Model name: model_name=EAM_Dynamo_Zhakhovsky_2009_Al__MO_519613893196_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=4.031999975442886
cohesive_energy=3.360958551709536
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: 0.01181268146565765
Energy: 0.20713978096168034
Energy: 0.20713978096168034
Energy: 0.01181268146565765
Energy: 0.20713978096168034
Energy: 0.2071397809605184
Energy: 0.01181268146565765
Energy: 0.20713978096168034
Energy: 0.20713978096168034
Energy: 0.0118126814679816
Energy: 0.20594194950936875
Energy: 0.013309420211303453
Energy: 0.20627420398603416
Energy: 0.20594194950936875
Energy: 0.013309420211303453
Energy: 0.20627420398603416
Energy: 0.20594194950936875
Energy: 0.013309420210141478
Energy: 0.20627420398603416
Energy: 0.20594194950936875
Energy: 0.8725877334172168
Energy: 0.27911722809611506
Energy: 0.017191638171980838
Energy: 0.8599025928265429
Energy: 0.09782071654570926
Energy: 0.017191638173142815
Energy: 0.8192947691460092
Energy: 0.017191638171980838
Energy: 0.017191638171980838
Energy: 0.8599025928265429
Energy: 0.20594194950936875
Energy: 0.20627420398719612
Energy: 0.013309420211303453
Energy: 0.20594194950820682
Energy: 0.20627420398603416
Energy: 0.013309420212439018
Energy: 0.20594194950936875
Energy: 0.20627420398719612
Energy: 0.013309420211303453
Energy: 0.20594194950820682
Energy: 0.01181268146565765
Energy: 0.2071397809605184
Energy: 0.20713978096168034
Energy: 0.01181268146565765
Energy: 0.20713978096168034
Energy: 0.2071397809605184
Energy: 0.01181268146565765
Energy: 0.2071397809605184
Energy: 0.20713978096168034
Energy: 0.01181268146565765
Energy: 0.20594194950936875
Energy: 0.013309420212439018
Energy: 0.20627420398603416
Energy: 0.20594194950820682
Energy: 0.013309420210141478
Energy: 0.20627420398719612
Energy: 0.20594194950936875
Energy: 0.013309420212439018
Energy: 0.20627420398603416
Energy: 0.20594194950820682
Energy: 0.4483225032105765
Energy: 0.12338214317714076
Energy: 0.017191638173142815
Energy: 0.44841763767270315
Energy: 0.12338214317714076
Energy: 0.017191638171980838
Energy: 0.44841750208973463
Energy: 0.37110876295881656
Energy: 0.017191638173142815
Energy: 0.4484424321562489

minimum gb energy = 0.01181268146565765 eV
minimum distance =  2.61430920463128 Angstroms
sigma value = 3


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

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Energy: 0.6052507253939091
Energy: 0.6054804390982911
Energy: 0.43782345316361154
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Energy: 0.43782345316361154
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Energy: 0.6063234037413777
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Energy: 0.5844155376941844
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Energy: 0.5844155376941844
Energy: 0.45998990577179455
Energy: 0.5030067858837944
Energy: 0.43782345316361154
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Energy: 0.6054804390991448
Energy: 0.4683525630761536
Energy: 0.6052507253930551
Energy: 0.6054804390980063
Energy: 0.4378234531638961
Energy: 0.6052507253953322
Energy: 0.6054804390988603
Energy: 0.4683525630764382
Energy: 0.4944665127196464
Energy: 0.4600300754631597
Energy: 0.6063234037416623
Energy: 0.49446651271822334
Energy: 0.4600300754631597
Energy: 0.6063234037450778
Energy: 0.4944665127193619
Energy: 0.4600300754620212
Energy: 0.6063234037439393
Energy: 0.49446651272078496
Energy: 0.55563547842225
Energy: 0.5439266515964755
Energy: 0.5713616228460697
Energy: 0.5445233991235253
Energy: 0.5439266489375637
Energy: 0.5713616228500545
Energy: 0.5556354784233886
Energy: 0.5439266427190069
Energy: 0.5713616228492007
Energy: 0.5445233991232407
Energy: 0.57811709890654
Energy: 0.6429478069258715
Energy: 0.4381020652014772
Energy: 0.5781170989096708
Energy: 0.6429478069324178
Energy: 0.4381020652051774
Energy: 0.5781170989130864
Energy: 0.6429478069292871
Energy: 0.43810206520119266
Energy: 0.578117098908817

minimum gb energy = 0.4163688115253271 eV
minimum distance =  2.65484442784751 Angstroms
sigma value = 75


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

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Energy: 0.4646480849004484
Energy: 0.4645535931480782
Energy: 0.5460679575180029
Energy: 0.4646480849018373
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minimum gb energy = 0.4630600134621142 eV
minimum distance =  2.51453900947206 Angstroms
sigma value = 105


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

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Energy: 0.5561862015488775
Energy: 0.5412205394944126
Energy: 0.5383398842809672
Energy: 0.5561862015473107
Energy: 0.5412205394933016
Energy: 0.5177702209828916
Energy: 0.5684482529493775
Energy: 0.5655049687782373
Energy: 0.517770220982094
Energy: 0.5684482529501752
Energy: 0.5655049687769839
Energy: 0.517770220981325
Energy: 0.568448252948295
Energy: 0.5655049687730811
Energy: 0.5177702209819516
Energy: 0.5447458265316547
Energy: 0.5420379988515119
Energy: 0.5432000095312904
Energy: 0.5447458265325948
Energy: 0.5420271905980153
Energy: 0.5432000095329995
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Energy: 0.5420379988511985
Energy: 0.5432000095336263
Energy: 0.5447458265352442
Energy: 0.5643570975610362
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Energy: 0.6070184202976028
Energy: 0.5643570975597827
Energy: 0.5319558129926136
Energy: 0.6070184202958651
Energy: 0.5643570975569625
Energy: 0.531950350796234
Energy: 0.6070184202936716
Energy: 0.5643570975572759
Energy: 0.5608066340545106
Energy: 0.5550589282854355
Energy: 0.5277895573386758
Energy: 0.560806634050437
Energy: 0.5550589282849796
Energy: 0.5277895573388184
Energy: 0.560806634050266
Energy: 0.555058928283242
Energy: 0.5277895573381916
Energy: 0.5608066340541973
Energy: 0.5466051033926664
Energy: 0.5571510429675063
Energy: 0.5368488764354294
Energy: 0.5466051033915837
Energy: 0.5572901990904818
Energy: 0.5368488764343469
Energy: 0.5466051033934639
Energy: 0.5571510429689306
Energy: 0.536848876435287
Energy: 0.5466051033961133
Energy: 0.5654351368817928
Energy: 0.5489511644966869
Energy: 0.5535948410407259
Energy: 0.5654351368816218
Energy: 0.548939772932246
Energy: 0.5535948410350854
Energy: 0.5654351368799125
Energy: 0.5489511644995072
Energy: 0.5535948410366521
Energy: 0.5654351368789726
Energy: 0.5717274461315254
Energy: 0.5156676664476291
Energy: 0.5800362946843327
Energy: 0.5717274461287052
Energy: 0.5156672720966688
Energy: 0.5800362946906
Energy: 0.5717274461288476
Energy: 0.515667666445749
Energy: 0.5800362946877797
Energy: 0.5717274461266542

minimum gb energy = 0.5156672720966688 eV
minimum distance =  2.5237324595348 Angstroms
sigma value = 165


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

Energy: 0.49670173491642666
Energy: 0.5412945109354559
Energy: 0.5413030349087832
Energy: 0.4967017349142751
Energy: 0.5412945109370452
Energy: 0.541303034905018
Energy: 0.49670173491642666
Energy: 0.541294510934918
Energy: 0.5413030349082453
Energy: 0.4967017349142751
Energy: 0.49586774291308267
Energy: 0.49607445458054705
Energy: 0.5197480721708722
Energy: 0.4958677429157721
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Energy: 0.49586774291362057
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Energy: 0.535264240227246
Energy: 0.47934565703369314
Energy: 0.5170844910912588
Energy: 0.5354727145524738
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Energy: 0.517084491089645
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Energy: 0.5416757555353608
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Energy: 0.5224145293395097
Energy: 0.5500314982407234
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Energy: 0.5224145293411235
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Energy: 0.5076159046217589
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Energy: 0.5073731588762133
Energy: 0.5190137187681398
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Energy: 0.5071977766403493
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Energy: 0.5224193007848404
Energy: 0.5030212657874122
Energy: 0.4957948839919206
Energy: 0.52241930078753
Energy: 0.5030212657831091
Energy: 0.4957948839956859
Energy: 0.5224193007843025
Energy: 0.5030212657874122
Energy: 0.4957948839962238
Energy: 0.52241930078753
Energy: 0.5170395774497327
Energy: 0.4792251946358862
Energy: 0.535724410971747
Energy: 0.5170395774502706
Energy: 0.47922519463642405
Energy: 0.5357228776426589
Energy: 0.5170395774502706
Energy: 0.47922519463803775
Energy: 0.535746199231049
Energy: 0.5170395774518843
Energy: 0.4958684147582766
Energy: 0.5199764363654203
Energy: 0.4962000974482855
Energy: 0.4958684147588145
Energy: 0.5199775436091607
Energy: 0.4962000974439825
Energy: 0.4958684147593524
Energy: 0.5199772536307452
Energy: 0.4962000974477477
Energy: 0.4958684147582766
Energy: 0.49670173491642666
Energy: 0.5412945109370452
Energy: 0.5413030349077075
Energy: 0.49670173491373726
Energy: 0.5412945109391967
Energy: 0.5413030349066316
Energy: 0.49670173491642666
Energy: 0.5412945109370452
Energy: 0.5413030349077075
Energy: 0.4967017349142751

minimum gb energy = 0.4792251946358862 eV
minimum distance =  2.61487926112013 Angstroms
sigma value = 41


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

Energy: 0.5863061556862957
Energy: 0.48411033605772197
Energy: 0.4846345098370384
Energy: 0.5560969636089514
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Energy: 0.5297961349412291
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Energy: 0.48647543680121524
Energy: 0.5551914248950173
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Energy: 0.4967719128812565
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Energy: 0.46741685759236656
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Energy: 0.48333494728858845
Energy: 0.48103965579956126
Energy: 0.5557286763373023
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Energy: 0.48103965579246566
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Energy: 0.4810396557964118
Energy: 0.55572867633753
Energy: 0.4833349472852493
Energy: 0.44099118592544573
Energy: 0.48835642727691103
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Energy: 0.4741478602634228
Energy: 0.4821919936646208
Energy: 0.4409911859302647
Energy: 0.488356427274179
Energy: 0.47326131110116454
Energy: 0.44099118593068204
Energy: 0.45059184279760417
Energy: 0.4805166510656836
Energy: 0.4804061966642059
Energy: 0.450591842789484
Energy: 0.4804303796606425
Energy: 0.48040182041805096
Energy: 0.4505918427994635
Energy: 0.4805166510569184
Energy: 0.48040619667733486
Energy: 0.4505918428038651
Energy: 0.44971467695350437
Energy: 0.4798718641277328
Energy: 0.44930073799232323
Energy: 0.4497146769564261
Energy: 0.47984096137945137
Energy: 0.4493007379866694
Energy: 0.4497146769560087
Energy: 0.4798718641277328
Energy: 0.44930073799520703
Energy: 0.4497146769560087
Energy: 0.4843667379527248
Energy: 0.4638757150299329
Energy: 0.4651371209753836
Energy: 0.48436673794479435
Energy: 0.46380539731916787
Energy: 0.46513712096806026
Energy: 0.4843667379489683
Energy: 0.4638757150240894
Energy: 0.4651371209705646
Energy: 0.48436673795420476
Energy: 0.4822278239394318
Energy: 0.4830047555201983
Energy: 0.4706120944217484
Energy: 0.4822278239425812
Energy: 0.48300475552623157
Energy: 0.47061209442550495
Energy: 0.5034502328610407
Energy: 0.48300475552456196
Energy: 0.47061209442467017
Energy: 0.48638122232740955

minimum gb energy = 0.43782112819133767 eV
minimum distance =  2.55520529160166 Angstroms
sigma value = 185


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

Energy: 0.36512856136269173
Energy: 0.25098849775866233
Energy: 0.25107824320481165
Energy: 0.22403427375668214
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Energy: 0.2233211161931362
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Energy: 0.3010165353816017
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Energy: 0.29551664120989785
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Energy: 0.30811446701130213
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Energy: 0.2955166412128707
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Energy: 0.3527117506818714
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Energy: 0.261058131984625
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Energy: 0.2450012031763073
Energy: 0.2610581319836341
Energy: 0.3527117506821191
Energy: 0.2448363188975253
Energy: 0.26105813198487277
Energy: 0.3527117506776598
Energy: 0.24729922361881038
Energy: 0.3268486777101313
Energy: 0.2511552493848907
Energy: 0.29477632803578835
Energy: 0.29787740311614314
Energy: 0.25115524938513845
Energy: 0.24729922361534212
Energy: 0.3268486777101313
Energy: 0.25115524938018385
Energy: 0.29477632803653153
Energy: 0.2238504288605274
Energy: 0.2261641606935699
Energy: 0.24748467022013024
Energy: 0.24344480520665718
Energy: 0.24964590009688928
Energy: 0.2474846702198825
Energy: 0.22385042885904097
Energy: 0.22616416069406536
Energy: 0.24748467022186438
Energy: 0.24344480519776127
Energy: 0.2954074490785974
Energy: 0.34030391332205384
Energy: 0.26305555039985035
Energy: 0.3080277297394842
Energy: 0.3403039133260176
Energy: 0.2630555504010891
Energy: 0.29540744908157024
Energy: 0.34030391332700854
Energy: 0.2630555504015845
Energy: 0.30802772973700693

minimum gb energy = 0.2233211161931362 eV
minimum distance =  2.64562187795643 Angstroms
sigma value = 33


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

Energy: 0.4684186083406891
Energy: 0.4517169219967986
Energy: 0.4514810822468318
Energy: 0.4585813839944116
Energy: 0.4517169220022385
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Energy: 0.452164264778297
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Energy: 0.45051184752479484
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minimum distance =  2.5292484755244 Angstroms
sigma value = 219


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

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Energy: 0.5510955704853948
Energy: 0.5308428051824033
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Energy: 0.5510955704853948
Energy: 0.5308428051806032

minimum gb energy = 0.496436416161936 eV
minimum distance =  2.59625993684893 Angstroms
sigma value = 15


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

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minimum gb energy = 0.5688839260030488 eV
minimum distance =  2.53064627356982 Angstroms
sigma value = 293


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

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Energy: 0.5732767847729604
Energy: 0.5816928751354465
Energy: 0.584196245557682
Energy: 0.5732767847731637
Energy: 0.5816928751346333
Energy: 0.5841962455570721
Energy: 0.5732767847727571
Energy: 0.6048722895467411
Energy: 0.6082771169792994
Energy: 0.6229463692156832
Energy: 0.6048722895467411
Energy: 0.6082771169786895
Energy: 0.6229463692154799
Energy: 0.6048722895467411
Energy: 0.608277116979096
Energy: 0.6229463692158865
Energy: 0.6048722895465378
Energy: 0.646561292638782
Energy: 0.5784027641897231
Energy: 0.5745687213505326
Energy: 0.6465612926383755
Energy: 0.5784027641893165
Energy: 0.5745687213499227
Energy: 0.646561292638782
Energy: 0.5784027641897231
Energy: 0.5745687213507359
Energy: 0.6465612926383755
Energy: 0.6027650258617417
Energy: 0.6292430012094117
Energy: 0.5701459196017123
Energy: 0.602765025862555
Energy: 0.6292430012094117
Energy: 0.5701459196017123
Energy: 0.602765025861945
Energy: 0.6292430012083953
Energy: 0.5701459196017123
Energy: 0.602765025862555
Energy: 0.5779355063160653
Energy: 0.5754414210941338
Energy: 0.5715884233375126
Energy: 0.5779355063150489
Energy: 0.5754414210947437
Energy: 0.5715884233375126
Energy: 0.5779355063154554
Energy: 0.5754414210941338
Energy: 0.5715884233375126
Energy: 0.5779355063150489
Energy: 0.6056163825969957
Energy: 0.6080818844971375
Energy: 0.5743927644936422
Energy: 0.6056163825988254
Energy: 0.6080818844969343
Energy: 0.5743927644938456
Energy: 0.6056163825974022
Energy: 0.6080818844965277
Energy: 0.5743927644938456
Energy: 0.6056163825996386
Energy: 0.587237400638247
Energy: 0.5899080393132586
Energy: 0.5899303466890983
Energy: 0.5872374006384502
Energy: 0.5899080393152917
Energy: 0.5899303466878784
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Energy: 0.5899080393152917
Energy: 0.5899303466884883
Energy: 0.5872374006386536
Energy: 0.6057223310587949
Energy: 0.5745357948007281
Energy: 0.6081600509303167
Energy: 0.605722331060218
Energy: 0.5745357947997116
Energy: 0.6081600509301134
Energy: 0.6057223310589982
Energy: 0.5745357948005249
Energy: 0.6081600509299101
Energy: 0.605722331058185
Energy: 0.5779098142154552
Energy: 0.5715922033470479
Energy: 0.5754540485414569
Energy: 0.5779098142156585
Energy: 0.5715922033478611
Energy: 0.5754540485412537
Energy: 0.5779098142152518
Energy: 0.5715922033470479
Energy: 0.575454048540847
Energy: 0.5779098142154552
Energy: 0.6027853299630821
Energy: 0.5701112020295832
Energy: 0.6291132406412903
Energy: 0.6027853299628789
Energy: 0.5701112020303963
Energy: 0.6291132406416968
Energy: 0.6027853299630821
Energy: 0.5701112020297864
Energy: 0.6291132406423068
Energy: 0.6027853299628789
Energy: 0.6465852927484607
Energy: 0.5745759143978935
Energy: 0.5783327746109455
Energy: 0.6465852927488673
Energy: 0.574575914398097
Energy: 0.5783327746111486
Energy: 0.6465852927486639
Energy: 0.5745759143978935
Energy: 0.5783327746099289
Energy: 0.6465852927486639
Energy: 0.6049115063181035
Energy: 0.6228923616440543
Energy: 0.6083903635632467
Energy: 0.6049115063176969
Energy: 0.6228923616438511
Energy: 0.6083903635624336
Energy: 0.6049115063179001
Energy: 0.6228923616440543
Energy: 0.6083903635632467
Energy: 0.6049115063172903
Energy: 0.5732707018025004
Energy: 0.5842247668896104
Energy: 0.5833839432637257
Energy: 0.573270701802907
Energy: 0.5842247668898136
Energy: 0.5833839432639291
Energy: 0.5732707018025004
Energy: 0.584224766890017
Energy: 0.5833839432647422
Energy: 0.5732707018025004
Energy: 0.6396466439692035
Energy: 0.585664033787927
Energy: 0.5856781389759791
Energy: 0.6396466439694068
Energy: 0.5856640337881303
Energy: 0.5856781389749626
Energy: 0.6396466439692035
Energy: 0.5856640337883336
Energy: 0.5856781389757759
Energy: 0.6396466439694068
Energy: 0.5732767847731637
Energy: 0.5816928751360565
Energy: 0.584196245557682
Energy: 0.5732767847731637
Energy: 0.581692875137073
Energy: 0.5841962455570721
Energy: 0.5732767847729604
Energy: 0.5816928751378861
Energy: 0.584196245557682
Energy: 0.5732767847733671
Energy: 0.6048722895465378
Energy: 0.6082771169782828
Energy: 0.6229463692152767
Energy: 0.6048722895467411
Energy: 0.6082771169788928
Energy: 0.6229463692158865
Energy: 0.6048722895463345
Energy: 0.6082771169784862
Energy: 0.6229463692152767
Energy: 0.6048722895465378
Energy: 0.6465612926381722
Energy: 0.5784027641893165
Energy: 0.5745687213499227
Energy: 0.646561292638782
Energy: 0.5784027641897231
Energy: 0.5745687213505326
Energy: 0.6465612926383755
Energy: 0.5784027641893165
Energy: 0.5745687213499227
Energy: 0.6465612926385788
Energy: 0.602765025862555
Energy: 0.6292430012092085
Energy: 0.5701459196017123
Energy: 0.602765025861945
Energy: 0.6292430012085986
Energy: 0.570145919601509
Energy: 0.602765025862555
Energy: 0.6292430012088018
Energy: 0.570145919601509
Energy: 0.602765025861945

minimum gb energy = 0.5701112020295832 eV
minimum distance =  2.53899626475992 Angstroms
sigma value = 293


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

Energy: 0.5704728817907716
Energy: 0.5712556020161047
Energy: 0.5712449719093045
Energy: 0.5704728817907716
Energy: 0.5712556020157372
Energy: 0.5712449719096719
Energy: 0.5704728817911391
Energy: 0.5712556020161047
Energy: 0.5712449719093045
Energy: 0.5704728817907716
Energy: 0.5696037415191761
Energy: 0.570890524662785
Energy: 0.5709897926014781
Energy: 0.5696037415195436
Energy: 0.570890524662785
Energy: 0.5709897926011105
Energy: 0.5696037415195436
Energy: 0.570890524662785
Energy: 0.5709897926011105
Energy: 0.5696037415191761
Energy: 0.5700956483372022
Energy: 0.5701353135951583
Energy: 0.6111364738975492
Energy: 0.5700956483375695
Energy: 0.5701353135944235
Energy: 0.611136473753576
Energy: 0.5700956483375695
Energy: 0.5701353135947911
Energy: 0.6111364737513714
Energy: 0.5700956483368347
Energy: 0.611240954627362
Energy: 0.5701324597250628
Energy: 0.5701465491591959
Energy: 0.6112409549065063
Energy: 0.5701324597272674
Energy: 0.5701465491588286
Energy: 0.6112409545311405
Energy: 0.5701324597239604
Energy: 0.5701465491595635
Energy: 0.6112409545304056
Energy: 0.5710389308664287
Energy: 0.5709117945466365
Energy: 0.5696219134972832
Energy: 0.5710389308653264
Energy: 0.5709117945459017
Energy: 0.5696219134950786
Energy: 0.5710389308671636
Energy: 0.5709117945466365
Energy: 0.5696219134972832
Energy: 0.5710389308664287
Energy: 0.5712556020157372
Energy: 0.5712449719096719
Energy: 0.5704728817915065
Energy: 0.5712556020161047
Energy: 0.571244971908937
Energy: 0.5704728817907716
Energy: 0.5712556020161047
Energy: 0.5712449719096719
Energy: 0.5704728817911391
Energy: 0.5712556020161047
Energy: 0.5708905246631524
Energy: 0.5709897926011105
Energy: 0.5696037415191761
Energy: 0.570890524662785
Energy: 0.5709897926007431
Energy: 0.5696037415188087
Energy: 0.5708905246631524
Energy: 0.5709897926007431
Energy: 0.5696037415191761
Energy: 0.570890524662785
Energy: 0.5701353135944235
Energy: 0.6111364737186852
Energy: 0.5700956483375695
Energy: 0.5701353135951583
Energy: 0.6111364738145393
Energy: 0.5700956483372022
Energy: 0.5701353135944235
Energy: 0.6111364736617473
Energy: 0.570095648337937
Energy: 0.5701353135951583
Energy: 0.5701324597276349
Energy: 0.5701465491588286
Energy: 0.6112409547092696
Energy: 0.570132459723593
Energy: 0.5701465491595635
Energy: 0.6112409547588586
Energy: 0.5701324597272674
Energy: 0.5701465491588286
Energy: 0.6112409546457346
Energy: 0.570132459723593
Energy: 0.5709117945459017
Energy: 0.5696219134947111
Energy: 0.5710389308671636
Energy: 0.5709117945466365
Energy: 0.5696219134972832
Energy: 0.5710389308649588
Energy: 0.5709117945459017
Energy: 0.5696219134950786
Energy: 0.5710389308653264
Energy: 0.5709117945466365
Energy: 0.5712449719093045
Energy: 0.5704728817900367
Energy: 0.5712556020157372
Energy: 0.5712449719096719
Energy: 0.5704728817911391
Energy: 0.5712556020161047
Energy: 0.5712449719093045
Energy: 0.5704728817896693
Energy: 0.5712556020161047
Energy: 0.5712449719096719
Energy: 0.5709897926011105
Energy: 0.5696037415188087
Energy: 0.570890524662785
Energy: 0.5709897926007431
Energy: 0.5696037415191761
Energy: 0.570890524662785
Energy: 0.5709897926011105
Energy: 0.5696037415191761
Energy: 0.570890524662785
Energy: 0.5709897926007431
Energy: 0.6111364737311618
Energy: 0.5700956483375695
Energy: 0.5701353135947911
Energy: 0.611136473820051
Energy: 0.570095648337937
Energy: 0.5701353135955258
Energy: 0.6111364737083966
Energy: 0.5700956483368347
Energy: 0.5701353135944235
Energy: 0.6111364738178462
Energy: 0.5701465491599308
Energy: 0.6112409546644576
Energy: 0.5701324597272674
Energy: 0.5701465491602984
Energy: 0.6112409548245986
Energy: 0.5701324597246954
Energy: 0.5701465491595635
Energy: 0.611240954628097
Energy: 0.5701324597283699
Energy: 0.5701465491591959
Energy: 0.5696219134972832
Energy: 0.5710389308664287
Energy: 0.5709117945459017
Energy: 0.5696219134950786
Energy: 0.5710389308660612
Energy: 0.5709117945462691
Energy: 0.5696219134972832
Energy: 0.5710389308653264
Energy: 0.5709117945459017
Energy: 0.5696219134950786
Energy: 0.5704728817911391
Energy: 0.5712556020161047
Energy: 0.5712449719093045
Energy: 0.5704728817904042
Energy: 0.5712556020161047
Energy: 0.5712449719096719
Energy: 0.5704728817915065
Energy: 0.5712556020161047
Energy: 0.5712449719093045
Energy: 0.5704728817907716
Energy: 0.5696037415188087
Energy: 0.570890524662785
Energy: 0.5709897926007431
Energy: 0.5696037415184413
Energy: 0.570890524662785
Energy: 0.5709897926007431
Energy: 0.5696037415188087
Energy: 0.570890524662785
Energy: 0.5709897926007431
Energy: 0.5696037415184413
Energy: 0.570095648337937
Energy: 0.5701353135955258
Energy: 0.6111364738553092
Energy: 0.5700956483375695
Energy: 0.5701353135951583
Energy: 0.6111364738828513
Energy: 0.5700956483375695
Energy: 0.5701353135955258
Energy: 0.6111364742468428
Energy: 0.5700956483372022
Energy: 0.6112409548348872
Energy: 0.5701324597243278
Energy: 0.5701465491595635
Energy: 0.6112409549773904
Energy: 0.5701324597276349
Energy: 0.5701465491588286
Energy: 0.6112409550288167
Energy: 0.5701324597243278
Energy: 0.5701465491595635
Energy: 0.6112409548587546
Energy: 0.5710389308664287
Energy: 0.5709117945462691
Energy: 0.5696219134972832
Energy: 0.5710389308653264
Energy: 0.5709117945459017
Energy: 0.5696219134950786
Energy: 0.5710389308660612
Energy: 0.5709117945466365
Energy: 0.5696219134972832
Energy: 0.5710389308660612
Energy: 0.5712556020157372
Energy: 0.5712449719096719
Energy: 0.5704728817915065
Energy: 0.5712556020161047
Energy: 0.5712449719093045
Energy: 0.5704728817904042
Energy: 0.5712556020161047
Energy: 0.5712449719100394
Energy: 0.5704728817915065
Energy: 0.5712556020161047
Energy: 0.5708905246631524
Energy: 0.5709897926011105
Energy: 0.5696037415188087
Energy: 0.570890524662785
Energy: 0.5709897926014781
Energy: 0.5696037415184413
Energy: 0.5708905246631524
Energy: 0.5709897926014781
Energy: 0.5696037415184413
Energy: 0.570890524662785

minimum gb energy = 0.5696037415184413 eV
minimum distance =  2.60048430974188 Angstroms
sigma value = 15


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

Energy: 0.5917313083387487
Energy: 0.571553592594195
Energy: 0.5873833627398359
Energy: 0.5658078146480822
Energy: 0.5715535925958607
Energy: 0.5873833627464985
Energy: 0.591731308333782
Energy: 0.5715535925925295
Energy: 0.5873833627498298
Energy: 0.5658078146480822
Energy: 0.5708192688367738
Energy: 0.5691796646494184
Energy: 0.5990309432298414
Energy: 0.5708192688384394
Energy: 0.5691796646594122
Energy: 0.5990309432281758
Energy: 0.5708192688467676
Energy: 0.5691796646610779
Energy: 0.5990309432265102
Energy: 0.5708192688351081
Energy: 0.5898552442570865
Energy: 0.5839082471717831
Energy: 0.6746360248416369
Energy: 0.5898552442604178
Energy: 0.5839082471684518
Energy: 0.6746360248433024
Energy: 0.5898552442554209
Energy: 0.5839082471734487
Energy: 0.6746360248433024
Energy: 0.5898552442520896
Energy: 0.556414368116727
Energy: 0.5840187701756725
Energy: 0.5555161271414201
Energy: 0.5564143681333833
Energy: 0.58401877016901
Energy: 0.5555161271480826
Energy: 0.5564143681267207
Energy: 0.58401877016901
Energy: 0.5555161271480826
Energy: 0.5564143681183925
Energy: 0.6052145380016497
Energy: 0.569475662646254
Energy: 0.6108122891663528
Energy: 0.6052145380033153
Energy: 0.5694756626512206
Energy: 0.6108122891646871
Energy: 0.6052145379983184
Energy: 0.5694756626512206
Energy: 0.6108122891663528
Energy: 0.6052145380016497
Energy: 0.5895105151092531
Energy: 0.6374765706071632
Energy: 0.5557074877506478
Energy: 0.5895105151125843
Energy: 0.6374765706071632
Energy: 0.5557074877539792
Energy: 0.5895105151092531
Energy: 0.6374765706088288
Energy: 0.555707487758976
Energy: 0.5895105151159157
Energy: 0.5859874804553237
Energy: 0.5989900202154305
Energy: 0.5824359934375432
Energy: 0.5859820386240088
Energy: 0.5989900202254244
Energy: 0.5824359934392087
Energy: 0.5859874804619862
Energy: 0.5989900202254244
Energy: 0.58243599344254
Energy: 0.5859820386156807
Energy: 0.5687973397599457
Energy: 0.6258812963688901
Energy: 0.6012099594963848
Energy: 0.5687973397599457
Energy: 0.6258812963705559
Energy: 0.6012099594913879
Energy: 0.5687973397583104
Energy: 0.625881296373887
Energy: 0.6012099594897223
Energy: 0.5687973397666083
Energy: 0.5923453689877285
Energy: 0.5836216348861469
Energy: 0.5833228871051342
Energy: 0.5923453689860627
Energy: 0.5663193544925067
Energy: 0.5664154929830724
Energy: 0.5923453690043848
Energy: 0.583621634876153
Energy: 0.5833228871001372
Energy: 0.5923453689244643
Energy: 0.5679392693844246
Energy: 0.6449274069076696
Energy: 0.5843254059253861
Energy: 0.568091051686334
Energy: 0.6449274069010373
Energy: 0.5976427857890266
Energy: 0.5679392693777622
Energy: 0.6449274069093351
Energy: 0.5843254059253861
Energy: 0.5680910516846683
Energy: 0.5947614134698554
Energy: 0.5470909336922198
Energy: 0.5994464293782702
Energy: 0.5947614134615272
Energy: 0.547090933687223
Energy: 0.5994464293816015
Energy: 0.5947614134581959
Energy: 0.5470909336922198
Energy: 0.5994464293782702
Energy: 0.5947614134631928
Energy: 0.6130457269593363
Energy: 0.5538876786547009
Energy: 0.6520779732916128
Energy: 0.613045726961002
Energy: 0.5540989136018263
Energy: 0.6520779732982754
Energy: 0.6130457269543393
Energy: 0.5538876786513696
Energy: 0.6520779732982754
Energy: 0.613045726961002
Energy: 0.6279675794366292
Energy: 0.5549552769460039
Energy: 0.6098665784589151
Energy: 0.6279675794299665
Energy: 0.5549552769476694
Energy: 0.6098665784556142
Energy: 0.627967579428301
Energy: 0.5549552769426725
Energy: 0.6098665784539484
Energy: 0.6279675794366292
Energy: 0.5543946070334672
Energy: 0.5553931561670785
Energy: 0.660227501420233
Energy: 0.5543946070318015
Energy: 0.5553931561704097
Energy: 0.6602275014218987
Energy: 0.5543946070334672
Energy: 0.5553931561654128
Energy: 0.6602275014218987
Energy: 0.5543946070351329
Energy: 0.6064869284732082
Energy: 0.6365798897159496
Energy: 0.5633436916079747
Energy: 0.606486928474874
Energy: 0.6365798897109526
Energy: 0.5631652544164024
Energy: 0.6064869284615488
Energy: 0.636579889709287
Energy: 0.5633436916129716
Energy: 0.6064869284615488
Energy: 0.5614747466909472
Energy: 0.5685141010953242
Energy: 0.6267979925032195
Energy: 0.5614747466876159
Energy: 0.5685141011003211
Energy: 0.6267979925015539
Energy: 0.5614747466909472
Energy: 0.5685141010936584
Energy: 0.6267979924948913
Energy: 0.5614747466892817
Energy: 0.5699578131979314
Energy: 0.642178270656586
Energy: 0.61408016779552
Energy: 0.5873054476734686
Energy: 0.6421782706532546
Energy: 0.6140801677988513
Energy: 0.5699578131995969
Energy: 0.6421782706632485
Energy: 0.6140801678021826
Energy: 0.5873054476817665
Energy: 0.6590477223971483
Energy: 0.57014198107688
Energy: 0.5984881439427734
Energy: 0.6590477224004796
Energy: 0.5701419810868739
Energy: 0.5984881439377764
Energy: 0.6590477223988139
Energy: 0.5701419810835425
Energy: 0.598488143944439
Energy: 0.6590477223971483
Energy: 0.5633019200651959
Energy: 0.6456021587618863
Energy: 0.5668816393587015
Energy: 0.5633019200601989
Energy: 0.645602158758555
Energy: 0.5668816393603671
Energy: 0.5633019200668614
Energy: 0.6456021587502571
Energy: 0.5668816393553702
Energy: 0.5633019200651959
Energy: 0.6232113646712208
Energy: 0.5633247835940318
Energy: 0.5834795299737283
Energy: 0.6232113646778834
Energy: 0.5633247836039953
Energy: 0.5834795299703971
Energy: 0.6232113646728864
Energy: 0.5633247835990287
Energy: 0.583479529975394
Energy: 0.6232113646762177
Energy: 0.5874488810716475
Energy: 0.5692291186546604
Energy: 0.6364489233619782
Energy: 0.5874488810716475
Energy: 0.5692291186513292
Energy: 0.636448923358647
Energy: 0.5874488810699817
Energy: 0.5692291186546604
Energy: 0.6364489233569812
Energy: 0.5874488810649848
Energy: 0.5978595587382046
Energy: 0.6127209195067487
Energy: 0.5559076675187682
Energy: 0.5978595587298764
Energy: 0.6127209195117457
Energy: 0.5559076675171025
Energy: 0.5978595587282108
Energy: 0.6127209195134112
Energy: 0.5559076675137713
Energy: 0.5978595587315421
Energy: 0.5842692375412779
Energy: 0.5849359625355767
Energy: 0.5704393338554756
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Energy: 0.5848953294864525
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Energy: 0.5840785107404065
Energy: 0.5584608996532793
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Energy: 0.5949417773859891
Energy: 0.5935732503354743
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Energy: 0.5949417773859891
Energy: 0.5681588717438996
Energy: 0.6166842079303667
Energy: 0.5963438989795676
Energy: 0.5681668460399828
Energy: 0.6166842079253698
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Energy: 0.5681588717405682
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Energy: 0.596343898972905
Energy: 0.5681668460433141
Energy: 0.6073367494511045
Energy: 0.5521991545999706
Energy: 0.5986514536588413
Energy: 0.6073367494494388
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Energy: 0.5986514536671695
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Energy: 0.5521991545949737
Energy: 0.5986514536621725
Energy: 0.6073367494511045
Energy: 0.625528486678539
Energy: 0.6252493594863238
Energy: 0.656030154743249
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Energy: 0.588773321137601
Energy: 0.6189311810465629
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Energy: 0.5887733211309385
Energy: 0.6189311810482285
Energy: 0.5832735193220362
Energy: 0.5521659959751786
Energy: 0.6208551476221796
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Energy: 0.6208551476238452
Energy: 0.5832735193237018
Energy: 0.5521659959701816
Energy: 0.6208551476321734
Energy: 0.5832735193237018
Energy: 0.6237251216016738
Energy: 0.6248785618604661
Energy: 0.5652168950968376
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Energy: 0.5652283494523425
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Energy: 0.6252593322944665
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Energy: 0.5657079147915602
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Energy: 0.6234697591766798
Energy: 0.5857633349510684
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Energy: 0.5917500487205881
Energy: 0.6151102193881591
Energy: 0.6131667066228148
Energy: 0.5657600406170773
Energy: 0.6151102193864936
Energy: 0.6153050123694822
Energy: 0.5917500487189225
Energy: 0.6151102193898248
Energy: 0.6131667066411368
Energy: 0.5657600406254055
Energy: 0.5593661211715648
Energy: 0.6738542853854682
Energy: 0.6108645444528404
Energy: 0.5593661211732304
Energy: 0.673854285395462
Energy: 0.6108645444495091
Energy: 0.5593661211715648
Energy: 0.6738542853838025
Energy: 0.6108645444578373
Energy: 0.5593661211682335
Energy: 0.5556747930969831
Energy: 0.566063659929015
Energy: 0.6105964482960309
Energy: 0.5556747930969831
Energy: 0.5660636599306805
Energy: 0.610596448299362
Energy: 0.5556747930953175
Energy: 0.5660636599306805
Energy: 0.6105964482943651
Energy: 0.5556747930986489
Energy: 0.6055785826114624
Energy: 0.6244221477499495
Energy: 0.5531101852119288
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Energy: 0.5532864424730193
Energy: 0.6055785826181249
Energy: 0.624422147744983
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Energy: 0.6055785826081311
Energy: 0.6622651809969642
Energy: 0.595884620844398
Energy: 0.5539092481032611
Energy: 0.6622651810052621
Energy: 0.5958846208560575
Energy: 0.5539092481015955
Energy: 0.6622651810035964
Energy: 0.5958846208560575
Energy: 0.5539092480982641
Energy: 0.6622651809969642
Energy: 0.6254782366333562
Energy: 0.6295547705760652
Energy: 0.6022959362393366
Energy: 0.6254782366283592
Energy: 0.6295547705793966
Energy: 0.6022959362343396
Energy: 0.6254782366350218
Energy: 0.6295547705760652
Energy: 0.6022959362393366
Energy: 0.6254782366366873
Energy: 0.6230553761803316
Energy: 0.5947708837667229
Energy: 0.5572113861705307
Energy: 0.623055376186994
Energy: 0.5947708837700543
Energy: 0.5572113861688651
Energy: 0.6230553761919909
Energy: 0.5947708837717199
Energy: 0.5572113861721965
Energy: 0.623055376186994
Energy: 0.5684286929487933
Energy: 0.6295626468577292
Energy: 0.5923500938917812
Energy: 0.5684286929504588
Energy: 0.6295626468593948
Energy: 0.5923500938967782
Energy: 0.5684286929487933
Energy: 0.6295626468643917
Energy: 0.592350093893447
Energy: 0.5684286929487933
Energy: 0.624525169609496
Energy: 0.5852808869117418
Energy: 0.5849406988813328
Energy: 0.6245251696078303
Energy: 0.5684433796560767
Energy: 0.5681804613639629
Energy: 0.624525169609496
Energy: 0.5852808869117418
Energy: 0.5849406988879954
Energy: 0.6245251696111616
Energy: 0.6189769273709015
Energy: 0.547198764236105
Energy: 0.604047684254711
Energy: 0.6189769273742328
Energy: 0.5471987642394363
Energy: 0.6040476842563766
Energy: 0.6189769273725672
Energy: 0.5471987642327738
Energy: 0.6040476842613735
Energy: 0.6189769273742328
Energy: 0.5838576919698611
Energy: 0.6516824893724144
Energy: 0.5840424638321603
Energy: 0.5838576919631986
Energy: 0.6516824893674174
Energy: 0.5840424638271633
Energy: 0.5838576919681956
Energy: 0.6516824893724144
Energy: 0.5840424638304946
Energy: 0.5838576919681956
Energy: 0.5685291209483632
Energy: 0.5540217956924383
Energy: 0.6592293207681671
Energy: 0.5685291209417005
Energy: 0.554009535645125
Energy: 0.6592293207681671
Energy: 0.5685291209500287
Energy: 0.5540217956941039
Energy: 0.6592293207714983
Energy: 0.5685291209466974
Energy: 0.5802637833289173
Energy: 0.5639726631392383
Energy: 0.62489668488729
Energy: 0.5802637833255859
Energy: 0.5639726631325758
Energy: 0.6248966848856244
Energy: 0.5802637833322484
Energy: 0.563972663135907
Energy: 0.6248966848822931
Energy: 0.5802637833289173
Energy: 0.5891005804099804
Energy: 0.587448065717887
Energy: 0.5636580827467047
Energy: 0.5891005804083147
Energy: 0.5874480657262152
Energy: 0.5637301046894796
Energy: 0.5891005804066491
Energy: 0.5874480657295464
Energy: 0.5636580827550329
Energy: 0.5891005804149774
Energy: 0.5571102521934025
Energy: 0.58500792630552
Energy: 0.5762383379905112
Energy: 0.5571102521967337
Energy: 0.5850079263021888
Energy: 0.576238337995508
Energy: 0.5571102521900713
Energy: 0.585007926292195
Energy: 0.5762383379938424
Energy: 0.5571102521950682
Energy: 0.5657278062787637
Energy: 0.6228120325186531
Energy: 0.6409190793018864
Energy: 0.5831025855092175
Energy: 0.6228120325269813
Energy: 0.640919079308549
Energy: 0.5657278062721012
Energy: 0.6228120325203188
Energy: 0.6409190793068834
Energy: 0.5831025855058862

minimum gb energy = 0.547090933687223 eV
minimum distance =  2.51842389336155 Angstroms
sigma value = 437


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

Energy: 0.5434999003055057
Energy: 0.5484797710219631
Energy: 0.549110312820903
Energy: 0.5434999003042921
Energy: 0.54847977102257
Energy: 0.5491103128221165
Energy: 0.5434999003055057
Energy: 0.5484797710219631
Energy: 0.549110312820903
Energy: 0.5434999003042921
Energy: 0.5959020344072437
Energy: 0.5314030026142609
Energy: 0.5875892685951121
Energy: 0.5959020344084572
Energy: 0.5314030026142609
Energy: 0.5875892685963258
Energy: 0.5959020344078504
Energy: 0.5314030026136541
Energy: 0.5875892685951121
Energy: 0.5959020344078504
Energy: 0.5914129043069742
Energy: 0.52445748290778
Energy: 0.636818235190429
Energy: 0.591412904307581
Energy: 0.52445748290778
Energy: 0.636818234346726
Energy: 0.5914129043069742
Energy: 0.52445748290778
Energy: 0.6368182348307491
Energy: 0.591412904307581
Energy: 0.588777341267614
Energy: 0.6063715042082461
Energy: 0.5506587935496682
Energy: 0.5887773412688277
Energy: 0.6063715042058188
Energy: 0.5506587935490613
Energy: 0.588777341267614
Energy: 0.6063715042082461
Energy: 0.5506587935490613
Energy: 0.5887773412688277
Energy: 0.5530986621646619
Energy: 0.5364313023556277
Energy: 0.6595171522262533
Energy: 0.5530986621652686
Energy: 0.5364313023550209
Energy: 0.6595171522232192
Energy: 0.5530986621646619
Energy: 0.5364313023556277
Energy: 0.6595171522262533
Energy: 0.5530986621646619
Energy: 0.5504455466260406
Energy: 0.5997093073125894
Energy: 0.5314365295973492
Energy: 0.550445546627861
Energy: 0.5997093073089484
Energy: 0.5314365295979561
Energy: 0.5504455466260406
Energy: 0.5997093073125894
Energy: 0.5314365295973492
Energy: 0.550445546627861
Energy: 0.5510653292401825
Energy: 0.5439769897067948
Energy: 0.5245350369656315
Energy: 0.5510653292413961
Energy: 0.5439769897067948
Energy: 0.524535036967452
Energy: 0.5510653292407893
Energy: 0.5439769897067948
Energy: 0.5245350369656315
Energy: 0.5510653292413961
Energy: 0.5427532322709056
Energy: 0.6136571688366562
Energy: 0.5788919356542864
Energy: 0.5427532322702988
Energy: 0.6136571688372631
Energy: 0.5788919356330753
Energy: 0.5427532322709056
Energy: 0.6136571688366562
Energy: 0.578891935686448
Energy: 0.5427532322702988
Energy: 0.6391805684066513
Energy: 0.5878009186659305
Energy: 0.5365777614106627
Energy: 0.6391805684072581
Energy: 0.58780091866411
Energy: 0.5365777614143037
Energy: 0.6391805684066513
Energy: 0.5878009186659305
Energy: 0.5365777614112696
Energy: 0.6391805684072581
Energy: 0.5852113715063707
Energy: 0.5498357497981186
Energy: 0.6024034539357724
Energy: 0.5852113715069777
Energy: 0.549835749799939
Energy: 0.6024034539369861
Energy: 0.5852113715063707
Energy: 0.5498357497981186
Energy: 0.6024034539357724
Energy: 0.5852113715069777
Energy: 0.571188405711529
Energy: 0.5712408162765391
Energy: 0.5946776092147659
Energy: 0.5711884057121359
Energy: 0.5712408162771458
Energy: 0.5946776092117319
Energy: 0.5711884057121359
Energy: 0.5712408162765391
Energy: 0.5946776092147659
Energy: 0.5711884057121359
Energy: 0.5490709009259842
Energy: 0.532117632918544
Energy: 0.5349721591544174
Energy: 0.5490709009253774
Energy: 0.5321176329191506
Energy: 0.5349721591568448
Energy: 0.5490709009265909
Energy: 0.532117632918544
Energy: 0.5349721591550243
Energy: 0.5490709009259842
Energy: 0.536616205664648
Energy: 0.567271181994584
Energy: 0.5367626572869713
Energy: 0.5366162056664685
Energy: 0.5672711819964045
Energy: 0.5367626572875781
Energy: 0.536616205664648
Energy: 0.5672711819951908
Energy: 0.5367626572869713
Energy: 0.5366162056664685
Energy: 0.541466438862159
Energy: 0.5405122093031315
Energy: 0.5802139162848307
Energy: 0.5414664388591248
Energy: 0.540512209301311
Energy: 0.5802139162842237
Energy: 0.5414664388627657
Energy: 0.5405122093031315
Energy: 0.5802139162848307
Energy: 0.5414664388603383

minimum gb energy = 0.52445748290778 eV
minimum distance =  2.54513340697056 Angstroms
sigma value = 33