Model name: model_name=MEAM_LAMMPS_ShimParkCho_2003_NiW__MO_500937681860_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391771733761
cohesive_energy=4.450349977833565
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
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: 0.022218726617191854
Energy: 0.6788959500259555
Energy: 1.7768966214470923
Energy: 0.6788524521849757
Energy: 0.022218726617191854
Energy: 0.6788959500259555
Energy: 0.4046910498281101
Energy: 0.7379013514161933
Energy: 0.022396687730784293
Energy: 0.3640115650204627
Energy: 0.022440699499316027
Energy: 0.7379013514161933
Energy: 0.022396687728145716
Energy: 0.3640115650204627
Energy: 0.022218726617191854
Energy: 0.6788959500259555
Energy: 1.9561365281504848
Energy: 0.6788524521849757
Energy: 0.022218726617191854
Energy: 0.6788959500259555
Energy: 0.4046910498281101
Energy: 0.7379013514188317
Energy: 0.022396687730784293
Energy: 0.36401156502310134
Energy: 0.022440699499316027
Energy: 0.7379013514161933
Energy: 0.022396687730784293
Energy: 0.3640115650204627
Energy: 0.022218726617191854
Energy: 0.6788959500259555
Energy: 0.7386175566234795
Energy: 0.6788524521849757
Energy: 0.022218726617191854
Energy: 0.6788959500259555
Energy: 0.4046910498281101
Energy: 0.7379013514161933
Energy: 0.022396687730784293
Energy: 0.3640115650204627
Energy: 0.022440699499316027
Energy: 0.7379013514161933
Energy: 0.022396687728145716
Energy: 0.3640115650204627

minimum gb energy = 0.022218726617191854 eV
minimum distance =  2.4715595885449 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.7416590932083298
Energy: 1.735578135167619
Energy: 1.889327693312906
Energy: 1.7355693771465819
Energy: 1.7416590932051064
Energy: 1.735578135167619
Energy: 1.889486677140302
Energy: 1.6274287203201259
Energy: 1.6311685650575818
Energy: 1.7523647583478674
Energy: 1.6627471979694306
Energy: 1.6274287203329612
Energy: 1.6311685650575818
Energy: 1.7523647583478674
Energy: 1.624457747331685
Energy: 1.6427553577486167
Energy: 1.8170667966539042
Energy: 1.642921738494308
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Energy: 1.6427553577389462
Energy: 1.8313757642925828
Energy: 1.7423250863261008
Energy: 1.6914308520336
Energy: 1.8086664131920025
Energy: 1.6558907235582756
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Energy: 1.6914308520368238
Energy: 1.8086664132016728
Energy: 1.6312194173095778
Energy: 1.6054208378505332
Energy: 1.8545503717958558
Energy: 1.6848688963381309
Energy: 1.6312194173128016
Energy: 1.6054208378440864
Energy: 1.8545503717926324
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Energy: 1.6991623651417602
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Energy: 1.627072856755532
Energy: 1.7092195800832632
Energy: 1.9197102683789884
Energy: 1.7081917875587846
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Energy: 1.8808027296468128
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Energy: 1.6911588893647767
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Energy: 1.8477830632298933
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Energy: 1.879215836056847
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Energy: 1.696375848266218
Energy: 1.8242760204872692
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Energy: 1.6446293973737949
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Energy: 1.796404305033103
Energy: 1.8919455157259142
Energy: 1.7521955905109674
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Energy: 1.7964043050395502
Energy: 1.8919455157226905
Energy: 1.6351706002577902
Energy: 1.6539389355595755
Energy: 1.7120385546567911
Energy: 1.6630041251987357
Energy: 1.6351706002545665
Energy: 1.6539389355531287
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Energy: 1.6293129571889444
Energy: 1.6044290698923456
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Energy: 1.6293129571889444
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Energy: 1.6434291752547316
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Energy: 1.6434291752482844
Energy: 1.8465773596229922
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Energy: 1.7102167938638586
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Energy: 1.6438908339566463
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Energy: 1.8331235355566051
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Energy: 1.6293025429612193
Energy: 1.7503426968806988
Energy: 1.745602763402434
Energy: 1.6630803039939246
Energy: 1.6293025429579957
Energy: 1.7503426968839224
Energy: 1.7274886801967437
Energy: 1.6402391709725752
Energy: 1.7490035017313037
Energy: 1.6441949846956379
Energy: 1.7274886802031908
Energy: 1.6402391709725752
Energy: 1.7490035017313037
Energy: 1.7417336257809988
Energy: 1.6911458255909948
Energy: 1.839819210589922
Energy: 1.6889911382222196
Energy: 1.7417336257809988
Energy: 1.6911458255973837
Energy: 1.8398192105931457
Energy: 1.6745188328296559
Energy: 1.6569670799523173
Energy: 1.8530269204717082
Energy: 1.6403506642488566
Energy: 1.674518832826432
Energy: 1.6569670799523173
Energy: 1.8530269204846024
Energy: 1.6454759276513
Energy: 1.6828352314483013
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Energy: 1.6285587790172984
Energy: 1.6454759276416295
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Energy: 1.8752984935726928
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Energy: 1.7328834501687205
Energy: 1.8684727618536148
Energy: 1.7755378609125463
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Energy: 1.8684727618471677
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Energy: 1.6965014936646103
Energy: 1.678758385021414
Energy: 1.6251886480649849
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Energy: 1.6593907220502493
Energy: 1.68538845093658
Energy: 1.9205652683593029
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Energy: 1.6593907220502493
Energy: 1.685388450930133
Energy: 1.92056526836575
Energy: 1.6633847841070877
Energy: 1.626706112261859
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Energy: 1.6908144697727139
Energy: 1.6633847841103115
Energy: 1.6267061122683057
Energy: 1.9044519270189695
Energy: 1.6251572008555182
Energy: 1.6331083523427803
Energy: 1.6841863493050397
Energy: 1.7131160963233716
Energy: 1.6251572008522948
Energy: 1.6331083523363916
Energy: 1.6841863493114868
Energy: 1.626650721807976
Energy: 1.7263596645527726
Energy: 1.8572178235961543
Energy: 1.647844226070724
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Energy: 1.8572178235864838
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Energy: 1.6510297076140588
Energy: 1.820096358389005
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Energy: 1.6198922900728385
Energy: 1.6510297076140588
Energy: 1.8200963583986756
Energy: 1.6224786707776069
Energy: 1.6553121554096852
Energy: 1.7807866205397969
Energy: 1.6428856664728866
Energy: 1.6224786707808303
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Energy: 1.7807866205365734
Energy: 1.660885063781241
Energy: 1.6655766611539984
Energy: 1.8359888371611852
Energy: 1.6697704549184622
Energy: 1.660885063778017
Energy: 1.6655766611507747
Energy: 1.835988837154738
Energy: 1.6837107989977724
Energy: 1.811580312565782
Energy: 1.8136018550893978
Energy: 1.7467203584191866
Energy: 1.6837107989977724
Energy: 1.8115803125625585
Energy: 1.8136018550990685
Energy: 1.6901013757303323
Energy: 1.6457997066740806
Energy: 1.7783575972613073
Energy: 1.6836716992132301
Energy: 1.6901013757238852
Energy: 1.6457997066805277
Energy: 1.7783575972613073
Energy: 1.6817443147214937
Energy: 1.6421350684274199
Energy: 1.823802894148615
Energy: 1.6619617843621723
Energy: 1.68174431471827
Energy: 1.6421350684274199
Energy: 1.8238028941453914
Energy: 1.7945848406049565
Energy: 1.670143509029164
Energy: 1.8288218523515525
Energy: 1.6948913722673151
Energy: 1.7945848406017328
Energy: 1.6701435090356114
Energy: 1.8288218523547761
Energy: 1.6809074532046382
Energy: 1.6885701967539133
Energy: 1.8089002996582173
Energy: 1.69881929219711
Energy: 1.6809074532046382
Energy: 1.6885701967571365
Energy: 1.8089002996614407
Energy: 1.6198877684487742
Energy: 1.644606994017075
Energy: 1.8800583277251346
Energy: 1.6573236263054452
Energy: 1.619887768455221
Energy: 1.6446069940202985
Energy: 1.8800583277315817
Energy: 1.6267026654350836
Energy: 1.7019503401344542
Energy: 1.8855367768646318
Energy: 1.7754901197214097
Energy: 1.6267026654350836
Energy: 1.7019503401344542
Energy: 1.8855367768678555
Energy: 1.6047604115784713
Energy: 1.7084706105161598
Energy: 1.69517239690158
Energy: 1.6275048181437373
Energy: 1.60476041158486
Energy: 1.7084706105129364
Energy: 1.6951723968951329

minimum gb energy = 1.6044290698923456 eV
minimum distance =  2.2192325678987 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.741548137319548
Energy: 1.667116723080349
Energy: 1.8915471209491876
Energy: 1.6659513101146954
Energy: 1.741548137319548
Energy: 1.667116723080349
Energy: 1.8887124100258947
Energy: 1.6181724828261657
Energy: 1.7561325886562185
Energy: 1.7733382912490878
Energy: 1.6532182321953022
Energy: 1.6181724828298247
Energy: 1.7561325886562185
Energy: 1.7697539043080663
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Energy: 1.6401210354419662
Energy: 1.8086890668447952
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Energy: 1.6401210354456253
Energy: 1.8086890668447952
Energy: 1.6752020476756408
Energy: 1.676746417526444
Energy: 1.787198115191788
Energy: 1.6449758228085927
Energy: 1.6752020476756408
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Energy: 1.8141476752108037
Energy: 1.6878998807166492
Energy: 1.665051864590139
Energy: 1.7301689177365418
Energy: 1.6457660926325264
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Energy: 1.6238079473125244
Energy: 1.643001081244089
Energy: 1.7922560228046158
Energy: 1.6724249590924394
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Energy: 1.7461707756511362
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Energy: 1.900181411508322
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Energy: 1.6615705094806976
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Energy: 1.7945352441129188
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Energy: 1.6447006784868947
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Energy: 1.8222661597527146
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Energy: 1.667116723080349
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Energy: 1.6401210354419662
Energy: 1.8086890668447952
Energy: 1.6752020476756408
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Energy: 1.6858923836666502
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Energy: 1.7211488797576207
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Energy: 1.7704571815534937
Energy: 1.6193790384334987
Energy: 1.6364513659486137
Energy: 1.772358468587401
Energy: 1.6615705094806976
Energy: 1.6193790384334987
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Energy: 1.772358468587401
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Energy: 1.6447006784868947
Energy: 1.62021978310952
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Energy: 1.6671167230766901
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Energy: 1.7561325886562185
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Energy: 1.6401210354419662
Energy: 1.8086890668447952
Energy: 1.6339890802571169
Energy: 1.6369127654440387
Energy: 1.6401210354419662
Energy: 1.8086890668447952
Energy: 1.6752020476756408
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Energy: 1.6449758228085927
Energy: 1.6752020476756408
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Energy: 1.8141476752108037
Energy: 1.6878998807166492
Energy: 1.665051864590139
Energy: 1.8153011238326742
Energy: 1.6457660926325264
Energy: 1.6878998807129904
Energy: 1.665051864590139
Energy: 1.8153011238326742
Energy: 1.6238079473125244
Energy: 1.643001081247748
Energy: 1.7922560228046158
Energy: 1.67242495908878
Energy: 1.6238079473125244
Energy: 1.643001081247748
Energy: 1.7922560228046158
Energy: 1.660618389362319
Energy: 1.68692967542847
Energy: 1.8135427828225554
Energy: 1.6659775723997128
Energy: 1.660618389362319
Energy: 1.6869296754357879
Energy: 1.8135427828116448
Energy: 1.6521439692644513
Energy: 1.645417217314426
Energy: 1.9285127946870404
Energy: 1.6921944630488523
Energy: 1.6521439692644513
Energy: 1.645417217314426
Energy: 1.9285127946943585
Energy: 1.6330135627579396
Energy: 1.6474286152084474
Energy: 1.733037824965717
Energy: 1.6377243394415004
Energy: 1.6330135627542808
Energy: 1.6474286152084474
Energy: 1.7330378249693763
Energy: 1.6858923836666502
Energy: 1.7201720782635503
Energy: 1.7057887757215204
Energy: 1.6352189270482798
Energy: 1.6858923836629913
Energy: 1.7201720782598917
Energy: 1.7057887757251793
Energy: 1.673944055813566
Energy: 1.7093522415578088
Energy: 1.7704571815461758
Energy: 1.6349646866427012
Energy: 1.6739440558099072
Energy: 1.7093522415541493
Energy: 1.7704571815498347
Energy: 1.619430280836168
Energy: 1.6364513659522728
Energy: 1.772358468587401
Energy: 1.661570509484357
Energy: 1.6194302808398273
Energy: 1.6364513659522728
Energy: 1.772358468587401
Energy: 1.6373822639356548
Energy: 1.6477704989518702
Energy: 1.834164954256463
Energy: 1.6447006784832359
Energy: 1.6373822639356548
Energy: 1.6477704989555295
Energy: 1.834164954260122
Energy: 1.6343646989834828
Energy: 1.667116723080349
Energy: 1.8887124100222359
Energy: 1.6659513101146954
Energy: 1.634364698990801
Energy: 1.6671167230766901
Energy: 1.8887124100258947
Energy: 1.6181724828261657
Energy: 1.7561325886525592
Energy: 1.7697539043080663
Energy: 1.6497461136154072
Energy: 1.6181724828298247
Energy: 1.7561325886562185
Energy: 1.7697539043080663

minimum gb energy = 1.6181724828261657 eV
minimum distance =  2.23480786164595 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.779848103050069
Energy: 1.6561150756930438
Energy: 1.835078080276157
Energy: 1.6584693755122075
Energy: 1.7798481030479565
Energy: 1.6561150756934664
Energy: 1.8914424255117577
Energy: 1.7425016308817165
Energy: 1.6473430075215214
Energy: 1.7412310784751508
Energy: 1.6925530001739202
Energy: 1.742501630879604
Energy: 1.6473430075227888
Energy: 1.7412310784747282
Energy: 1.677235421330435
Energy: 1.703156759678341
Energy: 1.8845943124075457
Energy: 1.6958256279158082
Energy: 1.6772354213300122
Energy: 1.7031567596779185
Energy: 1.8845943124067006
Energy: 1.6811315810484195
Energy: 1.635935676058804
Energy: 1.8305114122310446
Energy: 1.6340040084423333
Energy: 1.6811315810484195
Energy: 1.635935676057114
Energy: 1.830511412230622
Energy: 1.684486954355592
Energy: 1.6800796294771592
Energy: 1.8754185869607156
Energy: 1.6984655811884122
Energy: 1.684486954353902
Energy: 1.680079629477582
Energy: 1.9183012278251044
Energy: 1.714840023116716
Energy: 1.6357905482379393
Energy: 1.6865484458086761
Energy: 1.7001054948266527
Energy: 1.7148400231179834
Energy: 1.6357905482358268
Energy: 1.6865484458086761
Energy: 1.706216292531253
Energy: 1.7690653925258737
Energy: 1.8702901128237293
Energy: 1.700617663194674
Energy: 1.7062162925291402
Energy: 1.7690653925241837
Energy: 1.8255990481168274
Energy: 1.7033995541777924
Energy: 1.662252939855123
Energy: 1.7922027014784974
Energy: 1.6581229249554257
Energy: 1.7033995541790599
Energy: 1.6622529398547001
Energy: 1.7922027014763846
Energy: 1.687379369589224
Energy: 1.6375099098992432
Energy: 1.8145884545075999
Energy: 1.6531694989815013
Energy: 1.687379369588379
Energy: 1.637509909898398
Energy: 1.8145884545059097
Energy: 1.6902388443522538
Energy: 1.7149815246510451
Energy: 1.8362300919146768
Energy: 1.7766314001018728
Energy: 1.6902388443535212
Energy: 1.7149815246502
Energy: 1.8362300919138317
Energy: 1.7554922671022013
Energy: 1.7127866643330771
Energy: 1.8337835000391431
Energy: 1.62859772476067
Energy: 1.7554922671026238
Energy: 1.7127866643334997
Energy: 1.833783500039566
Energy: 1.6962864731715295
Energy: 1.7247799379490316
Energy: 1.8533357695364714
Energy: 1.702004280065454
Energy: 1.6962864731723744
Energy: 1.7247799379515663
Energy: 1.8533357695360488
Energy: 1.691716680042475
Energy: 1.6357488352414733
Energy: 1.7833241684378895
Energy: 1.6499393188956826
Energy: 1.69171668004332
Energy: 1.635748835242318
Energy: 1.7833241684378895
Energy: 1.6716820490889928
Energy: 1.6974093354459239
Energy: 1.700885699530722
Energy: 1.702644232281141
Energy: 1.6716820490885707
Energy: 1.6974093354463462
Energy: 1.700885699530722
Energy: 1.7063863992842563
Energy: 1.6374912012930045
Energy: 1.7508600055426622
Energy: 1.6513895341540346
Energy: 1.7063863992842563
Energy: 1.6374912012930045
Energy: 1.7508600055426622
Energy: 1.7511337006408416
Energy: 1.7020331024037691
Energy: 1.7633582774340772
Energy: 1.723016703148343
Energy: 1.7511337006404195
Energy: 1.7020331024063042
Energy: 1.7633582774332324
Energy: 1.7557992989254536
Energy: 1.6352815310199178
Energy: 1.872291181826629
Energy: 1.6921132248038455
Energy: 1.7557992989262985
Energy: 1.6352815310178055
Energy: 1.8722911818262067
Energy: 1.689862390162235
Energy: 1.7533908757818994
Energy: 1.703919252625422
Energy: 1.7213143262594817
Energy: 1.6898623901609675
Energy: 1.7533908757818994
Energy: 1.7039192526262672
Energy: 1.6730492037869689
Energy: 1.6621062183850634
Energy: 1.829559625577183
Energy: 1.6541175278114624
Energy: 1.673049203788659
Energy: 1.6621062183867537
Energy: 1.8295596255767603
Energy: 1.7029639577702302
Energy: 1.6652077494289814
Energy: 1.7564037019719905
Energy: 1.6539186870538858
Energy: 1.7029639577693856
Energy: 1.6652077494294037
Energy: 1.7564037019715684
Energy: 1.6983385393884844
Energy: 1.6966406117549209
Energy: 1.7251461510952517
Energy: 1.7788783175904732
Energy: 1.6983385393876391
Energy: 1.6966406117566109
Energy: 1.7365626765571123
Energy: 1.6980358763433718
Energy: 1.7250045951408346
Energy: 1.685520337380478
Energy: 1.632667033057017
Energy: 1.6980358763421044
Energy: 1.72500459513999
Energy: 1.6855203373796326
Energy: 1.6845025331184997
Energy: 1.6903933756151164
Energy: 1.7448176457341382
Energy: 1.6799813265935668
Energy: 1.6845025331193446
Energy: 1.6903933756155392
Energy: 1.7633414168564576
Energy: 1.678200895773922
Energy: 1.6340587698343867
Energy: 1.8310016088582517
Energy: 1.6408378372889152
Energy: 1.6782008957730772
Energy: 1.6340587698364994
Energy: 1.8310016088582517
Energy: 1.701140123510218
Energy: 1.6971273273141174
Energy: 1.7892696205467913
Energy: 1.6860425746236298
Energy: 1.7011401235127528
Energy: 1.6971273273149625
Energy: 1.8119795246732873
Energy: 1.7658534914283166
Energy: 1.7105598487959968
Energy: 1.7062084806449864
Energy: 1.6480796050851698
Energy: 1.7658534914300066
Energy: 1.710559848795574
Energy: 1.7062084806449864
Energy: 1.7849137249033227
Energy: 1.658371454849897
Energy: 1.7908059073458797
Energy: 1.6589298412488709
Energy: 1.7849137249050127
Energy: 1.6583714548494741
Energy: 1.7946358065019306
Energy: 1.7202667960660432
Energy: 1.6466226776011739
Energy: 1.711637145779356
Energy: 1.6926989123097476
Energy: 1.7202667960673106
Energy: 1.6466226775990613
Energy: 1.7116371457780881
Energy: 1.6658518722117046
Energy: 1.7052767729749327
Energy: 1.8496893861266255
Energy: 1.699836268382305
Energy: 1.6658518722117046
Energy: 1.7052767729753555
Energy: 1.8542913558096676
Energy: 1.677899816702167
Energy: 1.6386467479619664
Energy: 1.87118343969174
Energy: 1.6398283662547242
Energy: 1.677899816700477
Energy: 1.6386467479628115
Energy: 1.8711834396921625
Energy: 1.6840998175011193
Energy: 1.6802399715235978
Energy: 1.7287466798721978
Energy: 1.6908029424397568
Energy: 1.6840998175011193
Energy: 1.680239971524443
Energy: 1.8453080490242333
Energy: 1.7097265869846834
Energy: 1.6324077359218132
Energy: 1.739385400169186
Energy: 1.6999486077684536
Energy: 1.7097265869855283
Energy: 1.6324077359205456
Energy: 1.739385400170031
Energy: 1.6899084226760297
Energy: 1.7859123457740553
Energy: 1.8136570626780044
Energy: 1.6996176283447813
Energy: 1.6899084226760297
Energy: 1.7859123457740553
Energy: 1.7770463509126397
Energy: 1.7025967180166508
Energy: 1.6740166844850863
Energy: 1.7670126798243466
Energy: 1.7056392693385827
Energy: 1.7025967180158057
Energy: 1.6740166844850863
Energy: 1.7670126798247692
Energy: 1.6704084901756464
Energy: 1.6373717885176253
Energy: 1.8140070488906592
Energy: 1.6740183581470613
Energy: 1.6704084901756464
Energy: 1.6373717885155128
Energy: 1.814007048892772
Energy: 1.689775423175201
Energy: 1.715000809897214
Energy: 1.8014037029711816
Energy: 1.7253108693553243
Energy: 1.6897754231747781
Energy: 1.7150008098976366
Energy: 1.8014037029716041

minimum gb energy = 1.62859772476067 eV
minimum distance =  2.21674433719226 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.6514562816717906
Energy: 1.6793883317541627
Energy: 1.8339919236135178
Energy: 1.675890030044879
Energy: 1.6514562816707934
Energy: 1.6793883317521683
Energy: 1.7805424048917962
Energy: 1.630758200645016
Energy: 1.6554963514519603
Energy: 1.73503078921088
Energy: 1.6553371099728071
Energy: 1.6307582006445176
Energy: 1.655496351454952
Energy: 1.7350307892148693
Energy: 1.651286832828307
Energy: 1.5770451019108
Energy: 1.680291553390685
Energy: 1.6049918583528622
Energy: 1.6512868328268109
Energy: 1.5770451019098028
Energy: 1.680291553389189
Energy: 1.6320721298600551
Energy: 1.6554498376922788
Energy: 1.7353997853309855
Energy: 1.7280974462484202
Energy: 1.6320721298600551
Energy: 1.655449837697265
Energy: 1.7353997853314842
Energy: 1.7005445036614613
Energy: 1.6011341839171052
Energy: 1.6596318901169955
Energy: 1.6030769151869193
Energy: 1.7005445036679434
Energy: 1.601134183916108
Energy: 1.5996232485741548
Energy: 1.6474589515819544
Energy: 1.6546909443498594
Energy: 1.6621462671764162
Energy: 1.7232186254895614
Energy: 1.6474589515819544
Energy: 1.6546909443483635
Energy: 1.66214626717492
Energy: 1.8424221609376485
Energy: 1.6025175561959901
Energy: 1.6105742836606516
Energy: 1.6049333323203894
Energy: 1.8424221609381475
Energy: 1.6025175561905052
Energy: 1.629942790565348
Energy: 1.6323997529830792
Energy: 1.6485617409027498
Energy: 1.7277078334688036
Energy: 1.6485237173518543
Energy: 1.6323997529875671
Energy: 1.6485617409032485
Energy: 1.7277078334658114
Energy: 1.842449711962187
Energy: 1.6019428240776927
Energy: 1.7243237358903034
Energy: 1.6025071000253917
Energy: 1.8424497119616883
Energy: 1.6019428240737033
Energy: 1.7243237358883088
Energy: 1.6473384010319883
Energy: 1.7235002561160018
Energy: 1.662197702736562
Energy: 1.65467726145877
Energy: 1.6473384010354786
Energy: 1.7235002561145059
Energy: 1.66219770273357
Energy: 1.7005597221162203
Energy: 1.6032525775132427
Energy: 1.6785063789058134
Energy: 1.6012173180446394
Energy: 1.7005597221172173
Energy: 1.603252577511248
Energy: 1.6878879352278018
Energy: 1.6321639682824494
Energy: 1.7280888996460493
Energy: 1.7356355331428184
Energy: 1.6553893531021358
Energy: 1.6321639682869375
Energy: 1.7280888996450519
Energy: 1.7356355331418214
Energy: 1.6514133764305603
Energy: 1.6049827067189628
Energy: 1.643339164413524
Energy: 1.5769867304682073
Energy: 1.651413376432056
Energy: 1.6049827067194615
Energy: 1.6557077732782266
Energy: 1.6307726922337205
Energy: 1.6552378662467826
Energy: 1.7351471733542383
Energy: 1.6554633373766108
Energy: 1.6307726922352161
Energy: 1.6552378662532652
Energy: 1.7351471733522439
Energy: 1.6514562816722893
Energy: 1.6793883317546614
Energy: 1.7310767510656704
Energy: 1.6758900300443802
Energy: 1.6514562816712919
Energy: 1.6793883317531657
Energy: 1.731076751067166
Energy: 1.630758200645016
Energy: 1.6554963514529575
Energy: 1.73503078921088
Energy: 1.6553371099728071
Energy: 1.6307582006440189
Energy: 1.655496351456448
Energy: 1.7350307892148693
Energy: 1.651286832828307
Energy: 1.5770451019112985
Energy: 1.6618221799269421
Energy: 1.6049918583528622
Energy: 1.6512868328273096
Energy: 1.5770451019098028
Energy: 1.6802915533871943
Energy: 1.6320721298595562
Energy: 1.655449837693276
Energy: 1.7353997853314842
Energy: 1.7280974462474228
Energy: 1.6320721298590575
Energy: 1.6554498376977638
Energy: 1.7353997853314842
Energy: 1.7005445036624582
Energy: 1.601134183917604
Energy: 1.6030482904803929
Energy: 1.6030769151879167
Energy: 1.7005445036684421
Energy: 1.6011341839156092
Energy: 1.6035605364964352
Energy: 1.6474589515819544
Energy: 1.6546909443493607
Energy: 1.6621462671769147
Energy: 1.7232186254880653
Energy: 1.647458951581456
Energy: 1.6546909443478648
Energy: 1.662146267175419
Energy: 1.8424221609376485
Energy: 1.6025175561949927
Energy: 1.629942790565348
Energy: 1.604933332320888
Energy: 1.8424221609386457
Energy: 1.6025175561915026
Energy: 1.593558198773457
Energy: 1.6323997529835779
Energy: 1.6485617409032485
Energy: 1.7277078334688036
Energy: 1.6485237173518543
Energy: 1.6323997529875671
Energy: 1.6485617409032485
Energy: 1.72770783346631
Energy: 1.8424497119636827
Energy: 1.6019428240776927
Energy: 1.6980329047560578
Energy: 1.6025071000253917
Energy: 1.842449711963184
Energy: 1.6019428240737033
Energy: 1.6980329047560578
Energy: 1.6473384010319883
Energy: 1.7235002561174977
Energy: 1.6621977027360633
Energy: 1.6546772614577727
Energy: 1.6473384010354786
Energy: 1.7235002561150046
Energy: 1.6621977027345674
Energy: 1.700559722117716
Energy: 1.6032525775127442
Energy: 1.6878879352263056
Energy: 1.601217318045138
Energy: 1.700559722117716
Energy: 1.6032525775117468
Energy: 1.6842506499152077
Energy: 1.632163968282948
Energy: 1.7280888996455506
Energy: 1.7356355331448132
Energy: 1.6553893531021358
Energy: 1.6321639682869375
Energy: 1.7280888996435562
Energy: 1.735635533143317
Energy: 1.6514133764305603
Energy: 1.6049827067194615
Energy: 1.6569241381655317
Energy: 1.5769867304692047
Energy: 1.6514133764325547
Energy: 1.6049827067189628
Energy: 1.6500744223312713
Energy: 1.6307726922337205
Energy: 1.6552378662472813
Energy: 1.7351471733542383
Energy: 1.655463337376112
Energy: 1.6307726922357149
Energy: 1.6552378662537637
Energy: 1.7351471733527426
Energy: 1.6514562816717906
Energy: 1.6793883317541627
Energy: 1.7310767510666674
Energy: 1.6758900300463748
Energy: 1.6514562816707934
Energy: 1.679388331753664
Energy: 1.7310767510681635
Energy: 1.630758200645016
Energy: 1.6554963514519603
Energy: 1.73503078921088
Energy: 1.6553371099733056
Energy: 1.6307582006445176
Energy: 1.6554963514554508
Energy: 1.7350307892148693

minimum gb energy = 1.5769867304682073 eV
minimum distance =  2.28154055208311 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.684249264379478
Energy: 1.8040802167675878
Energy: 1.7748472228994336
Energy: 1.8052908823004936
Energy: 1.6842492643788727
Energy: 1.8040802167687984
Energy: 1.634803733925333
Energy: 1.6859781336590687
Energy: 1.6554426360439258
Energy: 1.7541008552009176
Energy: 1.6550379247099722
Energy: 1.6859781336566473
Energy: 1.6554426360439258
Energy: 1.7541008552021284
Energy: 1.6848453357322815
Energy: 1.7301885430604318
Energy: 1.7594812216584326
Energy: 1.66858325969557
Energy: 1.6848453357340978
Energy: 1.7301885430592212
Energy: 1.7594812216584326
Energy: 1.647708567619734
Energy: 1.6647361906106626
Energy: 1.7890101820778477
Energy: 1.6342438220068802
Energy: 1.647708567619734
Energy: 1.6647361906088465
Energy: 1.7890101820766369
Energy: 1.6184834724494828
Energy: 1.5788542594194044
Energy: 1.6583814475445577
Energy: 1.6585844138264836
Energy: 1.618483472446456
Energy: 1.578854259418194
Energy: 1.6583814475463738
Energy: 1.6479616805151085
Energy: 1.5980814677050919
Energy: 1.700220890921485
Energy: 1.6608545705032396
Energy: 1.6479616805145032
Energy: 1.5980814677105397
Energy: 1.700220890921485
Energy: 1.7367968651196923
Energy: 1.5795285836561124
Energy: 1.665936193814335
Energy: 1.6575548775112823
Energy: 1.7367968651190873
Energy: 1.5795285836579283
Energy: 1.63521086561979
Energy: 1.6743023665640715
Energy: 1.7134224775834126
Energy: 1.8015644830648325
Energy: 1.6608497483249862
Energy: 1.6743023665640715
Energy: 1.7134224775846234
Energy: 1.8015644830636217
Energy: 1.7215619672375226
Energy: 1.6627520331013743
Energy: 1.678983836054059
Energy: 1.7846789093110953
Energy: 1.7215619672387337
Energy: 1.6627520330995582
Energy: 1.678983836054059
Energy: 1.6561102711939575
Energy: 1.662401435621347
Energy: 1.6245614473820398
Energy: 1.7406636973744412
Energy: 1.6561102711957736
Energy: 1.6624014356219523
Energy: 1.6245614473838559
Energy: 1.7737921800187235
Energy: 1.7895220130374365
Energy: 1.6703062209592354
Energy: 1.6671510397385618
Energy: 1.7737921800187235
Energy: 1.7895220130374365
Energy: 1.6774150495208926
Energy: 1.5651287445893685
Energy: 1.6913978879603688
Energy: 1.6368446275911963
Energy: 1.6343141562222347
Energy: 1.5651287445905793
Energy: 1.6913978879597633
Energy: 1.6368446275905908
Energy: 1.774088151609917
Energy: 1.6473752932150278
Energy: 1.6378064771338932
Energy: 1.6692214138112729
Energy: 1.7740881516105225
Energy: 1.6473752932132122
Energy: 1.6378064771320775
Energy: 1.5650662251483045
Energy: 1.6912194623577181
Energy: 1.679899608442267
Energy: 1.6996830819294284
Energy: 1.5650662251458833
Energy: 1.6912194623577181
Energy: 1.679899608442267
Energy: 1.752457385188861
Energy: 1.5923504316399169
Energy: 1.6257283294725495
Energy: 1.633389345908021
Energy: 1.752457385188861
Energy: 1.5923504316399169
Energy: 1.6257283294707336
Energy: 1.5569101673137005
Energy: 1.7320175001403229
Energy: 1.6142818767927296
Energy: 1.6262269432128826
Energy: 1.556910167314306
Energy: 1.7320175001409284
Energy: 1.614281876791519
Energy: 1.7533239104618061
Energy: 1.5925594503249962
Energy: 1.6166362532987195
Energy: 1.6331499715192694
Energy: 1.753323910461201
Energy: 1.5925594503249962
Energy: 1.6166362532975087
Energy: 1.556984826772333
Energy: 1.666362101180343
Energy: 1.619280813727715
Energy: 1.7213436295400455
Energy: 1.556984826772333
Energy: 1.6663621011815535
Energy: 1.6192808137301364
Energy: 1.6838102153599637
Energy: 1.6379170516410544
Energy: 1.6945917004348532
Energy: 1.6334210991607556
Energy: 1.6838102153581476
Energy: 1.63791705164166
Energy: 1.6945917004372748
Energy: 1.5566559415366577
Energy: 1.7155123569254358
Energy: 1.5999196470991348
Energy: 1.715479249325769
Energy: 1.5566559415360526
Energy: 1.7155123569266466
Energy: 1.599919647100951
Energy: 1.684018474992966
Energy: 1.6334446127826596
Energy: 1.6944772925209879
Energy: 1.5914519472266262
Energy: 1.684018474994782
Energy: 1.6334446127826596
Energy: 1.6944772925215934
Energy: 1.5569353427735029
Energy: 1.7213898368081084
Energy: 1.619304646719742
Energy: 1.666160630276511
Energy: 1.5569353427741082
Energy: 1.7213898368081084
Energy: 1.6193046467209524
Energy: 1.7531824574143702
Energy: 1.6332822582985453
Energy: 1.6165290169757685
Energy: 1.5925037483178808
Energy: 1.7531824574143702
Energy: 1.633282258299756
Energy: 1.616529016976374
Energy: 1.5570412605013995
Energy: 1.625798667999293
Energy: 1.6143262996415115
Energy: 1.7318782469147556
Energy: 1.5570412604996111
Energy: 1.6257986680011092
Energy: 1.6143262996415115
Energy: 1.7526415628750853
Energy: 1.6333472888243445
Energy: 1.651566906742587
Energy: 1.5921892243009497
Energy: 1.7526415628732692
Energy: 1.6333472888243445
Energy: 1.6515669067413767

minimum gb energy = 1.5566559415360526 eV
minimum distance =  2.25630018612861 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.660950557259498
Energy: 1.7887832290666883
Energy: 1.637327553058849
Energy: 1.7797309364626197
Energy: 1.660950557259498
Energy: 1.7887832290700667
Energy: 1.6309666080758554
Energy: 1.784590688035298
Energy: 1.7138441874623032
Energy: 1.8071184715206106
Energy: 1.7471080777990828
Energy: 1.7845906880319196
Energy: 1.7138441874589248
Energy: 1.8071184715206106
Energy: 1.7156688686336241
Energy: 1.7526370068102106
Energy: 1.78065797045917
Energy: 1.7206948324798275
Energy: 1.7156688686302457
Energy: 1.752637006813589
Energy: 1.7806579704557919
Energy: 1.6610509509990705
Energy: 1.7741685056279413
Energy: 1.8377797723656533
Energy: 1.7065501493008508
Energy: 1.6610509509990705
Energy: 1.774168505624563
Energy: 1.8377797723656533
Energy: 1.7127191769608523
Energy: 1.632893843413498
Energy: 1.6318970108765583
Energy: 1.6908606442177232
Energy: 1.7127191769574739
Energy: 1.632893843413498
Energy: 1.6318970108799367
Energy: 1.630828703370649
Energy: 1.7746811345656197
Energy: 1.7821200788763838
Energy: 1.6346867729615164
Energy: 1.6308287033672706
Energy: 1.7746811345656197
Energy: 1.7821200788763838
Energy: 1.6430579681341462
Energy: 1.635805753473831
Energy: 1.7156721656697187
Energy: 1.643521007214367
Energy: 1.6430579681341462
Energy: 1.635805753467074
Energy: 1.7156721656764753
Energy: 1.627874059212892
Energy: 1.7330124652370396
Energy: 1.7774979418816512
Energy: 1.6514542378845751
Energy: 1.6278740592162702
Energy: 1.7330124652404177
Energy: 1.7774979418816512
Energy: 1.6212031652313872
Energy: 1.6639405567860783
Energy: 1.7742954503613098
Energy: 1.6582217147477873
Energy: 1.6212031652313872
Energy: 1.6639405567860783
Energy: 1.774295450347858
Energy: 1.645639624777965
Energy: 1.714499631328767
Energy: 1.7616488825433767
Energy: 1.648351444925758
Energy: 1.645639624777965
Energy: 1.7144996313321454
Energy: 1.7616488825399983
Energy: 1.65394828632304
Energy: 1.7037857148706692
Energy: 1.8334674405470168
Energy: 1.6895663100977867
Energy: 1.6539482863196615
Energy: 1.7037857148672908
Energy: 1.8334674405470168
Energy: 1.6763552319087969
Energy: 1.7157021066135727
Energy: 1.9012078234424958
Energy: 1.67784166301938
Energy: 1.6763552319087969
Energy: 1.7157021066203293
Energy: 1.9012078234391177
Energy: 1.754267222584845
Energy: 1.723106738199246
Energy: 1.851278605433893
Energy: 1.700082023950396
Energy: 1.7542672225780882
Energy: 1.723106738199246
Energy: 1.851278605433893
Energy: 1.7024401551797357
Energy: 1.7944466522105196
Energy: 1.8666630313808523
Energy: 1.7750828583887925
Energy: 1.7024401551797357
Energy: 1.794446652213898
Energy: 1.8666630313808523
Energy: 1.7547943941388158
Energy: 1.7290692126141103
Energy: 1.8885339664159497
Energy: 1.7577530267081654
Energy: 1.7547943941421942
Energy: 1.7290692126107319
Energy: 1.8885339664193281
Energy: 1.730051154134867
Energy: 1.7160356052516552
Energy: 1.7874650921704371
Energy: 1.717602859295958
Energy: 1.730051154134867
Energy: 1.7160356052550336
Energy: 1.7874650921704371
Energy: 1.7754077407505189
Energy: 1.7327679730136025
Energy: 1.8873646957060681
Energy: 1.7066364674810288
Energy: 1.7754077407572142
Energy: 1.7327679730136025
Energy: 1.8873646957026897
Energy: 1.6861906223980085
Energy: 1.688045507782834
Energy: 1.7450643295206334
Energy: 1.6639914428629516
Energy: 1.686190622391252
Energy: 1.6880455077862122
Energy: 1.7450643295273902
Energy: 1.7836611623539906
Energy: 1.708533994560245
Energy: 1.8170528350073532
Energy: 1.7267408341423622
Energy: 1.783661162357369
Energy: 1.7085339945568665
Energy: 1.8524274657128312
Energy: 1.5906612497789927
Energy: 1.7099775014768988
Energy: 1.7804444654309082
Energy: 1.6330404259292297
Energy: 1.5906612497789927
Energy: 1.709977501480277
Energy: 1.7804444654342866
Energy: 1.632684893913396
Energy: 1.622082376257761
Energy: 1.7866298509917138
Energy: 1.7390892175812183
Energy: 1.632684893903261
Energy: 1.622082376257761
Energy: 1.7866298509917138
Energy: 1.5947009212788759
Energy: 1.6652574212314648
Energy: 1.6988032059099984
Energy: 1.632107801647028
Energy: 1.5947009212754975
Energy: 1.6652574212314648
Energy: 1.69880320590662
Energy: 1.6699325960558082
Energy: 1.6495320347637958
Energy: 1.7780652522172098
Energy: 1.7788553799289788
Energy: 1.6699325960524296
Energy: 1.6495320347637958
Energy: 1.778065252220588
Energy: 1.6640835734423607
Energy: 1.6626436905625939
Energy: 1.7296283338214278
Energy: 1.6682794872649735
Energy: 1.664083573445739
Energy: 1.6626436905625939
Energy: 1.7296283338214278
Energy: 1.652213896000552
Energy: 1.7088694872431296
Energy: 1.7367626018343139
Energy: 1.84771706533709
Energy: 1.6522138959971733
Energy: 1.7088694872397512
Energy: 1.736762601837692
Energy: 1.6629051413364364
Energy: 1.7855816969539897
Energy: 1.7655999915337868
Energy: 1.706889818518753
Energy: 1.662905141333058
Energy: 1.7855816969539897
Energy: 1.7655999915337868
Energy: 1.7121722443087015
Energy: 1.69312638180181
Energy: 1.663058956582633
Energy: 1.8818823713552348
Energy: 1.712172244305323
Energy: 1.69312638180181
Energy: 1.663058956582633
Energy: 1.6889957299650509
Energy: 1.8460379737460457
Energy: 1.762221663526075
Energy: 1.812521287248032
Energy: 1.6889957299650509
Energy: 1.8460379737494241
Energy: 1.7622216635226968
Energy: 1.7761113279838876
Energy: 1.6887280879045459
Energy: 1.7898493917242915
Energy: 1.8449569820543366
Energy: 1.7761113279872658
Energy: 1.6887280879079245
Energy: 1.7898493917242915
Energy: 1.656527177573404
Energy: 1.7586757546977867
Energy: 1.7555329418755672
Energy: 1.7900583968715067
Energy: 1.6565271775700257
Energy: 1.7586757546977867
Energy: 1.7555329418789454
Energy: 1.6567977200744166
Energy: 1.7012076939386471
Energy: 1.8069574784291516
Energy: 1.7900338283342732
Energy: 1.6567977200744166
Energy: 1.7012076939420253
Energy: 1.80695747843253
Energy: 1.659155688310973
Energy: 1.6282991888757634
Energy: 1.7094114468858224
Energy: 1.7175575189956196
Energy: 1.659155688310973
Energy: 1.6282991888690068
Energy: 1.7094114468858224
Energy: 1.6208818892050876
Energy: 1.682852307811796
Energy: 1.828728555368883
Energy: 1.7204486383598858
Energy: 1.6208818892050876
Energy: 1.682852307811796
Energy: 1.828728555368883
Energy: 1.6349959696963023
Energy: 1.6376347515480048
Energy: 1.6829265686871455
Energy: 1.6359337080030893
Energy: 1.6349959696929237
Energy: 1.6376347515480048
Energy: 1.682926568690524
Energy: 1.620912707649968
Energy: 1.6115550937996224
Energy: 1.7763075736786236
Energy: 1.7167062822500883
Energy: 1.6209127076567247
Energy: 1.611555093796244
Energy: 1.7763075736786236
Energy: 1.615871075476691
Energy: 1.6287508577236152
Energy: 1.6587738116248123
Energy: 1.6212201731480578
Energy: 1.6158710754800694
Energy: 1.6287508577202368
Energy: 1.6587738116248123
Energy: 1.6201371383593453
Energy: 1.6491000414626957
Energy: 1.792962841539596
Energy: 1.7198097591824946
Energy: 1.6201371383627237
Energy: 1.6491000414593173
Energy: 1.7929628415429744
Energy: 1.6215265208505387
Energy: 1.6225554159189457
Energy: 1.7631697260356527
Energy: 1.6594780216905347
Energy: 1.6215265208539171
Energy: 1.622555415922324
Energy: 1.7631697260356527
Energy: 1.652270929369341
Energy: 1.680566681303243
Energy: 1.9041789747083206
Energy: 1.7402187652372614
Energy: 1.6522709293727194
Energy: 1.6805666812998648
Energy: 1.9041789747083206
Energy: 1.6663154388410144
Energy: 1.7066291689604698
Energy: 1.7759784734785748
Energy: 1.6989425301414696
Energy: 1.6663154388443928
Energy: 1.7066291689604698
Energy: 1.7759784734785748
Energy: 1.7376024053691546
Energy: 1.6806592152815032
Energy: 1.8671553890285886
Energy: 1.7629553233409792
Energy: 1.7376024053725332
Energy: 1.6806592152848816
Energy: 1.867155389031967
Energy: 1.6663551033931552
Energy: 1.682319517949786
Energy: 1.85012167250106
Energy: 1.73987274442902
Energy: 1.6663551033965336
Energy: 1.682319517949786
Energy: 1.85012167250106
Energy: 1.7192003587051672
Energy: 1.680013588594717
Energy: 1.8383393940347708
Energy: 1.7781085789397881
Energy: 1.7192003586984106
Energy: 1.6800135885980951
Energy: 1.8383393940347708
Energy: 1.7150255154183527
Energy: 1.6778932207656994
Energy: 1.8786044056552131
Energy: 1.6009955008759345
Energy: 1.7150255154149743
Energy: 1.6778932207589428
Energy: 1.8786044056484563
Energy: 1.6101956157901562
Energy: 1.681818305750567
Energy: 1.787033153034091
Energy: 1.7281823151355284
Energy: 1.6101956157935344
Energy: 1.681818305750567
Energy: 1.7870331530374695

minimum gb energy = 1.5906612497789927 eV
minimum distance =  2.20510805845174 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.7268365393098029
Energy: 1.3400406538810712
Energy: 1.4672862054998153
Energy: 1.3400406538810712
Energy: 1.7268365393113263
Energy: 1.3400406538825946
Energy: 1.3797087306101206
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.5728249195341601
Energy: 1.340040653884118
Energy: 1.7268365393105645
Energy: 1.3400406538825946
Energy: 1.3174903722931584
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.4333327376170615
Energy: 1.3400406538833565
Energy: 1.7268365393098029
Energy: 1.3400406538825946
Energy: 1.4096846487609043
Energy: 1.7268365393098029
Energy: 1.340040653881833
Energy: 1.8059348982946355
Energy: 1.3400406538825946
Energy: 1.726836539312088
Energy: 1.340040653881833
Energy: 1.6495277607136563
Energy: 1.7268365393128497
Energy: 1.340040653881833
Energy: 1.446751004614841
Energy: 1.340040653881833
Energy: 1.7268365393105645
Energy: 1.340040653881833
Energy: 1.4992994298134716
Energy: 1.726836539312088
Energy: 1.340040653884118
Energy: 1.3796782343283025
Energy: 1.3400406538810712
Energy: 1.7268365393105645
Energy: 1.3400406538833565
Energy: 1.3126071961282346
Energy: 1.7268365393098029
Energy: 1.3400406538825946
Energy: 1.7516092243452002
Energy: 1.3400406538825946
Energy: 1.726836539312088
Energy: 1.3400406538810712
Energy: 1.6495277603390768
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3127284186723036
Energy: 1.3400406538810712
Energy: 1.7268365393105645
Energy: 1.340040653881833
Energy: 1.380144013274566
Energy: 1.726836539312088
Energy: 1.3400406538833565
Energy: 1.5993433357063107
Energy: 1.3400406538833565
Energy: 1.7268365393098029
Energy: 1.3400406538833565
Energy: 1.3127283001447982
Energy: 1.7268365393098029
Energy: 1.3400406538810712
Energy: 1.3174778000012042
Energy: 1.3400406538803096
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3796814341396548
Energy: 1.726836539312088
Energy: 1.3400406538833565
Energy: 1.3174930598970243
Energy: 1.3400406538825946
Energy: 1.7268365393105645
Energy: 1.3400406538810712
Energy: 1.3174885633978337
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3798164876978585
Energy: 1.340040653881833
Energy: 1.7268365393105645
Energy: 1.3400406538825946
Energy: 1.3798146527292379
Energy: 1.7268365393090412
Energy: 1.340040653881833
Energy: 1.3174917641608506
Energy: 1.3400406538825946
Energy: 1.7268365393113263
Energy: 1.3400406538803096
Energy: 1.3174879896813874
Energy: 1.7268365393128497
Energy: 1.340040653881833
Energy: 1.31749182756715
Energy: 1.340040653881833
Energy: 1.7268365393105645
Energy: 1.340040653881833
Energy: 1.3174911715346802
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3174886710159404
Energy: 1.3400406538825946
Energy: 1.7268365393105645
Energy: 1.340040653881833
Energy: 1.3174890875410292
Energy: 1.7268365393098029
Energy: 1.3400406538810712
Energy: 1.317487155706931
Energy: 1.3400406538825946
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3174955985375345
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3174877445080586
Energy: 1.3400406538825946
Energy: 1.7268365393105645
Energy: 1.340040653881833
Energy: 1.3174899941052596
Energy: 1.726836539312088
Energy: 1.3400406538810712
Energy: 1.3174751408985954
Energy: 1.340040653881833
Energy: 1.7268365393105645
Energy: 1.3400406538825946
Energy: 1.3174899433686287
Energy: 1.7268365393090412
Energy: 1.3400406538810712
Energy: 1.3174799455465047
Energy: 1.3400406538825946
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3174705002500444
Energy: 1.726836539312088
Energy: 1.3400406538825946
Energy: 1.3174909293542116
Energy: 1.340040653881833
Energy: 1.7268365393098029
Energy: 1.340040653881833
Energy: 1.3174945175700683

minimum gb energy = 1.3126071961282346 eV
minimum distance =  2.37488851416453 Angstroms
sigma value = 23