 0.4799155166064132
Energy: 0.4414220290454926
Energy: 0.5101254188940082
Energy: 0.4799155166120473
Energy: 0.4414220290448455
Energy: 0.479618336103025
Energy: 0.4385084748513643
Energy: 0.47150133075354533
Energy: 0.4796183361036722
Energy: 0.4385084748505267
Energy: 0.47150133075792316
Energy: 0.47961833610260624
Energy: 0.43850847485075517
Energy: 0.47150133076317674
Energy: 0.47961833610218746
Energy: 0.48902228704564554
Energy: 0.45760537324020717
Energy: 0.49923357887989206
Energy: 0.489022287049224
Energy: 0.4576053733017642
Energy: 0.4992335788819859
Energy: 0.48902228704983314
Energy: 0.4576053732437856
Energy: 0.49923357888156716
Energy: 0.4890222870469018
Energy: 0.4340402375535057
Energy: 0.5134908059281894
Energy: 0.4638431523198169
Energy: 0.43404023755331533
Energy: 0.5134809554195648
Energy: 0.46384315232084466
Energy: 0.43404023755415283
Energy: 0.5134908059227455
Energy: 0.46384315232229134
Energy: 0.4340402375543432
Energy: 0.44460171592086745
Energy: 0.4486171730944122
Energy: 0.44915375239826133
Energy: 0.4446017159212862
Energy: 0.44862590871144126
Energy: 0.4489686816012082
Energy: 0.4446017159246362
Energy: 0.44861717308919674
Energy: 0.44915375239491123
Energy: 0.4446017159244459
Energy: 0.4420967821321363
Energy: 0.4496988880570929
Energy: 0.4461600479795338
Energy: 0.4420967821296237
Energy: 0.44968649024157803
Energy: 0.4461600483934935
Energy: 0.4420967821285959
Energy: 0.4496988880600241
Energy: 0.4461600482367263
Energy: 0.44209678213027087
Energy: 0.5443684059433779
Energy: 0.44944457132422744
Energy: 0.47085718654074166
Energy: 0.5443684059435681
Energy: 0.44944345715864126
Energy: 0.4708571865388382
Energy: 0.5443684059431494
Energy: 0.44944457132338994
Energy: 0.47085718653990416
Energy: 0.5443684059433779
Energy: 0.4742911940582244
Energy: 0.4881584456387441
Energy: 0.4412981809362259
Energy: 0.4742911940551027
Energy: 0.4881584456379066
Energy: 0.44129818094125095
Energy: 0.4742911940542653
Energy: 0.4881584456387441
Energy: 0.44129818094186
Energy: 0.4742911940584527

minimum gb energy = 0.43399410296912266 eV
minimum distance =  2.63085489208537 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 0.3222065803450159
Energy: 0.2416713618988718
Energy: 0.24160152318823816
Energy: 0.20320447745322298
Energy: 0.2416713618988718
Energy: 0.24160152318823816
Energy: 0.32220658034526445
Energy: 0.2416713618988718
Energy: 0.2416015231884867
Energy: 0.20320447745322298
Energy: 0.29663248299732237
Energy: 0.23794033927133632
Energy: 0.3070306947515904
Energy: 0.28209430192457136
Energy: 0.23794033927158484
Energy: 0.37721656508563217
Energy: 0.2966324829970738
Energy: 0.23794033927133632
Energy: 0.30703069475134187
Energy: 0.2820943019248199
Energy: 0.2037421943245581
Energy: 0.25230602546056485
Energy: 0.2648807189716092
Energy: 0.26363687738846686
Energy: 0.2523060254603163
Energy: 0.20447915039035308
Energy: 0.20374219432430954
Energy: 0.25230602546081343
Energy: 0.2648807189713607
Energy: 0.26363687738846686
Energy: 0.32571202696590534
Energy: 0.2419602333323224
Energy: 0.3066767941824948
Energy: 0.3257120269664024
Energy: 0.24196023333207387
Energy: 0.27733415120341554
Energy: 0.3257120269664024
Energy: 0.24196023333207387
Energy: 0.30667679418274335
Energy: 0.32571202696615387
Energy: 0.24215470196358757
Energy: 0.25044395261905633
Energy: 0.22433982640567546
Energy: 0.24215470196383612
Energy: 0.25044395261905633
Energy: 0.2237530461701838
Energy: 0.24215470196408467
Energy: 0.25044395261905633
Energy: 0.22433982640592398
Energy: 0.24215470196358757
Energy: 0.3567269036016324
Energy: 0.35451626905059036
Energy: 0.2795903865206266
Energy: 0.3567269036016324
Energy: 0.3364501277763037
Energy: 0.30757122509192897
Energy: 0.35672690360138387
Energy: 0.35451626904959616
Energy: 0.2795903865203781
Energy: 0.35672690360138387
Energy: 0.24210023161329391
Energy: 0.29027269365303615
Energy: 0.3325677942132578
Energy: 0.24210023161354244
Energy: 0.26282698867589177
Energy: 0.3325677942135063
Energy: 0.24210023161354244
Energy: 0.2902726936525391
Energy: 0.3325677942135063
Energy: 0.24210023161329391
Energy: 0.3535887816601961
Energy: 0.20394625533604185
Energy: 0.2540838262467668
Energy: 0.3535887816601961
Energy: 0.20454536769880802
Energy: 0.2540838262462697
Energy: 0.3535887816601961
Energy: 0.2039462553357933
Energy: 0.2540838262465182
Energy: 0.3535887816604446
Energy: 0.26425416561835513
Energy: 0.26858750617160365
Energy: 0.24178255458471656
Energy: 0.2334142169764447
Energy: 0.2825355012190675
Energy: 0.241782554584468
Energy: 0.26425416561835513
Energy: 0.2685875061718522
Energy: 0.241782554584468
Energy: 0.2334142169761962
Energy: 0.20448168284099122
Energy: 0.20512686660998455
Energy: 0.2526117480246801
Energy: 0.18395702255661497
Energy: 0.1844392965283464
Energy: 0.2526117480246801
Energy: 0.20448168284099122
Energy: 0.20512686660998455
Energy: 0.2526117480246801
Energy: 0.18395702255636645
Energy: 0.2786816865006442
Energy: 0.3326121109685777
Energy: 0.25149515085336377
Energy: 0.2786816865003956
Energy: 0.33261211096882626
Energy: 0.25149515085311525
Energy: 0.2786816865003956
Energy: 0.3326121109685777
Energy: 0.25149515085336377
Energy: 0.2786816865006442
Energy: 0.1633258570802692
Energy: 0.2416713618988718
Energy: 0.2416015231884867
Energy: 0.20435151713527286
Energy: 0.2416713618988718
Energy: 0.24160152318823816
Energy: 0.16332585707977212
Energy: 0.2416713618988718
Energy: 0.2416015231884867
Energy: 0.20435151713527286
Energy: 0.26845635937224444
Energy: 0.23794033927133632
Energy: 0.3323499467846299
Energy: 0.26845635937249296
Energy: 0.23794033927158484
Energy: 0.35486336158822185
Energy: 0.2684563593727415
Energy: 0.23794033927133632
Energy: 0.33234994678487845
Energy: 0.26845635937249296
Energy: 0.20442101026789183
Energy: 0.25230602546081343
Energy: 0.18460823934741338
Energy: 0.18399063705650126
Energy: 0.25230602546056485
Energy: 0.20515718505835834
Energy: 0.2044210102683889
Energy: 0.25230602546081343
Energy: 0.18460823934691628
Energy: 0.1839906370567498
Energy: 0.32571202696590534
Energy: 0.24196023333207387
Energy: 0.27733415120366406
Energy: 0.32571202696615387
Energy: 0.24196023333207387
Energy: 0.27733415120341554
Energy: 0.3257120269664024
Energy: 0.24196023333207387
Energy: 0.27733415120341554
Energy: 0.32571202696615387
Energy: 0.24215470196358757
Energy: 0.25044395261905633
Energy: 0.20465711479855844
Energy: 0.24215470196358757
Energy: 0.25044395261905633
Energy: 0.20394467788717457
Energy: 0.24215470196383612
Energy: 0.25044395261930485
Energy: 0.20465711479855844
Energy: 0.24215470196358757
Energy: 0.3567269036016324
Energy: 0.3242331511284147
Energy: 0.2935636650008355
Energy: 0.35672690360138387
Energy: 0.34506255600681346
Energy: 0.2795903865203781
Energy: 0.35672690360138387
Energy: 0.32423315112965745
Energy: 0.29356366500108405
Energy: 0.35672690360138387
Energy: 0.24210023161329391
Energy: 0.2628269886761403
Energy: 0.3325677942135063
Energy: 0.24210023161354244
Energy: 0.2768834011657149
Energy: 0.3325677942135063
Energy: 0.24210023161329391
Energy: 0.26282698867589177
Energy: 0.3325677942135063
Energy: 0.24210023161329391
Energy: 0.3535887816604446
Energy: 0.2237537982832595
Energy: 0.2540838262465182
Energy: 0.3535887816601961
Energy: 0.22431678409203953
Energy: 0.2540838262457726
Energy: 0.3535887816601961
Energy: 0.22375379828375663
Energy: 0.25408382624602116
Energy: 0.3535887816604446
Energy: 0.26425416561860365
Energy: 0.2685875061718522
Energy: 0.241782554584468
Energy: 0.2336288173714318
Energy: 0.2827914193626405
Energy: 0.241782554584468
Energy: 0.26425416561835513
Energy: 0.26858750617160365
Energy: 0.241782554584468
Energy: 0.2336288173714318
Energy: 0.20372448649105018
Energy: 0.2042302351675946
Energy: 0.25261174802492864
Energy: 0.26360518730644267
Energy: 0.2627191174551567
Energy: 0.2526117480246801
Energy: 0.20372448649080166
Energy: 0.2042302351671201
Energy: 0.2526117480246801
Energy: 0.26360518730619414
Energy: 0.2964602527679828
Energy: 0.3326121109685777
Energy: 0.25149515085311525
Energy: 0.28361492139884253
Energy: 0.33261211096882626
Energy: 0.25149515085311525
Energy: 0.29646025276823135
Energy: 0.3326121109685777
Energy: 0.25149515085336377
Energy: 0.28361492139884253
Energy: 0.3222065803450159
Energy: 0.24167136189912033
Energy: 0.2416015231879896
Energy: 0.20320447745322298
Energy: 0.24167136189912033
Energy: 0.24160152318823816
Energy: 0.32220658034526445
Energy: 0.24167136189862326
Energy: 0.2416015231884867
Energy: 0.20320447745322298
Energy: 0.29663248299732237
Energy: 0.23794033927158484
Energy: 0.30703069475134187
Energy: 0.28209430192457136
Energy: 0.2379403392718334
Energy: 0.37721656508563217
Energy: 0.2966324829970738
Energy: 0.2379403392718334
Energy: 0.3070306947510933
Energy: 0.2820943019248199
Energy: 0.2037421943245581
Energy: 0.25230602546006775
Energy: 0.2648807189713607
Energy: 0.2636368773887155
Energy: 0.2523060254603163
Energy: 0.20447915039035308
Energy: 0.20374219432430954
Energy: 0.25230602546056485
Energy: 0.2648807189716092
Energy: 0.26363687738846686
Energy: 0.32571202696590534
Energy: 0.2419602333323224
Energy: 0.3066767941824948
Energy: 0.3257120269664024
Energy: 0.24196023333207387
Energy: 0.27733415120341554
Energy: 0.32571202696615387
Energy: 0.24196023333207387
Energy: 0.30667679418274335
Energy: 0.32571202696590534
Energy: 0.24215470196358757
Energy: 0.25044395261905633
Energy: 0.22433982640592398
Energy: 0.24215470196358757
Energy: 0.25044395261905633
Energy: 0.22375304616993527
Energy: 0.24215470196383612
Energy: 0.25044395261930485
Energy: 0.22433982640617253
Energy: 0.24215470196358757
Energy: 0.35672690360138387
Energy: 0.35451626904959616
Energy: 0.2795903865206266
Energy: 0.3567269036016324
Energy: 0.3364501277770493
Energy: 0.30757122509143187
Energy: 0.35672690360138387
Energy: 0.3545162690500933
Energy: 0.2795903865203781
Energy: 0.35672690360138387
Energy: 0.24210023161329391
Energy: 0.29027269365303615
Energy: 0.3325677942135063
Energy: 0.24210023161354244
Energy: 0.26282698867589177
Energy: 0.3325677942135063
Energy: 0.24210023161329391
Energy: 0.29027269365278763
Energy: 0.3325677942135063
Energy: 0.24210023161329391
Energy: 0.3535887816601961
Energy: 0.20394625533604185
Energy: 0.25408382624701537
Energy: 0.3535887816601961
Energy: 0.20454536769880802
Energy: 0.2540838262467668
Energy: 0.3535887816601961
Energy: 0.2039462553357933
Energy: 0.2540838262462697
Energy: 0.3535887816604446
Energy: 0.26425416561860365
Energy: 0.26858750617160365
Energy: 0.24178255458471656
Energy: 0.2334142169764447
Energy: 0.28253550121881893
Energy: 0.241782554584468
Energy: 0.26425416561835513
Energy: 0.2685875061718522
Energy: 0.241782554584468
Energy: 0.2334142169761962
Energy: 0.20448168284099122
Energy: 0.20512686660998455
Energy: 0.25261174802492864
Energy: 0.18395702255661497
Energy: 0.1844392965283464
Energy: 0.2526117480246801
Energy: 0.20448168284099122
Energy: 0.20512686660998455
Energy: 0.2526117480246801
Energy: 0.18395702255636645
Energy: 0.2786816865006442
Energy: 0.33261211096882626
Energy: 0.25149515085336377
Energy: 0.2786816865003956
Energy: 0.33261211096882626
Energy: 0.25149515085311525
Energy: 0.2786816865003956
Energy: 0.33261211096882626
Energy: 0.25149515085336377
Energy: 0.2786816865006442

minimum gb energy = 0.16332585707977212 eV
minimum distance =  2.64899183911295 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.451097788189945
Energy: 0.462968771938351
Energy: 0.46292593131568854
Energy: 0.44172083116531036
Energy: 0.4629687719397154
Energy: 0.46292593131568854
Energy: 0.451097788189945
Energy: 0.462968771938351
Energy: 0.46292593131568854
Energy: 0.44172083116531036
Energy: 0.47129765834390625
Energy: 0.40864298951013833
Energy: 0.44910342168312506
Energy: 0.47129765834390625
Energy: 0.40864298951013833
Energy: 0.44910342168312506
Energy: 0.47129765834390625
Energy: 0.40864298951013833
Energy: 0.44910342168312506
Energy: 0.47129765834390625
Energy: 0.42692923968887825
Energy: 0.38626815765690525
Energy: 0.42994231928692866
Energy: 0.42692923968887825
Energy: 0.3862681576555408
Energy: 0.4299423192882931
Energy: 0.42692923968887825
Energy: 0.3862681576555408
Energy: 0.42994231928692866
Energy: 0.42692923968887825
Energy: 0.5035099113150937
Energy: 0.4093326074068311
Energy: 0.500951898322977
Energy: 0.5035099113150937
Energy: 0.4093326074068311
Energy: 0.500951898322977
Energy: 0.5035099113150937
Energy: 0.4093326074068311
Energy: 0.500951898322977
Energy: 0.5035099113150937
Energy: 0.47167764166379
Energy: 0.43899770712801456
Energy: 0.4322007995643876
Energy: 0.47167764166242554
Energy: 0.43899770712801456
Energy: 0.4322007995643876
Energy: 0.47167764166379
Energy: 0.43899770712801456
Energy: 0.4322007995643876
Energy: 0.47167764166242554
Energy: 0.4256449300112385
Energy: 0.4649193065216395
Energy: 0.4621673757333166
Energy: 0.4256449300112385
Energy: 0.4649193065216395
Energy: 0.4621673757333166
Energy: 0.4256449300112385
Energy: 0.4649193065216395
Energy: 0.4621673757333166
Energy: 0.4256449300112385
Energy: 0.39933226971067887
Energy: 0.44570863550490614
Energy: 0.48695797244961353
Energy: 0.3993188512586457
Energy: 0.44570863550490614
Energy: 0.48695797244961353
Energy: 0.39933226971067887
Energy: 0.44570863550490614
Energy: 0.48695797244961353
Energy: 0.3993188512572812
Energy: 0.4300982856556211
Energy: 0.3999659732634183
Energy: 0.41387356949302073
Energy: 0.4300982856556211
Energy: 0.3999659732634183
Energy: 0.41387356949302073
Energy: 0.4300982856556211
Energy: 0.3999659732634183
Energy: 0.41387356949302073
Energy: 0.4300982856556211
Energy: 0.4471204446715287
Energy: 0.3857616362849648
Energy: 0.4980932619949559
Energy: 0.4471204446715287
Energy: 0.3857616362849648
Energy: 0.4980932619949559
Energy: 0.4471204446715287
Energy: 0.3857616362849648
Energy: 0.4980932619949559
Energy: 0.44712044467018924
Energy: 0.44893391538394994
Energy: 0.4086038069493485
Energy: 0.47081163364029793
Energy: 0.44893391538394994
Energy: 0.4086038069493485
Energy: 0.4708116336416624
Energy: 0.44893391538394994
Energy: 0.4086038069493485
Energy: 0.4708116336416624
Energy: 0.44893391538394994
Energy: 0.4498142959801867
Energy: 0.4778745412743132
Energy: 0.4169980773305793
Energy: 0.4498142959801867
Energy: 0.4778745412770421
Energy: 0.416999006755357
Energy: 0.4498142959801867
Energy: 0.4778745412743132
Energy: 0.4169980773305793
Energy: 0.4498142959801867
Energy: 0.40883848655551014
Energy: 0.44342489816577524
Energy: 0.46253192152279565
Energy: 0.40883848655551014
Energy: 0.4434518543484106
Energy: 0.4625236700484602
Energy: 0.40883848655551014
Energy: 0.44342489816577524
Energy: 0.46253192152552447
Energy: 0.40883848655551014
Energy: 0.4056871706356773
Energy: 0.42692723636682856
Energy: 0.4265709510644303
Energy: 0.4056871706356773
Energy: 0.43367640957946685
Energy: 0.4266704440105688
Energy: 0.4056871706356773
Energy: 0.4269272363654642
Energy: 0.4265709510644303
Energy: 0.4056871706356773
Energy: 0.4091378098307298
Energy: 0.47371823998541984
Energy: 0.42115576100357544
Energy: 0.4091378098307298
Energy: 0.4739915134309893
Energy: 0.42115576100357544
Energy: 0.4091378098307298
Energy: 0.4737182399867843
Energy: 0.42115576100357544
Energy: 0.4091378098307298
Energy: 0.4628681370920192
Energy: 0.44338077566068507
Energy: 0.46176438567281664
Energy: 0.4628681370920192
Energy: 0.44336989745271865
Energy: 0.46176438567281664
Energy: 0.4628681370920192
Energy: 0.44338077566068507
Energy: 0.46176438567281664
Energy: 0.4628681370920192
Energy: 0.4422737745215255
Energy: 0.45248455930580034
Energy: 0.4085412617603174
Energy: 0.4422737745215255
Energy: 0.45248455930580034
Energy: 0.4085412617603174
Energy: 0.4422737745215255
Energy: 0.45248455930580034
Energy: 0.4085412617603174
Energy: 0.4422737745215255
Energy: 0.44616088830698175
Energy: 0.49998378838723
Energy: 0.3866902462309737
Energy: 0.44616088830698175
Energy: 0.49998378838723
Energy: 0.3866902462309737
Energy: 0.4461608883083462
Energy: 0.49998378838723
Energy: 0.3866902462309737
Energy: 0.44616088830698175
Energy: 0.48397283143187325
Energy: 0.41320368858017986
Energy: 0.4069501960620336
Energy: 0.48397283143323766
Energy: 0.41320368858017986
Energy: 0.4069501960620336
Energy: 0.4839728314223222
Energy: 0.41320368858017986
Energy: 0.4069501960620336
Energy: 0.4839728314250511
Energy: 0.41322354584731613
Energy: 0.47102672122021827
Energy: 0.4394782611570325
Energy: 0.41322354584731613
Energy: 0.47102672122021827
Energy: 0.4394782611570325
Energy: 0.41322354584731613
Energy: 0.47102672122021827
Energy: 0.4394782611570325
Energy: 0.41322354584731613
Energy: 0.44870904209999785
Energy: 0.45401233582321315
Energy: 0.46474482813225165
Energy: 0.44870904209999785
Energy: 0.45401233582321315
Energy: 0.46474482813225165
Energy: 0.44870904209999785
Energy: 0.45401233582321315
Energy: 0.46474482813225165
Energy: 0.44870904209999785
Energy: 0.4862935028329698
Energy: 0.40131017977693856
Energy: 0.44541734343300554
Energy: 0.4862935028329698
Energy: 0.4013121912955571
Energy: 0.44541734343436995
Energy: 0.4862935028329698
Energy: 0.40131017977693856
Energy: 0.44541734343436995
Energy: 0.4862935028329698
Energy: 0.4355929089080019
Energy: 0.5202627484951311
Energy: 0.39950634467036694
Energy: 0.43559290890936636
Energy: 0.5202627484951311
Energy: 0.39950634467036694
Energy: 0.4355929089080019
Energy: 0.5202627484951311
Energy: 0.39950634467036694
Energy: 0.4355929089080019
Energy: 0.4038641187408651
Energy: 0.4045428846095275
Energy: 0.38620895469842026
Energy: 0.4038641187422295
Energy: 0.4045428846095275
Energy: 0.38620895469842026
Energy: 0.4038641187408651
Energy: 0.4045428846095275
Energy: 0.38620895469842026
Energy: 0.4038641187408651
Energy: 0.46995164618272883
Energy: 0.45429328825402027
Energy: 0.4087468155218016
Energy: 0.46995164618272883
Energy: 0.45429328825538473
Energy: 0.40874681552316594
Energy: 0.46995164618272883
Energy: 0.45429328825402027
Energy: 0.4087468155218016
Energy: 0.46995164618272883
Energy: 0.41613880684281374
Energy: 0.44657941369896026
Energy: 0.461948290396242
Energy: 0.4161396294789023
Energy: 0.44657941369896026
Energy: 0.4619482903948776
Energy: 0.41613880684417814
Energy: 0.44657941369896026
Energy: 0.461948290396242
Energy: 0.4161396294789023
Energy: 0.47106144939528277
Energy: 0.40848030424788223
Energy: 0.4520886559739963
Energy: 0.47106144939528277
Energy: 0.40848030424788223
Energy: 0.45208865596853853
Energy: 0.47106144939528277
Energy: 0.40848030424788223
Energy: 0.45208865596853853
Energy: 0.47106144939528277
Energy: 0.4265355017039744
Energy: 0.4073907887712438
Energy: 0.4302887638127408
Energy: 0.42653722417395734
Energy: 0.4073907887712438
Energy: 0.43042337557917104
Energy: 0.4265355017039744
Energy: 0.4073907887712438
Energy: 0.4302887638127408
Energy: 0.42653722417395734
Energy: 0.42148397451355013
Energy: 0.4076404356737277
Energy: 0.4792687727684222
Energy: 0.42148397451355013
Energy: 0.4076404356696344
Energy: 0.4790878950087921
Energy: 0.42148397451355013
Energy: 0.4076404356696344
Energy: 0.4792687727684222
Energy: 0.42148397451355013
Energy: 0.4720384072236376
Energy: 0.45732682495532334
Energy: 0.4551013679517748
Energy: 0.4720384072236376
Energy: 0.45732682495532334
Energy: 0.45487952883408916
Energy: 0.4720384072236376
Energy: 0.45732682495532334
Energy: 0.4551013679517748
Energy: 0.4720384072236376
Energy: 0.41357931100458684
Energy: 0.45501429390649784
Energy: 0.4733961589108666
Energy: 0.41357931100458684
Energy: 0.45501429390649784
Energy: 0.4733961589108666
Energy: 0.41357931100458684
Energy: 0.45501429390649784
Energy: 0.4733961589108666
Energy: 0.41357931100458684
Energy: 0.40845529345889386
Energy: 0.4454737213976063
Energy: 0.4908457868907978
Energy: 0.40845529345889386
Energy: 0.4454737213976063
Energy: 0.4908457868907978
Energy: 0.40845529345889386
Energy: 0.4454737213976063
Energy: 0.4908457868907978
Energy: 0.40845529345889386
Energy: 0.4124160495295282
Energy: 0.41458560911639797
Energy: 0.45913250399975936
Energy: 0.4124160495308926
Energy: 0.41458560911639797
Energy: 0.45913250399975936
Energy: 0.4124160495308926
Energy: 0.41458560911639797
Energy: 0.4591325039983949
Energy: 0.4124160495295282
Energy: 0.4237553353807849
Energy: 0.41369651324514817
Energy: 0.5001967921520764
Energy: 0.4237553353807849
Energy: 0.41369651324514817
Energy: 0.5001967921520764
Energy: 0.4237553353807849
Energy: 0.41369651324514817
Energy: 0.5001967921520764
Energy: 0.4237553353807849
Energy: 0.4485517975825247
Energy: 0.44863782414834763
Energy: 0.46854173388357806
Energy: 0.4485517975811604
Energy: 0.44863782414834763
Energy: 0.46854173388357806
Energy: 0.4485517975811604
Energy: 0.44863782414834763
Energy: 0.46854173388357806
Energy: 0.4485517975811604
Energy: 0.4458991605310403
Energy: 0.47618232042039205
Energy: 0.4237421658448048
Energy: 0.4458991605310403
Energy: 0.47618232042039205
Energy: 0.42374003241680064
Energy: 0.4458991605310403
Energy: 0.47618232042039205
Energy: 0.4237421658448048
Energy: 0.4458991605310403
Energy: 0.3996122973427167
Energy: 0.4363257001128496
Energy: 0.5166801046103291
Energy: 0.3996122973427167
Energy: 0.4363257001128496
Energy: 0.5166801046103291
Energy: 0.3996122973427167
Energy: 0.4363257001128496
Energy: 0.5166801046103291
Energy: 0.3996122973427167
Energy: 0.40634660155445146
Energy: 0.4039055745146714
Energy: 0.404464784736459
Energy: 0.40634660155581587
Energy: 0.4039055745146714
Energy: 0.4044647847378235
Energy: 0.40634660155581587
Energy: 0.4039055745146714
Energy: 0.4044647847378235
Energy: 0.40634660155445146
Energy: 0.4120758815465851
Energy: 0.45754969633466874
Energy: 0.4192538202048122
Energy: 0.4120758815465851
Energy: 0.45771554839619155
Energy: 0.4192538202048122
Energy: 0.4120758815465851
Energy: 0.4575496963360332
Energy: 0.4192538202048122
Energy: 0.4120758815465851
Energy: 0.4621784338309444
Energy: 0.41671620913508284
Energy: 0.4467470817287277
Energy: 0.4621784338309444
Energy: 0.4168078650917316
Energy: 0.4467470817287277
Energy: 0.4621784338309444
Energy: 0.41671620913508284
Energy: 0.44674708173009203
Energy: 0.46217843383230883
Energy: 0.4518056817414181
Energy: 0.4500673516227587
Energy: 0.40837559091810394
Energy: 0.4518056817400537
Energy: 0.4500673516227587
Energy: 0.40837559091810394
Energy: 0.4518056817400537
Energy: 0.4500673516227587
Energy: 0.40837559091810394
Energy: 0.4518056817400537
Energy: 0.4442006215367675
Energy: 0.45391162818759395
Energy: 0.38636173613454056
Energy: 0.4441782311873755
Energy: 0.4538166904886929
Energy: 0.38636173613454056
Energy: 0.4442006215367675
Energy: 0.45391162818759395
Energy: 0.3863617361331762
Energy: 0.4441782311873755
Energy: 0.4710199327439482
Energy: 0.3983819369177733
Energy: 0.40690661317335974
Energy: 0.469760112071193
Energy: 0.39838193691913765
Energy: 0.40690661317063087
Energy: 0.47101993274121945
Energy: 0.3983819369177733
Energy: 0.40690661317335974
Energy: 0.469760112071193
Energy: 0.4576813359209961
Energy: 0.47604573506189296
Energy: 0.4640106575554633
Energy: 0.4511809599227984
Energy: 0.47604573506189296
Energy: 0.4640106575554633
Energy: 0.4576813359209961
Energy: 0.47604573506189296
Energy: 0.4640106575554633
Energy: 0.4511809599173407
Energy: 0.4617273210053667
Energy: 0.43040475333839767
Energy: 0.454551020217416
Energy: 0.4617273210053667
Energy: 0.43040475333839767
Energy: 0.454551020217416
Energy: 0.4617273210053667
Energy: 0.43040475333839767
Energy: 0.454551020217416
Energy: 0.4617273210053667
Energy: 0.48079887052519904
Energy: 0.4368256930697714
Energy: 0.44537999796469224
Energy: 0.48079887052519904
Energy: 0.4368256930697714
Energy: 0.44537999796469224
Energy: 0.48079887052519904
Energy: 0.4368256930697714
Energy: 0.44537999796605665
Energy: 0.48079887052519904
Energy: 0.41421304984613777
Energy: 0.4304591298411364
Energy: 0.4068273066753029
Energy: 0.41421304984613777
Energy: 0.43045912984386525
Energy: 0.4068273066753029
Energy: 0.41421304984750223
Energy: 0.4304591298411364
Energy: 0.4068273066753029
Energy: 0.41421304984613777
Energy: 0.4394181896438309
Energy: 0.4020486612195028
Energy: 0.4130134838127196
Energy: 0.4394181896438309
Energy: 0.4020486612195028
Energy: 0.413013483814084
Energy: 0.4394181896438309
Energy: 0.40204866121813837
Energy: 0.413013483814084
Energy: 0.4394181896424665
Energy: 0.44157695270261327
Energy: 0.45453532714211775
Energy: 0.4144784028548082
Energy: 0.44157695270261327
Energy: 0.45453532714211775
Energy: 0.41447840285617255
Energy: 0.4415769527039777
Energy: 0.4545353271407533
Energy: 0.41447840285617255
Energy: 0.44157695270261327
Energy: 0.4233116710461374
Energy: 0.446784511331254
Energy: 0.46535052783810843
Energy: 0.42330832753498826
Energy: 0.446784511331254
Energy: 0.46535052783810843
Energy: 0.4233116710461374
Energy: 0.446784511331254
Energy: 0.4653505278394729
Energy: 0.42330832753498826
Energy: 0.472789589538011
Energy: 0.39955958175513034
Energy: 0.4444207473036162
Energy: 0.472789589538011
Energy: 0.39955958175513034
Energy: 0.444420747306345
Energy: 0.4727895895366466
Energy: 0.39955958175513034
Energy: 0.4444207473036162
Energy: 0.472789589538011
Energy: 0.385916942734011
Energy: 0.4066838307882476
Energy: 0.3858680152283425
Energy: 0.385916942734011
Energy: 0.4066838307882476
Energy: 0.3858680152283425
Energy: 0.3859169427326466
Energy: 0.4066838307882476
Energy: 0.3858680152283425
Energy: 0.3859169427326466
Energy: 0.419362872718213
Energy: 0.41034082971631297
Energy: 0.42019354245136614
Energy: 0.419362872718213
Energy: 0.4103408297149487
Energy: 0.42258940911369236
Energy: 0.4193628727195775
Energy: 0.4103408297149487
Energy: 0.42019354245136614
Energy: 0.4193628727195775
Energy: 0.45425823126318127
Energy: 0.446824417989771
Energy: 0.43202564397970317
Energy: 0.45425823126318127
Energy: 0.446824417989771
Energy: 0.43205404773067646
Energy: 0.45425823126318127
Energy: 0.446824417989771
Energy: 0.43202564397970317
Energy: 0.45425823126318127
Energy: 0.41348973289609325
Energy: 0.4606371736449634
Energy: 0.46174985955799763
Energy: 0.41348973289609325
Energy: 0.4606371736449634
Energy: 0.4617498595566333
Energy: 0.41348973289609325
Energy: 0.4606371736449634
Energy: 0.4617498595566333
Energy: 0.41348973289609325
Energy: 0.43717581702033914
Energy: 0.4434964005047266
Energy: 0.45365010292845154
Energy: 0.43717581702033914
Energy: 0.443502108051311
Energy: 0.4538181773651266
Energy: 0.43717581702033914
Energy: 0.4434964005047266
Energy: 0.453650102927087
Energy: 0.43717581702033914
Energy: 0.4122909207653272
Energy: 0.4361279969331933
Energy: 0.4142765991518674
Energy: 0.4122909207653272
Energy: 0.4359882188887195
Energy: 0.4142765991518674
Energy: 0.4122909207653272
Energy: 0.43612799693182885
Energy: 0.4142765991518674
Energy: 0.4122909207653272
Energy: 0.449904890348024
Energy: 0.4538256742685128
Energy: 0.4870032222707186
Energy: 0.449904890348024
Energy: 0.453691088481522
Energy: 0.4870032222693542
Energy: 0.449904890348024
Energy: 0.45382567426714837
Energy: 0.4870032222707186
Energy: 0.449904890348024
Energy: 0.4601907644396467
Energy: 0.4459986577357091
Energy: 0.43117381989876497
Energy: 0.4601907644410112
Energy: 0.4459986577357091
Energy: 0.43117381989876497
Energy: 0.4601907644382823
Energy: 0.4459986577357091
Energy: 0.43117381989876497
Energy: 0.4601907644396467
Energy: 0.4458423077951855
Energy: 0.46619419931892053
Energy: 0.4493939205815392
Energy: 0.4458423077951855
Energy: 0.46619419931892053
Energy: 0.44939392058017485
Energy: 0.4458423077951855
Energy: 0.46619419931892053
Energy: 0.44939392058017485
Energy: 0.4458423077951855
Energy: 0.41333035919550215
Energy: 0.4146279943876935
Energy: 0.45219511569516724
Energy: 0.41333035919550215
Energy: 0.41462799438360026
Energy: 0.45219511569516724
Energy: 0.41333035919550215
Energy: 0.4146279943822358
Energy: 0.45219511569516724
Energy: 0.41333035919550215

minimum gb energy = 0.3857616362849648 eV
minimum distance =  2.51497099633846 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 0.48115264252459594
Energy: 0.5761439256962816
Energy: 0.5760874114301849
Energy: 0.48115264252459594
Energy: 0.5761439256962816
Energy: 0.576087411431088
Energy: 0.48115264252459594
Energy: 0.5761439256962816
Energy: 0.5760874114301849
Energy: 0.48115264252459594
Energy: 0.5233507960564747
Energy: 0.5098423016300367
Energy: 0.5785069211057731
Energy: 0.5233507960564747
Energy: 0.5098423016300367
Energy: 0.5785069211057731
Energy: 0.5233507960564747
Energy: 0.5098423016309397
Energy: 0.5785069211057731
Energy: 0.5233507960564747
Energy: 0.4895638270309249
Energy: 0.5084932791692415
Energy: 0.5043175642146687
Energy: 0.4895638270309249
Energy: 0.5084932791692415
Energy: 0.5043175642137656
Energy: 0.4895638270309249
Energy: 0.5084932791692415
Energy: 0.5043175642137656
Energy: 0.4895638270309249
Energy: 0.5779955558772281
Energy: 0.5279521922375922
Energy: 0.5839120365201893
Energy: 0.5779955558772281
Energy: 0.5279521922375922
Energy: 0.5839120365201893
Energy: 0.5779955558772281
Energy: 0.5279521922375922
Energy: 0.5839120365201893
Energy: 0.5779955558772281
Energy: 0.580888146046518
Energy: 0.5546256158859454
Energy: 0.5282870468285751
Energy: 0.580888146046518
Energy: 0.5546256158859454
Energy: 0.5282870468285751
Energy: 0.580888146046518
Energy: 0.5546256158859454
Energy: 0.5282870468285751
Energy: 0.580888146046518
Energy: 0.5163639152970123
Energy: 0.5790607985591323
Energy: 0.5231247157158408
Energy: 0.5163639152970123
Energy: 0.5790607985591323
Energy: 0.5231247157158408
Energy: 0.5163639152970123
Energy: 0.5790607985582292
Energy: 0.5231247157158408
Energy: 0.5163639152970123
Energy: 0.4815434931181578
Energy: 0.5051919226399891
Energy: 0.48935618551450455
Energy: 0.4815434931145458
Energy: 0.5051919226417951
Energy: 0.48935618551450455
Energy: 0.4815434931091278
Energy: 0.5051919226408922
Energy: 0.48935618551450455
Energy: 0.48154349312538175
Energy: 0.48119113575806677
Energy: 0.5842829592335631
Energy: 0.5763572585653517
Energy: 0.48119113575716366
Energy: 0.5842829592326602
Energy: 0.5763572585644487
Energy: 0.48119113575806677
Energy: 0.5842829592326602
Energy: 0.5763572585653517
Energy: 0.48119113575716366
Energy: 0.535696292692983
Energy: 0.5430211433456985
Energy: 0.5620582842133479
Energy: 0.535696292692983
Energy: 0.5430211433456985
Energy: 0.5620582842133479
Energy: 0.535696292692983
Energy: 0.5430211433456985
Energy: 0.5620582842133479
Energy: 0.535696292693886

minimum gb energy = 0.48115264252459594 eV
minimum distance =  2.59728455015629 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 0.566072352874337
Energy: 0.634549596181795
Energy: 0.6346906687904242
Energy: 0.566072352874337
Energy: 0.634549596181795
Energy: 0.6346906687904242
Energy: 0.566072352874337
Energy: 0.6345495961801294
Energy: 0.6346906687904242
Energy: 0.566072352874337
Energy: 0.5946626947937509
Energy: 0.5798138135618846
Energy: 0.6217110672941254
Energy: 0.5946626947937509
Energy: 0.5798138135618846
Energy: 0.6217110672941254
Energy: 0.5946626947937509
Energy: 0.5798138135618846
Energy: 0.6217110672941254
Energy: 0.5946626947937509
Energy: 0.5661808502816248
Energy: 0.6006406226162757
Energy: 0.5865393367339775
Energy: 0.5661808502816248
Energy: 0.6006406226162757
Energy: 0.5865393367339775
Energy: 0.5661808502816248
Energy: 0.6006406226162757
Energy: 0.5865393367339775
Energy: 0.5661808502816248
Energy: 0.6073224466041367
Energy: 0.5653331306483943
Energy: 0.6426612676458245
Energy: 0.6073224466024714
Energy: 0.5653331306483943
Energy: 0.6426612676458245
Energy: 0.6073224466041367
Energy: 0.5653331306483943
Energy: 0.6426612676458245
Energy: 0.6073224466024714
Energy: 0.596750935496732
Energy: 0.5658171035776048
Energy: 0.5918490340764696
Energy: 0.596750935496732
Energy: 0.5658171035759395
Energy: 0.5918490340748043
Energy: 0.596750935496732
Energy: 0.5658171035776048
Energy: 0.5918490340781348
Energy: 0.5967509354950666
Energy: 0.5639195490421279
Energy: 0.5916198218893991
Energy: 0.5823712401391793
Energy: 0.5639195490404626
Energy: 0.5916198218893991
Energy: 0.5823712401391793
Energy: 0.5639195490437934
Energy: 0.5916198218893991
Energy: 0.5823712401391793
Energy: 0.5639195490404626
Energy: 0.5899201070315383
Energy: 0.5811229230814043
Energy: 0.5982684843855242
Energy: 0.5899201070315383
Energy: 0.5811229230814043
Energy: 0.5982684843871895
Energy: 0.5899201070315383
Energy: 0.5811229230814043
Energy: 0.5982684843838587
Energy: 0.5899201070315383
Energy: 0.6024321316050589
Energy: 0.5639424214935351
Energy: 0.5642528039732372
Energy: 0.6024321316050589
Energy: 0.5639424214935351
Energy: 0.5642528039732372
Energy: 0.6024321316050589
Energy: 0.5639424214935351
Energy: 0.5642528039732372
Energy: 0.6024321316050589
Energy: 0.5804281344734382
Energy: 0.5934626721240297
Energy: 0.5882617359300311
Energy: 0.5804281344734382
Energy: 0.5934626721240297
Energy: 0.5882617359300311
Energy: 0.5804281344734382
Energy: 0.5934626721240297
Energy: 0.5882617359300311
Energy: 0.5804281344751037
Energy: 0.6432189230345907
Energy: 0.5572943028199561
Energy: 0.60575696938922
Energy: 0.6432189230345907
Energy: 0.5572943028199561
Energy: 0.6057569693908853
Energy: 0.6432189230345907
Energy: 0.5572943028199561
Energy: 0.6057569693908853
Energy: 0.6432189230345907
Energy: 0.6009091768918673
Energy: 0.5842455987499844
Energy: 0.5783495459849423
Energy: 0.6136017285297922
Energy: 0.5842455987499844
Energy: 0.5783495459849423
Energy: 0.6009091768935326
Energy: 0.5842455987499844
Energy: 0.5783495459849423
Energy: 0.6009091768951981
Energy: 0.6134238550622132
Energy: 0.5677816629738611
Energy: 0.567160165424776
Energy: 0.6134238550622132
Energy: 0.5677816629705607
Energy: 0.567160165424776
Energy: 0.6134238550622132
Energy: 0.5677816629721958
Energy: 0.567160165424776
Energy: 0.6134238550622132
Energy: 0.5631670131976811
Energy: 0.6140469424328486
Energy: 0.5673243432686932
Energy: 0.5631670131976811
Energy: 0.6140469424345141
Energy: 0.5673243432670276
Energy: 0.5631670131976811
Energy: 0.6140469424345141
Energy: 0.5673243432686932
Energy: 0.5631670131993464
Energy: 0.5830587628280842
Energy: 0.6071069131187085
Energy: 0.5787382384577436
Energy: 0.5830587628280842
Energy: 0.6071069131187085
Energy: 0.5787382384577436
Energy: 0.5830587628280842
Energy: 0.6071069131187085
Energy: 0.5787382384577436
Energy: 0.5830587628280842
Energy: 0.5581392953603335
Energy: 0.6407200028789322
Energy: 0.6292226733749613
Energy: 0.5581392953603335
Energy: 0.6407200028789322
Energy: 0.6292226733749613
Energy: 0.5581392953603335
Energy: 0.6407200028789322
Energy: 0.6292226733749613
Energy: 0.5581392953603335
Energy: 0.5918511066264958
Energy: 0.5795410317416543
Energy: 0.5877083304436134
Energy: 0.5918511066264958
Energy: 0.5795410317416543
Energy: 0.5877083304419478
Energy: 0.5918511066264958
Energy: 0.5795410317416543
Energy: 0.5877083304419478
Energy: 0.5918511066264958
Energy: 0.5644878063478962
Energy: 0.5871626130684751
Energy: 0.563908424648221
Energy: 0.5644878063495615
Energy: 0.5871626130684751
Energy: 0.563908424648221
Energy: 0.5644878063495615
Energy: 0.5871626130684751
Energy: 0.5639084246498863
Energy: 0.5644878063495615
Energy: 0.585057092168483
Energy: 0.5760005435339396
Energy: 0.6113008159431843
Energy: 0.585057092168483
Energy: 0.5760005435339396
Energy: 0.6113008159431843
Energy: 0.585057092168483
Energy: 0.5760005435339396
Energy: 0.6113008159431843
Energy: 0.585057092168483
Energy: 0.600293800631121
Energy: 0.5658857312197163
Energy: 0.5819334378872408
Energy: 0.600293800631121
Energy: 0.5658857312197163
Energy: 0.5819334378872408
Energy: 0.600293800631121
Energy: 0.565885731223047
Energy: 0.5819334378872408
Energy: 0.600293800631121
Energy: 0.566342521659635
Energy: 0.6087441019832651
Energy: 0.5945430757940335
Energy: 0.5663425216613005
Energy: 0.6087441019815998
Energy: 0.5945430757940335
Energy: 0.5663425216613005
Energy: 0.6087441019815998
Energy: 0.5945430757940335
Energy: 0.5663425216613005
Energy: 0.5662944729527954
Energy: 0.6074686070685679
Energy: 0.6422414893087599
Energy: 0.5662944729527954
Energy: 0.6074686070669025
Energy: 0.6422414893070946
Energy: 0.5662944729527954
Energy: 0.6074686070635718
Energy: 0.6422414893087599
Energy: 0.5662944729527954
Energy: 0.5590751938778054
Energy: 0.5625776451495929
Energy: 0.5872275439508138
Energy: 0.5590751938778054
Energy: 0.5625776451495929
Energy: 0.5872275439508138
Energy: 0.5590751938778054
Energy: 0.5625776451495929
Energy: 0.5872275439508138
Energy: 0.5590751938778054
Energy: 0.5800539847040524
Energy: 0.5843718497841673
Energy: 0.601218851091397
Energy: 0.5800539847040524
Energy: 0.5843718497858328
Energy: 0.601218851091397
Energy: 0.5800539847040524
Energy: 0.5843718497858328
Energy: 0.6012188510930623
Energy: 0.5800539847040524
Energy: 0.6360373063807191
Energy: 0.5664453881130469
Energy: 0.6329090192875162
Energy: 0.6360373063807191
Energy: 0.5664453881130469
Energy: 0.6329090192875162
Energy: 0.6360373063807191
Energy: 0.5664453881130469
Energy: 0.6329090192875162
Energy: 0.6360373063807191
Energy: 0.6245304957226193
Energy: 0.5970691439316069
Energy: 0.5799531055275936
Energy: 0.6245304957226193
Energy: 0.5970691439332723
Energy: 0.5799531055275936
Energy: 0.6245304957226193
Energy: 0.5970691439316069
Energy: 0.5799531055275936
Energy: 0.6245304957226193
Energy: 0.5788576865153165
Energy: 0.5663867310567987
Energy: 0.6034232595570226
Energy: 0.5788576865153165
Energy: 0.5663867310567987
Energy: 0.6034232595570226
Energy: 0.5788576865153165
Energy: 0.5663867310567987
Energy: 0.6034232595570226
Energy: 0.5788576865169821
Energy: 0.6178644378449156
Energy: 0.5839072970380557
Energy: 0.5635055019405675
Energy: 0.6178644378432504
Energy: 0.5839072970397211
Energy: 0.5635055019422328
Energy: 0.6178644378449156
Energy: 0.5839072970380557
Energy: 0.5635055019422328
Energy: 0.6178644378449156
Energy: 0.5973401176088367
Energy: 0.5984095251760676
Energy: 0.5629759484437784
Energy: 0.5973401176105021
Energy: 0.5984095251760676
Energy: 0.5629759484437784
Energy: 0.5973401176105021
Energy: 0.5984095251760676
Energy: 0.5629759484454439
Energy: 0.5973401176088367
Energy: 0.5829379806781286
Energy: 0.5629705298765929
Energy: 0.5640831135779866
Energy: 0.5829379806781286
Energy: 0.5629705298799238
Energy: 0.5640831135763211
Energy: 0.5829379806781286
Energy: 0.5629705298799238
Energy: 0.5640831135763211
Energy: 0.5829379806781286
Energy: 0.5798406124791048
Energy: 0.5911382717342584
Energy: 0.5805104210611135
Energy: 0.5798406124774396
Energy: 0.5911382717342584
Energy: 0.5805104210594483
Energy: 0.5798406124791048
Energy: 0.5911382717342584
Energy: 0.5805104210594483
Energy: 0.5798406124791048
Energy: 0.569510623164066
Energy: 0.6014385932004997
Energy: 0.5689947435147206
Energy: 0.569510623164066
Energy: 0.6014385932004997
Energy: 0.5689947435147206
Energy: 0.569510623164066
Energy: 0.6014385932004997
Energy: 0.5689947435147206
Energy: 0.569510623164066
Energy: 0.5891290115563967
Energy: 0.5796162517578861
Energy: 0.5943478390497406
Energy: 0.5891290115563967
Energy: 0.5796162517578861
Energy: 0.5943478390497406
Energy: 0.5891290115563967
Energy: 0.5796162517578861
Energy: 0.5943478390497406
Energy: 0.5891290115563967
Energy: 0.5893867552221158
Energy: 0.6453029114913024
Energy: 0.55699521863445
Energy: 0.5893867552221158
Energy: 0.6453029114913024
Energy: 0.55699521863445
Energy: 0.5893867552221158
Energy: 0.6453029114913024
Energy: 0.55699521863445
Energy: 0.5893867552221158
Energy: 0.5776553519996768
Energy: 0.6029751570829179
Energy: 0.5951942546209611
Energy: 0.5776553519996768
Energy: 0.6029751570829179
Energy: 0.5951942546209611
Energy: 0.5776553519996768
Energy: 0.6029751570829179
Energy: 0.5951942546209611
Energy: 0.5776553519996768
Energy: 0.5672627991907784
Energy: 0.6148980525943303
Energy: 0.5674015999349201
Energy: 0.5672627991907784
Energy: 0.6148980525943303
Energy: 0.5674015999349201
Energy: 0.5672627991907784
Energy: 0.6148980525943303
Energy: 0.5674015999349201
Energy: 0.5672627991907784
Energy: 0.5762042611579987
Energy: 0.5627966714210142
Energy: 0.6148814674428725
Energy: 0.5762042611579987
Energy: 0.5627966714210142
Energy: 0.6148814674428725
Energy: 0.5762042611579987
Energy: 0.5627966714193489
Energy: 0.6148814674428725
Energy: 0.5762042611579987
Energy: 0.5832314848059911
Energy: 0.5753674071845202
Energy: 0.589676105535732
Energy: 0.5832314848059911
Energy: 0.5753674071861855
Energy: 0.5896761055373976
Energy: 0.5832314848059911
Energy: 0.5753674071845202
Energy: 0.589676105535732
Energy: 0.5832314848059911
Energy: 0.594418609932341
Energy: 0.5595208528559609
Energy: 0.6381169453709312
Energy: 0.5944186099340064
Energy: 0.5595208528559609
Energy: 0.6381169453709312
Energy: 0.5944186099340064
Energy: 0.5595208528559609
Energy: 0.6381169453725967
Energy: 0.5944186099340064
Energy: 0.5846036074698524
Energy: 0.578789794499637
Energy: 0.5923629443738664
Energy: 0.5846036074698524
Energy: 0.578789794499637
Energy: 0.5923629443738664
Energy: 0.5846036074698524
Energy: 0.5787897945013023
Energy: 0.5923629443738664
Energy: 0.5846036074698524
Energy: 0.5638925280383591
Energy: 0.564573399174567
Energy: 0.5872355223426042
Energy: 0.5638925280400243
Energy: 0.564573399174567
Energy: 0.5872355223426042
Energy: 0.5638925280400243
Energy: 0.564573399174567
Energy: 0.5872355223426042
Energy: 0.5638925280383591
Energy: 0.6098523636332746
Energy: 0.5814666183725327
Energy: 0.5771146969878342
Energy: 0.6098523636332746
Energy: 0.5814666183725327
Energy: 0.5771146969878342
Energy: 0.6098523636332746
Energy: 0.5814666183658712
Energy: 0.5771146969878342
Energy: 0.6098523636332746
Energy: 0.5811202879432328
Energy: 0.6000281845534546
Energy: 0.5652376693718777
Energy: 0.5811202879432328
Energy: 0.6000281845567853
Energy: 0.5652376693702124
Energy: 0.5811202879415676
Energy: 0.6000281845534546
Energy: 0.5652376693752085
Energy: 0.5811202879432328
Energy: 0.5808820121930707
Energy: 0.5663998555718514
Energy: 0.5635296220377338
Energy: 0.5808820121930707
Energy: 0.5663998555718514
Energy: 0.563529622039399
Energy: 0.5808820121930707
Energy: 0.5663998555718514
Energy: 0.563529622039399
Energy: 0.5808820121930707
Energy: 0.5659310940535736
Energy: 0.5589878333924201
Energy: 0.6171276448001053
Energy: 0.5659310940469119
Energy: 0.5589878333924201
Energy: 0.6171276448001053
Energy: 0.5659310940552388
Energy: 0.5589878333924201
Energy: 0.6171276448017706
Energy: 0.5659310940502427
Energy: 0.5877265736071319
Energy: 0.566284039968789
Energy: 0.5619020358045091
Energy: 0.5877265736054663
Energy: 0.566284039968789
Energy: 0.5619020358061746
Energy: 0.5877265736071319
Energy: 0.566284039968789
Energy: 0.5619020358061746
Energy: 0.5877265736071319
Energy: 0.577225944989894
Energy: 0.5807607870149536
Energy: 0.6031629663046272
Energy: 0.577225944989894
Energy: 0.5807607870149536
Energy: 0.6031629663046272
Energy: 0.577225944989894
Energy: 0.5807607870149536
Energy: 0.6031629663046272
Energy: 0.577225944989894
Energy: 0.6479128494700114
Energy: 0.5924787118497751
Energy: 0.5670444058253127
Energy: 0.6479128494683762
Energy: 0.5924787118497751
Energy: 0.5670444058253127
Energy: 0.6479128494700114
Energy: 0.5924787118497751
Energy: 0.5670444058253127
Energy: 0.6479128494700114
Energy: 0.579649836770332
Energy: 0.6252396520180568
Energy: 0.5959789924766471
Energy: 0.579649836770332
Energy: 0.6252396520180568
Energy: 0.5959789924766471
Energy: 0.579649836770332
Energy: 0.6252396520180568
Energy: 0.5959789924766471
Energy: 0.579649836770332
Energy: 0.5879112173536098
Energy: 0.5790637863876157
Energy: 0.5665019011559473
Energy: 0.5879112173536098
Energy: 0.5790637863876157
Energy: 0.5665019011559473
Energy: 0.5879112173536098
Energy: 0.5790637863876157
Energy: 0.5665019011559473
Energy: 0.5879112173536098

minimum gb energy = 0.55699521863445 eV
minimum distance =  2.5170210748963 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

Energy: 0.5752366745849191
Energy: 0.5984803168166732
Energy: 0.5984627245364186
Energy: 0.5752366745849191
Energy: 0.5984803168164692
Energy: 0.5984627245358066
Energy: 0.5752366745847152
Energy: 0.5984803168156534
Energy: 0.5984627245364186
Energy: 0.5752366745849191
Energy: 0.5869110185344861
Energy: 0.5691430106758876
Energy: 0.5945331222787649
Energy: 0.5869110185348939
Energy: 0.5691430106756837
Energy: 0.5945331222787649
Energy: 0.5869110185348939
Energy: 0.5691430106756837
Energy: 0.5945331222787649
Energy: 0.5869110185348939
Energy: 0.5575953795199406
Energy: 0.5511500641390832
Energy: 0.5593191979791209
Energy: 0.5575953795195328
Energy: 0.5511500641388792
Energy: 0.5593191979785089
Energy: 0.5575953795195328
Energy: 0.5511500641386753
Energy: 0.5593191979789168
Energy: 0.5575953795197366
Energy: 0.5878214841376632
Energy: 0.5525625419802777
Energy: 0.5807456574465367
Energy: 0.5878214841376632
Energy: 0.5525625419802777
Energy: 0.5807456575321658
Energy: 0.5878214841376632
Energy: 0.5525625419802777
Energy: 0.5807456574887393
Energy: 0.5878214841376632
Energy: 0.6346868896633849
Energy: 0.5678436292685104
Energy: 0.5725718277201506
Energy: 0.6346868896633849
Energy: 0.5678436292687145
Energy: 0.5725718277199466
Energy: 0.6346868896635889
Energy: 0.5678436292685104
Energy: 0.5725718277201506
Energy: 0.6346868896623651
Energy: 0.6014822232213285
Energy: 0.6008510576874043
Energy: 0.5906112325232342
Energy: 0.6014822232215326
Energy: 0.6008510576886282
Energy: 0.5906112325232342
Energy: 0.6014822232217364
Energy: 0.6008510576874043
Energy: 0.5906112325236422
Energy: 0.6014822232217364
Energy: 0.5687321060784252
Energy: 0.5553471972774492
Energy: 0.5636034842917987
Energy: 0.5687321060782212
Energy: 0.555347197290911
Energy: 0.5636034842917987
Energy: 0.5687321060784252
Energy: 0.5553471972807127
Energy: 0.5636034842917987
Energy: 0.5687321060782212
Energy: 0.6043952776217419
Energy: 0.5621505583343425
Energy: 0.5621372208027522
Energy: 0.6043952776217419
Energy: 0.5621505583341386
Energy: 0.5621372208027522
Energy: 0.604395277621538
Energy: 0.5621505583345466
Energy: 0.5621372208029563
Energy: 0.6043952776217419
Energy: 0.5687331967592973
Energy: 0.5634686989973928
Energy: 0.5560706593128901
Energy: 0.5687331967592973
Energy: 0.563468698997189
Energy: 0.5560706593106465
Energy: 0.5687331967592973
Energy: 0.563468698997189
Energy: 0.5560706593147259
Energy: 0.5687331967592973
Energy: 0.6015531786109607
Energy: 0.5905907477791125
Energy: 0.6008480020316861
Energy: 0.6015531786109607
Energy: 0.5905907477791125
Energy: 0.6008480020316861
Energy: 0.6015531786109607
Energy: 0.5905907477793164
Energy: 0.6008480020318899
Energy: 0.6015531786109607
Energy: 0.63471691039521
Energy: 0.5725863662431928
Energy: 0.5676925780990416
Energy: 0.63471691039521
Energy: 0.5725863662429889
Energy: 0.5676925780990416
Energy: 0.634716910395414
Energy: 0.5725863662429889
Energy: 0.5676925780990416
Energy: 0.634716910395006
Energy: 0.5878164693434649
Energy: 0.5808294631681793
Energy: 0.5524897639531415
Energy: 0.5878164693436688
Energy: 0.5808294631675673
Energy: 0.5524897639531415
Energy: 0.5878164693436688
Energy: 0.5808294631655277
Energy: 0.5524897639533454
Energy: 0.5878164693436688
Energy: 0.5577508541792356
Energy: 0.5593110186716478
Energy: 0.5512046030897109
Energy: 0.5577508541798475
Energy: 0.559311018671444
Energy: 0.5512046030893029
Energy: 0.5577508541792356
Energy: 0.559311018671444
Energy: 0.5512046030895069
Energy: 0.5577508541790317
Energy: 0.5894115594047212
Energy: 0.5947699391507584
Energy: 0.5692351484292144
Energy: 0.5894115594028855
Energy: 0.5947699391511663
Energy: 0.5692351484294185
Energy: 0.589411559405129
Energy: 0.5947699391548377
Energy: 0.5692351484294185
Energy: 0.5894115593992141
Energy: 0.5752366745851232
Energy: 0.598480316817693
Energy: 0.5984627245366225
Energy: 0.5752366745851232
Energy: 0.5984803168170811
Energy: 0.5984627245364186
Energy: 0.5752366745849191
Energy: 0.5984803168154494
Energy: 0.5984627245364186
Energy: 0.5752366745851232
Energy: 0.5869110185348939
Energy: 0.5691430106758876
Energy: 0.5945331222787649
Energy: 0.5869110185348939
Energy: 0.5691430106758876
Energy: 0.5945331222787649
Energy: 0.586911018535098
Energy: 0.5691430106758876
Energy: 0.5945331222789689
Energy: 0.58691101853469
Energy: 0.5575953795197366
Energy: 0.5511500641386753
Energy: 0.559319197978713
Energy: 0.5575953795195328
Energy: 0.5511500641388792
Energy: 0.559319197978101
Energy: 0.5575953795197366
Energy: 0.5511500641386753
Energy: 0.5593191979785089
Energy: 0.5575953795195328
Energy: 0.5878214841376632
Energy: 0.5525625419800736
Energy: 0.5807456575409363
Energy: 0.5878214841376632
Energy: 0.5525625419802777
Energy: 0.5807456574339093
Energy: 0.5878214841374592
Energy: 0.5525625419802777
Energy: 0.5807456573107689
Energy: 0.5878214841376632
Energy: 0.634686889662773
Energy: 0.5678436292683066
Energy: 0.5725718277197427
Energy: 0.6346868896633849
Energy: 0.5678436292683066
Energy: 0.5725718277197427
Energy: 0.6346868896631809
Energy: 0.5678436292685104
Energy: 0.5725718277201506
Energy: 0.634686889662773
Energy: 0.6014822232211245
Energy: 0.6008510576855687
Energy: 0.5906112325230304
Energy: 0.6014822232217364
Energy: 0.6008510576876084
Energy: 0.5906112325234384
Energy: 0.6014822232207166
Energy: 0.6008510576859766
Energy: 0.5906112325232342
Energy: 0.6014822232213285
Energy: 0.5687321060782212
Energy: 0.5553471972958062
Energy: 0.5636034842917987
Energy: 0.5687321060784252
Energy: 0.5553471972937665
Energy: 0.5636034842915948
Energy: 0.5687321060784252
Energy: 0.5553471972898912
Energy: 0.5636034842915948
Energy: 0.5687321060782212
Energy: 0.6043952776217419
Energy: 0.5621505583341386
Energy: 0.5621372208031602
Energy: 0.6043952776217419
Energy: 0.5621505583341386
Energy: 0.5621372208027522
Energy: 0.6043952776217419
Energy: 0.5621505583341386
Energy: 0.5621372208029563
Energy: 0.6043952776217419
Energy: 0.5687331967590933
Energy: 0.563468698997189
Energy: 0.5560706593120743
Energy: 0.5687331967592973
Energy: 0.563468698997189
Energy: 0.5560706593132981
Energy: 0.5687331967592973
Energy: 0.563468698997189
Energy: 0.5560706593114624
Energy: 0.5687331967592973
Energy: 0.6015531786109607
Energy: 0.5905907477791125
Energy: 0.6008480020316861
Energy: 0.6015531786109607
Energy: 0.5905907477791125
Energy: 0.6008480020318899
Energy: 0.6015531786109607
Energy: 0.5905907477793164
Energy: 0.6008480020318899
Energy: 0.6015531786109607
Energy: 0.634716910395006
Energy: 0.5725863662431928
Energy: 0.5676925780990416
Energy: 0.63471691039521
Energy: 0.5725863662429889
Energy: 0.5676925780990416
Energy: 0.63471691039521
Energy: 0.5725863662429889
Energy: 0.5676925780990416
Energy: 0.63471691039521
Energy: 0.5878164693436688
Energy: 0.5808294631667515
Energy: 0.5524897639535494
Energy: 0.5878164693436688
Energy: 0.5808294631665476
Energy: 0.5524897639531415
Energy: 0.5878164693436688
Energy: 0.5808294631704229
Energy: 0.5524897639533454
Energy: 0.5878164693434649
Energy: 0.5577508541788277
Energy: 0.5593110186718518
Energy: 0.5512046030893029
Energy: 0.5577508541792356
Energy: 0.5593110186716478
Energy: 0.5512046030899148
Energy: 0.5577508541794396
Energy: 0.5593110186718518
Energy: 0.5512046030893029
Energy: 0.5577508541790317
Energy: 0.589411559400438
Energy: 0.5947699391501464
Energy: 0.5692351484294185
Energy: 0.5894115593990101
Energy: 0.5947699391495346
Energy: 0.5692351484292144
Energy: 0.5894115594118601
Energy: 0.5947699391505543
Energy: 0.5692351484292144
Energy: 0.5894115594008458
Energy: 0.5752366745851232
Energy: 0.5984803168166732
Energy: 0.5984627245364186
Energy: 0.5752366745849191
Energy: 0.5984803168164692
Energy: 0.5984627245380503
Energy: 0.5752366745849191
Energy: 0.5984803168158574
Energy: 0.5984627245370304
Energy: 0.5752366745849191
Energy: 0.5869110185340781
Energy: 0.5691430106756837
Energy: 0.5945331222789689
Energy: 0.5869110185342821
Energy: 0.5691430106756837
Energy: 0.5945331222789689
Energy: 0.5869110185340781
Energy: 0.5691430106756837
Energy: 0.5945331222787649
Energy: 0.58691101853469
Energy: 0.5575953795199406
Energy: 0.5511500641386753
Energy: 0.559319197978713
Energy: 0.5575953795199406
Energy: 0.5511500641386753
Energy: 0.559319197978713
Energy: 0.5575953795195328
Energy: 0.5511500641388792
Energy: 0.5593191979791209
Energy: 0.5575953795193287
Energy: 0.5878214841374592
Energy: 0.5525625419802777
Energy: 0.5807456573972137
Energy: 0.5878214841376632
Energy: 0.5525625419800736
Energy: 0.580745657304242
Energy: 0.5878214841376632
Energy: 0.5525625419800736
Energy: 0.5807456572587758
Energy: 0.5878214841376632
Energy: 0.6346868896635889
Energy: 0.5678436292685104
Energy: 0.5725718277191493
Energy: 0.6346868896633849
Energy: 0.5678436292685104
Energy: 0.5725718277191493
Energy: 0.6346868896631809
Energy: 0.5678436292685104
Energy: 0.5725718277189453
Energy: 0.6346868896631809
Energy: 0.6014822232211245
Energy: 0.6008510576878123
Energy: 0.5906112325234384
Energy: 0.6014822232211245
Energy: 0.6008510576878123
Energy: 0.5906112325232342
Energy: 0.6014822232211245
Energy: 0.6008510576863845
Energy: 0.5906112325232342
Energy: 0.6014822232209205
Energy: 0.5687321060780172
Energy: 0.5553471972821404
Energy: 0.5636034842915948
Energy: 0.5687321060782212
Energy: 0.555347197284588
Energy: 0.5636034842913907
Energy: 0.5687321060782212
Energy: 0.5553471972902991
Energy: 0.5636034842913907
Energy: 0.5687321060782212
Energy: 0.6043952776217419
Energy: 0.5621505583343425
Energy: 0.5621372208027522
Energy: 0.6043952776217419
Energy: 0.5621505583345466
Energy: 0.5621372208027522
Energy: 0.6043952776217419
Energy: 0.5621505583341386
Energy: 0.5621372208037722
Energy: 0.6043952776217419
Energy: 0.5687331967592973
Energy: 0.5634686989969848
Energy: 0.5560706593122782
Energy: 0.5687331967590933
Energy: 0.563468698997189
Energy: 0.5560706593128901
Energy: 0.5687331967592973
Energy: 0.563468698997189
Energy: 0.5560706593120743
Energy: 0.5687331967592973
Energy: 0.6015531786109607
Energy: 0.5905907477793164
Energy: 0.6008480020316861
Energy: 0.6015531786109607
Energy: 0.5905907477795205
Energy: 0.6008480020318899
Energy: 0.6015531786109607
Energy: 0.5905907477791125
Energy: 0.6008480020318899
Energy: 0.6015531786109607
Energy: 0.6347169103945981
Energy: 0.5725863662431928
Energy: 0.5676925780992454
Energy: 0.6347169103948022
Energy: 0.5725863662431928
Energy: 0.5676925780992454
Energy: 0.6347169103945981
Energy: 0.5725863662429889
Energy: 0.5676925780992454
Energy: 0.634716910395006
Energy: 0.5878164693434649
Energy: 0.5808294631675673
Energy: 0.5524897639529374
Energy: 0.5878164693436688
Energy: 0.5808294631689952
Energy: 0.5524897639531415
Energy: 0.5878164693436688
Energy: 0.5808294631667515
Energy: 0.5524897639527335
Energy: 0.5878164693436688

minimum gb energy = 0.5511500641386753 eV
minimum distance =  2.52895234763822 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.5454751361328258
Energy: 0.5458930039760264
Energy: 0.5458728551296707
Energy: 0.5454751361317199
Energy: 0.5458930039760264
Energy: 0.545872855129302
Energy: 0.5454751361313512
Energy: 0.5458930039771323
Energy: 0.5458728551278273
Energy: 0.5454751361313512
Energy: 0.5838140091752475
Energy: 0.5457508832814305
Energy: 0.5839648738030117
Energy: 0.5838140091752475
Energy: 0.5457508832810619
Energy: 0.5839648738030117
Energy: 0.5838140091752475
Energy: 0.5457508832814305
Energy: 0.5839648738030117
Energy: 0.583814009174879
Energy: 0.5454733196012561
Energy: 0.5453993862303527
Energy: 0.6191535358026149
Energy: 0.5454733196019934
Energy: 0.5453993862321959
Energy: 0.6191535358022463
Energy: 0.5454733196030993
Energy: 0.5453993862325647
Energy: 0.6191535358026149
Energy: 0.5454733196001501
Energy: 0.616874429259805
Energy: 0.5454144022277008
Energy: 0.5454863917021636
Energy: 0.6168744292590675
Energy: 0.5454144022269636
Energy: 0.5454863917010577
Energy: 0.6168744292594363
Energy: 0.5454144022277008
Energy: 0.545486391701795
Energy: 0.6168744292594363
Energy: 0.583949780960758
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.5839497809611266
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.583949780960758
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.583949780960758
Energy: 0.545893003976395
Energy: 0.5458728551256156
Energy: 0.5454751361295082
Energy: 0.545893003977501
Energy: 0.5458728551289334
Energy: 0.5454751361317199
Energy: 0.545893003976395
Energy: 0.545872855129302
Energy: 0.5454751361317199
Energy: 0.5458930039778696
Energy: 0.5457508832810619
Energy: 0.5839648738030117
Energy: 0.583814009174879
Energy: 0.5457508832810619
Energy: 0.5839648738030117
Energy: 0.5838140091752475
Energy: 0.5457508832810619
Energy: 0.5839648738030117
Energy: 0.5838140091752475
Energy: 0.5457508832810619
Energy: 0.5453993862321959
Energy: 0.6191535358033522
Energy: 0.5454733196027307
Energy: 0.5453993862318273
Energy: 0.6191535358033522
Energy: 0.5454733196016247
Energy: 0.5453993862314586
Energy: 0.6191535358029836
Energy: 0.5454733196016247
Energy: 0.5453993862314586
Energy: 0.5454144022265949
Energy: 0.545486391700689
Energy: 0.6168744292586988
Energy: 0.5454144022273321
Energy: 0.5454863916992144
Energy: 0.6168744292601736
Energy: 0.545414402225489
Energy: 0.545486391701795
Energy: 0.6168744292601736
Energy: 0.5454144022273321
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.583949780960758
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.583949780960758
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.5839497809611266
Energy: 0.5457234510025339
Energy: 0.5458728551274586
Energy: 0.5454751361291394
Energy: 0.545893003977501
Energy: 0.5458728551289334
Energy: 0.5454751361328258
Energy: 0.545893003976395
Energy: 0.5458728551289334
Energy: 0.5454751361313512
Energy: 0.5458930039756577
Energy: 0.5458728551285646
Energy: 0.5839648738030117
Energy: 0.5838140091756162
Energy: 0.5457508832810619
Energy: 0.5839648738030117
Energy: 0.5838140091752475
Energy: 0.5457508832814305
Energy: 0.5839648738026428
Energy: 0.5838140091752475
Energy: 0.5457508832814305
Energy: 0.5839648738030117
Energy: 0.6191535358040895
Energy: 0.545473319602362
Energy: 0.545399386233302
Energy: 0.619153535801509
Energy: 0.5454733196016247
Energy: 0.5453993862314586
Energy: 0.6191535358022463
Energy: 0.5454733196005187
Energy: 0.54539938623109
Energy: 0.6191535358022463
Energy: 0.545486391700689
Energy: 0.6168744292590675
Energy: 0.5454144022280694
Energy: 0.5454863917003204
Energy: 0.6168744292590675
Energy: 0.5454144022277008
Energy: 0.5454863917029008
Energy: 0.6168744292623854
Energy: 0.5454144022269636
Energy: 0.5454863917014263
Energy: 0.5839394638665006
Energy: 0.5839497809611266
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.583949780960758
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.5839497809611266
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.5454751361320885
Energy: 0.5458930039738146
Energy: 0.5458728551285646
Energy: 0.5454751361313512
Energy: 0.5458930039756577
Energy: 0.5458728551263529
Energy: 0.5454751361309826
Energy: 0.5458930039756577
Energy: 0.5458728551281959
Energy: 0.5454751361320885
Energy: 0.5838140091756162
Energy: 0.5457508832810619
Energy: 0.5839648738030117
Energy: 0.5838140091763535
Energy: 0.5457508832810619
Energy: 0.5839648738030117
Energy: 0.5838140091756162
Energy: 0.5457508832810619
Energy: 0.5839648738026428
Energy: 0.5838140091752475
Energy: 0.5454733196001501
Energy: 0.54539938623109
Energy: 0.6191535358018776
Energy: 0.5454733196019934
Energy: 0.5453993862307213
Energy: 0.6191535358029836
Energy: 0.5454733196012561
Energy: 0.5453993862318273
Energy: 0.6191535358026149
Energy: 0.5454733196027307
Energy: 0.6168744292583302
Energy: 0.5454144022288067
Energy: 0.5454863917014263
Energy: 0.6168744292590675
Energy: 0.5454144022273321
Energy: 0.5454863917025322
Energy: 0.6168744292590675
Energy: 0.5454144022269636
Energy: 0.545486391700689
Energy: 0.6168744292594363
Energy: 0.583949780960758
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.5839497809611266
Energy: 0.5457234510025339
Energy: 0.5839394638661319
Energy: 0.5839497809611266
Energy: 0.5457234510025339
Energy: 0.5839394638665006
Energy: 0.583949780960758
Energy: 0.545893003976395
Energy: 0.5458728551296707
Energy: 0.5454751361298767
Energy: 0.5458930039756577
Energy: 0.5458728551285646
Energy: 0.5454751361309826
Energy: 0.5458930039749204
Energy: 0.5458728551281959
Energy: 0.5454751361309826
Energy: 0.5458930039760264
Energy: 0.5457508832814305
Energy: 0.5839648738030117
Energy: 0.5838140091756162
Energy: 0.5457508832814305
Energy: 0.5839648738030117
Energy: 0.5838140091759848
Energy: 0.5457508832810619
Energy: 0.5839648738026428
Energy: 0.5838140091752475
Energy: 0.5457508832810619

minimum gb energy = 0.5453993862303527 eV
minimum distance =  2.58308736044805 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 0.5631777011951766
Energy: 0.5700541727808225
Energy: 0.5669355384714337
Energy: 0.555706196638051
Energy: 0.5700541727808225
Energy: 0.5669355384714337
Energy: 0.5631777011951766
Energy: 0.5700541727824936
Energy: 0.5669355384714337
Energy: 0.555706196638051
Energy: 0.5609980054008102
Energy: 0.5639992167395153
Energy: 0.5917153862117609
Energy: 0.5609980054008102
Energy: 0.5639992167395153
Energy: 0.5917153862117609
Energy: 0.5609980054008102
Energy: 0.5639992167378441
Energy: 0.5917153862117609
Energy: 0.5609980054008102
Energy: 0.5829746444818396
Energy: 0.5583862091408618
Energy: 0.6045414400126831
Energy: 0.5829746444818396
Energy: 0.5583862091408618
Energy: 0.6045414400126831
Energy: 0.5829746444818396
Energy: 0.5583862091408618
Energy: 0.6045414400126831
Energy: 0.5829746444818396
Energy: 0.5478418485288132
Energy: 0.5584149821674819
Energy: 0.5457616407895756
Energy: 0.5478418485288132
Energy: 0.5584149821674819
Energy: 0.5457616407895756
Energy: 0.5478418485288132
Energy: 0.5584149821674819
Energy: 0.5457616407895756
Energy: 0.5478418485288132
Energy: 0.6042547854829996
Energy: 0.5636144486299103
Energy: 0.5978187664431378
Energy: 0.6042547854829996
Energy: 0.5636144486299103
Energy: 0.5978187664431378
Energy: 0.6042547854829996
Energy: 0.5636144486299103
Energy: 0.5978187664431378
Energy: 0.6042547854846707
Energy: 0.5730489293163169
Energy: 0.6265688684117154
Energy: 0.5421141709071067
Energy: 0.5730489293163169
Energy: 0.6265688684117154
Energy: 0.5421141709071067
Energy: 0.5730489293163169
Energy: 0.6265688684150577
Energy: 0.5421141709071067
Energy: 0.5730489293163169
Energy: 0.5601626884877656
Energy: 0.6061187924440581
Energy: 0.5620724727988121
Energy: 0.5603655841226108
Energy: 0.6061187924440581
Energy: 0.562072472797141
Energy: 0.5601626884877656
Energy: 0.6061187924440581
Energy: 0.5620724727988121
Energy: 0.5603655841226108
Energy: 0.5653754928414394
Energy: 0.6087113521756605
Energy: 0.5952938538189685
Energy: 0.5653754928414394
Energy: 0.6087113521756605
Energy: 0.5952938538189685
Energy: 0.5653754928414394
Energy: 0.6087113521756605
Energy: 0.5952938538189685
Energy: 0.5653754928414394
Energy: 0.6452575520056266
Energy: 0.5566068842240344
Energy: 0.5571617957211847
Energy: 0.6452575520039556
Energy: 0.5566068842240344
Energy: 0.5571617957211847
Energy: 0.6452575520056266
Energy: 0.5566068842240344
Energy: 0.5571617957211847
Energy: 0.6452575520039556
Energy: 0.5632610407563903
Energy: 0.6049250117443489
Energy: 0.5712079619386895
Energy: 0.5632640327489271
Energy: 0.6049250117393357
Energy: 0.5712079619370184
Energy: 0.5632610407563903
Energy: 0.6049250117393357
Energy: 0.5712079619386895
Energy: 0.5632640327489271
Energy: 0.5653187855814481
Energy: 0.5482469471521707
Energy: 0.5865265025419373
Energy: 0.5653187855814481
Energy: 0.5482469471521707
Energy: 0.5865265025419373
Energy: 0.5653187855814481
Energy: 0.5482469471521707
Energy: 0.5865265025419373
Energy: 0.5653187855814481
Energy: 0.5843592394197443
Energy: 0.5418013066694286
Energy: 0.6139370758188564
Energy: 0.5843592394197443
Energy: 0.5418073545548423
Energy: 0.6139370758188564
Energy: 0.5843592394197443
Energy: 0.5418013066710996
Energy: 0.6139370758205276
Energy: 0.5843592394197443
Energy: 0.6294737729224292
Energy: 0.5464649313364687
Energy: 0.6140767430443717
Energy: 0.6294737729224292
Energy: 0.5464649313364687
Energy: 0.6140767430443717
Energy: 0.6294737729224292
Energy: 0.5464649313364687
Energy: 0.6140767430443717
Energy: 0.6294737729224292
Energy: 0.5470362980842637
Energy: 0.5426928188781914
Energy: 0.6273565147376242
Energy: 0.5470362980842637
Energy: 0.5426928188781914
Energy: 0.6273565147376242
Energy: 0.5470362980859349
Energy: 0.5426928188781914
Energy: 0.6273565147376242
Energy: 0.5470362980842637
Energy: 0.5886151009976164
Energy: 0.6465244530164191
Energy: 0.5481116527694366
Energy: 0.5886151009976164
Energy: 0.6465244530164191
Energy: 0.5481095920337499
Energy: 0.5886151009976164
Energy: 0.6465244530164191
Energy: 0.5481116527694366
Energy: 0.5886151009976164
Energy: 0.5532540589820675
Energy: 0.6350042441406464
Energy: 0.6173190800982405
Energy: 0.5532540589820675
Energy: 0.6350042441406464
Energy: 0.6173190800982405
Energy: 0.5532540589820675
Energy: 0.6350042441406464
Energy: 0.6173190800982405
Energy: 0.5532540589820675
Energy: 0.5599450893628939
Energy: 0.5895342664830509
Energy: 0.6247966600287492
Energy: 0.5599450893628939
Energy: 0.5895342664830509
Energy: 0.6247966600304203
Energy: 0.5599450893628939
Energy: 0.5895342664830509
Energy: 0.6247966600287492
Energy: 0.5599450893628939
Energy: 0.591787073094262
Energy: 0.584011968927984
Energy: 0.5936287812263992
Energy: 0.5917870730959331
Energy: 0.584011968927984
Energy: 0.5936287812263992
Energy: 0.5917870730959331
Energy: 0.584011968927984
Energy: 0.5936287812263992
Energy: 0.5917870730959331
Energy: 0.554302657912296
Energy: 0.609929023380513
Energy: 0.5987045934445283
Energy: 0.554302657912296
Energy: 0.6099290233821841
Energy: 0.5987045934445283
Energy: 0.554302657912296
Energy: 0.609929023380513
Energy: 0.5987045934445283
Energy: 0.554302657912296
Energy: 0.6029704728095968
Energy: 0.5477905002444003
Energy: 0.5703149939888522
Energy: 0.6029704728095968
Energy: 0.5477905002444003
Energy: 0.5703149939888522
Energy: 0.6029704728095968
Energy: 0.5477905002444003
Energy: 0.5703149939888522
Energy: 0.6029704728095968
Energy: 0.5771629549195593
Energy: 0.5650140568101132
Energy: 0.6289097931162033
Energy: 0.5771629549195593
Energy: 0.5650140568101132
Energy: 0.6289097931162033
Energy: 0.5771629549195593
Energy: 0.5650140568117843
Energy: 0.6289097931162033
Energy: 0.5771629549195593
Energy: 0.5805213262524155
Energy: 0.6966369008727302
Energy: 0.541442264546355
Energy: 0.5805213262524155
Energy: 0.6966369008727302
Energy: 0.541442264546355
Energy: 0.5805213262524155
Energy: 0.6966369008727302
Energy: 0.541442264546355
Energy: 0.5805213262524155
Energy: 0.5594111477778143
Energy: 0.5586034270596117
Energy: 0.5768784417202037
Energy: 0.5594105912722931
Energy: 0.5587076756187099
Energy: 0.5768784417202037
Energy: 0.5594111477794854
Energy: 0.5586034270579407
Energy: 0.5768784417202037
Energy: 0.5594105912722931
Energy: 0.5480133509499342
Energy: 0.5649158762938089
Energy: 0.5517958037789064
Energy: 0.5480133509499342
Energy: 0.5649158762938089
Energy: 0.5517958037789064
Energy: 0.5480133509499342
Energy: 0.5649158762921379
Energy: 0.5517958037789064
Energy: 0.5480133509499342
Energy: 0.6053823298244274
Energy: 0.5651409884241031
Energy: 0.5653307922272731
Energy: 0.6053823298244274
Energy: 0.565140988422432
Energy: 0.5653307922272731
Energy: 0.6053823298244274
Energy: 0.5651409884241031
Energy: 0.5653307922272731
Energy: 0.6053823298244274
Energy: 0.5634523721827669
Energy: 0.6232460015405517
Energy: 0.5783504100767723
Energy: 0.5634614453204344
Energy: 0.6232460015388804
Energy: 0.5783504100767723
Energy: 0.5634523721827669
Energy: 0.6232460015405517
Energy: 0.5783504100767723
Energy: 0.5634614453204344
Energy: 0.5837454818571203
Energy: 0.5590591191883445
Energy: 0.5882372573710819
Energy: 0.5837454818571203
Energy: 0.5590591191883445
Energy: 0.5882372573694109
Energy: 0.5837454818571203
Energy: 0.5590591191883445
Energy: 0.5882372573694109
Energy: 0.5837454818571203
Energy: 0.5944606079844527
Energy: 0.6189207266472568
Energy: 0.6133334352836113
Energy: 0.5944606079844527
Energy: 0.6189207266472568
Energy: 0.6133334352836113
Energy: 0.5944606079844527
Energy: 0.6189207266472568
Energy: 0.6133334352836113
Energy: 0.5944606079844527
Energy: 0.6497364744835863
Energy: 0.5414596291951312
Energy: 0.5890632054146139
Energy: 0.6695065633095627
Energy: 0.5414623890662157
Energy: 0.5890632054146139
Energy: 0.6497364744819151
Energy: 0.5414596291968022
Energy: 0.5890632054146139
Energy: 0.6695065633095627
Energy: 0.6199612862535737
Energy: 0.5424644657665136
Energy: 0.615538682518644
Energy: 0.6199612862535737
Energy: 0.5424644657665136
Energy: 0.615538682518644
Energy: 0.6199612862535737
Energy: 0.5424644657665136
Energy: 0.615538682518644
Energy: 0.6199612862535737
Energy: 0.6475581284615962
Energy: 0.6018557290535338
Energy: 0.5489887818005564
Energy: 0.6475581284615962
Energy: 0.6018557290535338
Energy: 0.5487806623634516
Energy: 0.6475581284615962
Energy: 0.6018557290535338
Energy: 0.5489887818005564
Energy: 0.6475581284615962
Energy: 0.5496294254876447
Energy: 0.6007868522015632
Energy: 0.620941986689071
Energy: 0.5496294254876447
Energy: 0.6007868522015632
Energy: 0.620941986689071
Energy: 0.5496294254876447
Energy: 0.6007868522015632
Energy: 0.620941986689071
Energy: 0.5496294254876447
Energy: 0.5638360269725753
Energy: 0.6122624663887234
Energy: 0.576639585634666
Energy: 0.556129665797754
Energy: 0.6122624663887234
Energy: 0.576639585634666
Energy: 0.5638360269709042
Energy: 0.6122624663887234
Energy: 0.576639585634666
Energy: 0.556129665797754
Energy: 0.5636167021951705
Energy: 0.6077891235632271
Energy: 0.6047616458049174
Energy: 0.5562218272400153
Energy: 0.607789123561556
Energy: 0.6076390216313234
Energy: 0.5636167021951705
Energy: 0.6077891235632271
Energy: 0.6047616458049174
Energy: 0.5562218272400153
Energy: 0.553112932583481
Energy: 0.6525499306892378
Energy: 0.6114447184569619
Energy: 0.553112932583481
Energy: 0.6525499306892378
Energy: 0.6114447184569619
Energy: 0.553112932583481
Energy: 0.6525499306892378
Energy: 0.6114447184569619
Energy: 0.553112932583481
Energy: 0.6479092786059883
Energy: 0.5498399641838769
Energy: 0.5966982737014122
Energy: 0.6479092786076593
Energy: 0.5498399641838769
Energy: 0.5966982737030833
Energy: 0.6479092786076593
Energy: 0.5498399641838769
Energy: 0.5966982737030833
Energy: 0.6479092786076593
Energy: 0.6233210220236606
Energy: 0.6190917684293783
Energy: 0.5449513683999108
Energy: 0.6233210220236606
Energy: 0.6190917684293783
Energy: 0.5445000638461124
Energy: 0.6233210220236606
Energy: 0.6190917684293783
Energy: 0.5449513684015818
Energy: 0.6233210220236606
Energy: 0.6464574799571744
Energy: 0.5914728705745017
Energy: 0.5414855474004726
Energy: 0.6464574799571744
Energy: 0.5914728705745017
Energy: 0.5414855474004726
Energy: 0.6464574799571744
Energy: 0.5914728705745017
Energy: 0.5414855474004726
Energy: 0.6464574799571744
Energy: 0.60691483787485
Energy: 0.6063467507002278
Energy: 0.6109044732659468
Energy: 0.60691483787485
Energy: 0.6063467507002278
Energy: 0.6109044732659468
Energy: 0.60691483787485
Energy: 0.6063467507002278
Energy: 0.6109044732659468
Energy: 0.60691483787485
Energy: 0.6112847727350367
Energy: 0.5901062364103955
Energy: 0.5516566655250341
Energy: 0.6112847727333656
Energy: 0.5901062364103955
Energy: 0.5516566655250341
Energy: 0.6112847727367078
Energy: 0.5901062364103955
Energy: 0.5516566655250341
Energy: 0.6112847727350367
Energy: 0.5642521885100452
Energy: 0.5672806719178416
Energy: 0.565035003821655
Energy: 0.5642521885100452
Energy: 0.5672806719178416
Energy: 0.565035003821655
Energy: 0.5642521885100452
Energy: 0.5672806719178416
Energy: 0.565035003821655
Energy: 0.5642521885100452
Energy: 0.6144162658610473
Energy: 0.5583292145564258
Energy: 0.5579867785362406
Energy: 0.6144162658610473
Energy: 0.5583292145564258
Energy: 0.5579867785362406
Energy: 0.6144162658610473
Energy: 0.5583292145564258
Energy: 0.5579867785362406
Energy: 0.614416265859376
Energy: 0.602184719901069
Energy: 0.5506230421584215
Energy: 0.6359386398145997
Energy: 0.602184719901069
Energy: 0.5506230421584215
Energy: 0.6359386398145997
Energy: 0.602184719901069
Energy: 0.5506230421584215
Energy: 0.6359386398145997
Energy: 0.602184719901069
Energy: 0.5586054303925617
Energy: 0.623798313465519
Energy: 0.5586568244551233
Energy: 0.5586054303925617
Energy: 0.623798313465519
Energy: 0.5586568244551233
Energy: 0.5586054303925617
Energy: 0.6237983134671902
Energy: 0.5586568244551233
Energy: 0.5586054303925617
Energy: 0.5803089504994557
Energy: 0.54134457431201
Energy: 0.6421741828414891
Energy: 0.5803089504994557
Energy: 0.5413453227206292
Energy: 0.6421741828414891
Energy: 0.5803089504994557
Energy: 0.54134457431201
Energy: 0.6421741828414891
Energy: 0.5803089504994557
Energy: 0.6232224882617845
Energy: 0.5492808569421225
Energy: 0.6156364052921071
Energy: 0.6232224882617845
Energy: 0.5492808569404513
Energy: 0.6156364052921071
Energy: 0.6232224882617845
Energy: 0.5492808569404513
Energy: 0.6156364052921071
Energy: 0.6232224882617845
Energy: 0.5793207003342515
Energy: 0.5708969963674576
Energy: 0.5481955524493131
Energy: 0.5793207003342515
Energy: 0.5708969963674576
Energy: 0.548195272255627
Energy: 0.5793207003359225
Energy: 0.5708969963674576
Energy: 0.5481955524493131
Energy: 0.5793207003342515
Energy: 0.5516194294622612
Energy: 0.591648874531955
Energy: 0.5904469610664845
Energy: 0.5516194294622612
Energy: 0.591648874531955
Energy: 0.5904469610664845
Energy: 0.5516194294622612
Energy: 0.591648874531955
Energy: 0.5904469610648133
Energy: 0.5516194294622612
Energy: 0.5568952257160202
Energy: 0.6034715478726366
Energy: 0.6361960584436133
Energy: 0.5568952257160202
Energy: 0.6034715478726366
Energy: 0.6361960584436133
Energy: 0.5568952257160202
Energy: 0.6034715478726366
Energy: 0.6361960584436133
Energy: 0.5568952257160202

minimum gb energy = 0.54134457431201 eV
minimum distance =  2.53673574735939 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 0.5425952159657323
Energy: 0.5490136350477607
Energy: 0.5515754479833025
Energy: 0.5425952159663412
Energy: 0.5490136350483696
Energy: 0.5515754479833025
Energy: 0.5425952159657323
Energy: 0.5490136350483696
Energy: 0.5515754479833025
Energy: 0.5425952159663412
Energy: 0.5784612097801038
Energy: 0.5345930087649728
Energy: 0.5403586376591955
Energy: 0.5784612097770598
Energy: 0.5345930087649728
Energy: 0.5403586376598043
Energy: 0.5784612097770598
Energy: 0.5345930087649728
Energy: 0.5403586376598043
Energy: 0.5784612097782774
Energy: 0.5926865827438453
Energy: 0.5272916483220071
Energy: 0.6426863028502409
Energy: 0.5926865827438453
Energy: 0.5272916483226161
Energy: 0.6426864691201333
Energy: 0.5926865827438453
Energy: 0.5272916483220071
Energy: 0.6426863638781108
Energy: 0.5926865827432366
Energy: 0.576809775925132
Energy: 0.622618233332124
Energy: 0.5842091481475995
Energy: 0.576809775925132
Energy: 0.6226182333327328
Energy: 0.5842091481475995
Energy: 0.576809775925132
Energy: 0.6226182333345592
Energy: 0.5842091481475995
Energy: 0.576809775925132
Energy: 0.5553587724464318
Energy: 0.5402871120310757
Energy: 0.6388684620933498
Energy: 0.5553587724464318
Energy: 0.5402871120310757
Energy: 0.6388684620939585
Energy: 0.5553587724464318
Energy: 0.5402871120310757
Energy: 0.6388684620939585
Energy: 0.5553587724464318
Energy: 0.5541390875058309
Energy: 0.5848315781582892
Energy: 0.5349826355889847
Energy: 0.5541390875058309
Energy: 0.5848315781588982
Energy: 0.5349826355889847
Energy: 0.5541390875058309
Energy: 0.5848315781588982
Energy: 0.5349826355889847
Energy: 0.5541390875058309
Energy: 0.5433368333751849
Energy: 0.5467389142270902
Energy: 0.5274334194032976
Energy: 0.5433368333757936
Energy: 0.546738914227699
Energy: 0.5274334194039065
Energy: 0.5433368333751849
Energy: 0.546738914227699
Energy: 0.5274334194039065
Energy: 0.5433368333770112
Energy: 0.5743989199905165
Energy: 0.6049875602796944
Energy: 0.5726237326171074
Energy: 0.5743989199905165
Energy: 0.6049875602796944
Energy: 0.5726237326171074
Energy: 0.5743989199905165
Energy: 0.6049875602796944
Energy: 0.5726237326177162
Energy: 0.5743989199905165
Energy: 0.6711794623604851
Energy: 0.5395747381734693
Energy: 0.5399415851742707
Energy: 0.6711794623604851
Energy: 0.5395747381728605
Energy: 0.5399415851742707
Energy: 0.6711794623604851
Energy: 0.5395747381734693
Energy: 0.5399415851742707
Energy: 0.6711794623604851
Energy: 0.57690057488352
Energy: 0.5913909779993552
Energy: 0.6119710971947565
Energy: 0.57690057488352
Energy: 0.5913909779987464
Energy: 0.6119710971953654
Energy: 0.57690057488352
Energy: 0.5913909779987464
Energy: 0.6119710971953654
Energy: 0.57690057488352
Energy: 0.570421205554698
Energy: 0.5321104227738417
Energy: 0.5569823993986541
Energy: 0.570421205554698
Energy: 0.5321104227738417
Energy: 0.5569823993998717
Energy: 0.570421205554698
Energy: 0.5321104227738417
Energy: 0.5569823993992629
Energy: 0.570421205554698
Energy: 0.5920989089051432
Energy: 0.5352047161839515
Energy: 0.5904579291504864
Energy: 0.5920989089033167
Energy: 0.5352047161839515
Energy: 0.5904579291504864
Energy: 0.5920989089045343
Energy: 0.5352047161845603
Energy: 0.5904579291504864
Energy: 0.5920989089057519
Energy: 0.5399572474091766
Energy: 0.5739813075398362
Energy: 0.5400615153003694
Energy: 0.5399572474097853
Energy: 0.5739813075398362
Energy: 0.5400615153003694
Energy: 0.5399572474097853
Energy: 0.5739813075386186
Energy: 0.5400615153003694
Energy: 0.5399572474097853
Energy: 0.54554539276722
Energy: 0.5470138515256546
Energy: 0.5728584699471303
Energy: 0.5455453927690187
Energy: 0.5470138515250458
Energy: 0.5728584699465215
Energy: 0.54554539276722
Energy: 0.5470138515250458
Energy: 0.5728584699465215
Energy: 0.5455453927678288

minimum gb energy = 0.5272916483220071 eV
minimum distance =  2.53672244764999 Angstroms
sigma value = 33