Model name: model_name=EAM_Dynamo_ErcolessiAdams_1994_Al__MO_123629422045_005
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=4.032082033157349
cohesive_energy=3.360264254236775
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: 0.011810529076974047
Energy: 0.186792066612318
Energy: 0.186792066612318
Energy: 0.011810529078135975
Energy: 0.186792066612318
Energy: 0.186792066612318
Energy: 0.011810529078135975
Energy: 0.186792066612318
Energy: 0.186792066612318
Energy: 0.011810529076974047
Energy: 0.18602172879353274
Energy: 0.012361447793107555
Energy: 0.7693834229848869
Energy: 0.18602172879353274
Energy: 0.012361447794269483
Energy: 0.7693834229848869
Energy: 0.18602172879353274
Energy: 0.012361447794269483
Energy: 0.7693834229848869
Energy: 0.18602172879353274
Energy: 0.18602172879353274
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090920639726
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.18602172879353274
Energy: 0.7693834229848869
Energy: 0.012361447794269483
Energy: 0.18602172879237083
Energy: 0.7693834229848869
Energy: 0.012361447794269483
Energy: 0.18602172879237083
Energy: 0.7693834229848869
Energy: 0.012361447794269483
Energy: 0.18602172879237083
Energy: 0.011810529078135975
Energy: 0.18679206661115608
Energy: 0.18679206661115608
Energy: 0.011810529078135975
Energy: 0.186792066612318
Energy: 0.18679206661115608
Energy: 0.011810529078135975
Energy: 0.18679206661115608
Energy: 0.18679206661115608
Energy: 0.011810529078135975
Energy: 0.18602172879353274
Energy: 0.012361447794269483
Energy: 0.7693834229848869
Energy: 0.18602172879353274
Energy: 0.012361447794269483
Energy: 0.7693834229848869
Energy: 0.18602172879353274
Energy: 0.012361447794269483
Energy: 0.7693834229848869
Energy: 0.18602172879237083
Energy: 0.18602172879237083
Energy: 0.012727090921801652
Energy: 0.012727090920639726
Energy: 0.012727090920639726
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090921801652
Energy: 0.012727090920639726
Energy: 0.012727090920639726

minimum gb energy = 0.011810529076974047 eV
minimum distance =  2.84433919894358 Angstroms
sigma value = 3


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

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Energy: 0.6091610775215492
Energy: 0.5917356660084349
Energy: 0.4954906391542548
Energy: 0.6091610775221185
Energy: 0.5917356660078656
Energy: 0.5071407788562857
Energy: 0.6091610775218338
Energy: 0.5917356660101426
Energy: 0.4954906391542548
Energy: 0.5765747981048879
Energy: 0.483617170513017
Energy: 0.5643325145424496
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Energy: 0.4836171705110246
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Energy: 0.44930372043081673
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Energy: 0.449262642379733
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Energy: 0.5570506905404333
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Energy: 0.4283713819790945
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Energy: 0.5337589665608106
Energy: 0.559570432985867
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Energy: 0.533758966564226
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Energy: 0.5561571190000384
Energy: 0.4839109033103282
Energy: 0.4771397163961874
Energy: 0.5561571189991847
Energy: 0.48392323737223103
Energy: 0.4771397163944798
Energy: 0.5561571189997538
Energy: 0.4839109033095003
Energy: 0.4771397164004566
Energy: 0.4733859635543808
Energy: 0.6091610775235415
Energy: 0.591735666007581
Energy: 0.47374894428418146
Energy: 0.6091610775229723
Energy: 0.5917356660090041
Energy: 0.47338596354555773
Energy: 0.6091610775229723
Energy: 0.5917356660098579
Energy: 0.47374894428475073
Energy: 0.5765747981071648
Energy: 0.48361717051387076
Energy: 0.5643325145435881
Energy: 0.5765747981051725
Energy: 0.48361717051273234
Energy: 0.5643325145430188
Energy: 0.5765747981085879
Energy: 0.4836171705141554
Energy: 0.5643325145404573
Energy: 0.576574798106311
Energy: 0.5113981038511658
Energy: 0.5820001197949896
Energy: 0.5854211935816114
Energy: 0.5098693788834666
Energy: 0.5820001197966972
Energy: 0.5854211939932654
Energy: 0.5113981038531582
Energy: 0.5820001197958432
Energy: 0.585421193827129
Energy: 0.5098693788823281
Energy: 0.6075239921634326
Energy: 0.6190985688732958
Energy: 0.4493037204299629
Energy: 0.6075239921640018
Energy: 0.6190985688724421
Energy: 0.4493037204279706
Energy: 0.6075239921648555
Energy: 0.6190985688704498
Energy: 0.4493037204274014
Energy: 0.6075239921617249

minimum gb energy = 0.4283713819790945 eV
minimum distance =  2.5566357377026 Angstroms
sigma value = 75


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

Energy: 0.5084845398036378
Energy: 0.4714856911940636
Energy: 0.47096711008855835
Energy: 0.48626373024527864
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minimum gb energy = 0.4701574205738065 eV
minimum distance =  2.5659474128887 Angstroms
sigma value = 105


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

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Energy: 0.5098349721387964
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Energy: 0.4734967215085348
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Energy: 0.5158967166465215
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Energy: 0.4980576331575759
Energy: 0.47301519150337046
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Energy: 0.4730151915044814
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Energy: 0.5280540316018244
Energy: 0.47301519150636157
Energy: 0.5044189508992847
Energy: 0.5171318658369178
Energy: 0.48368464327537497
Energy: 0.5044189508980311
Energy: 0.5171148998588515
Energy: 0.48368464327412153
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Energy: 0.5171318658381712
Energy: 0.4836846432731815
Energy: 0.5044189508959802
Energy: 0.49049806340591734
Energy: 0.5182959313883798
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Energy: 0.4904980634046639
Energy: 0.5181906555167679
Energy: 0.5460276094133513
Energy: 0.4904980634019861
Energy: 0.5182959313843064
Energy: 0.5460276094147756
Energy: 0.49049806340372387
Energy: 0.5161893606263411
Energy: 0.4940432533177997
Energy: 0.5018819346428774
Energy: 0.5161893606260278
Energy: 0.49404325331905313
Energy: 0.5018819346439883
Energy: 0.5161893606282212
Energy: 0.4940432533191956
Energy: 0.5018819346441309
Energy: 0.5161893606304147
Energy: 0.4949961546378732
Energy: 0.5356846654389193
Energy: 0.5070463799661129
Energy: 0.4949961546386708
Energy: 0.5354879779324073
Energy: 0.5070463799656572
Energy: 0.4949961546389842
Energy: 0.5356846654376661
Energy: 0.5070463799640903
Energy: 0.49499615463755986
Energy: 0.5354620769444618
Energy: 0.5264059172673
Energy: 0.556758931561309
Energy: 0.5354620769444618
Energy: 0.5263078207999369
Energy: 0.5567589315642716
Energy: 0.5354620769474528
Energy: 0.5264059172702625
Energy: 0.5567589315630181
Energy: 0.5354620769466552
Energy: 0.5508981513811069
Energy: 0.4727701135405782
Energy: 0.5205381688368064
Energy: 0.550898151379711
Energy: 0.4727769893918401
Energy: 0.5205381688369488
Energy: 0.5508981513768908
Energy: 0.47277011353855564
Energy: 0.520538168835553
Energy: 0.5508981513764065

minimum gb energy = 0.4724918497190396 eV
minimum distance =  2.55336001362322 Angstroms
sigma value = 165


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

Energy: 0.47743092798045744
Energy: 0.47082122650009595
Energy: 0.4704919461811679
Energy: 0.45424282005398836
Energy: 0.47082122649955804
Energy: 0.47049194618063006
Energy: 0.47743092797615444
Energy: 0.47082122649902014
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Energy: 0.45424282005398836
Energy: 0.5379253268385298
Energy: 0.4873512346065861
Energy: 0.549997994247726
Energy: 0.5379253268385298
Energy: 0.4873512346060482
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Energy: 0.5379253268401434
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Energy: 0.5499979942455745
Energy: 0.5379253268379919
Energy: 0.4502974392266722
Energy: 0.44142477874587577
Energy: 0.4584399724964087
Energy: 0.45029743922559645
Energy: 0.4414247787431865
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Energy: 0.46586739443028286
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Energy: 0.45768271832449553
Energy: 0.46586744125294993
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Energy: 0.45768271832449553
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Energy: 0.503651434465813
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Energy: 0.455053642349809
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Energy: 0.48298957072083454
Energy: 0.5574339409310777
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Energy: 0.5574339409326914
Energy: 0.45478439235985285
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Energy: 0.5574339409321535
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Energy: 0.4829895707202967
Energy: 0.5066737985191256
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Energy: 0.5371447239486673
Energy: 0.4845236500185066
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Energy: 0.5066737985212771
Energy: 0.5035285571713676
Energy: 0.5371447239481294
Energy: 0.48452365001958236
Energy: 0.4644008833963435
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Energy: 0.4765040855029957
Energy: 0.442040455093929
Energy: 0.4573234603680794
Energy: 0.43658122358942236
Energy: 0.4644008833974193
Energy: 0.4573234603670282
Energy: 0.4765040855040715
Energy: 0.4420404550923153
Energy: 0.5044612226466961
Energy: 0.45863692095448444
Energy: 0.5128563792312137
Energy: 0.5044612226456204
Energy: 0.458636920956098
Energy: 0.5128563792312137
Energy: 0.5044612226488477
Energy: 0.45863692095556013
Energy: 0.512856379230676
Energy: 0.5044612226504612
Energy: 0.4703929921159179
Energy: 0.45901998143945705
Energy: 0.4679939293068373
Energy: 0.47039299211538005
Energy: 0.45901998143891914
Energy: 0.4679939293030722
Energy: 0.47039299211538005
Energy: 0.45901998144053274
Energy: 0.4679939293052237
Energy: 0.4703929921148422
Energy: 0.5165989481709671
Energy: 0.5125694335578062
Energy: 0.45629438153115126
Energy: 0.5165989481714804
Energy: 0.512569433558882
Energy: 0.45629438153007557
Energy: 0.5165989481709671
Energy: 0.5125694335583441
Energy: 0.45629438153115126
Energy: 0.5165989481714804
Energy: 0.45424282005560196
Energy: 0.47082122649740665
Energy: 0.4704919461817058
Energy: 0.4542428200545262
Energy: 0.47082122649740665
Energy: 0.47049194617796514
Energy: 0.45424282005560196
Energy: 0.47082122649740665
Energy: 0.4704919461811679
Energy: 0.4542428200545262

minimum gb energy = 0.43658122358942236 eV
minimum distance =  2.63300829388406 Angstroms
sigma value = 41


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

Energy: 0.49578900929869196
Energy: 0.42613762276816347
Energy: 0.42840996823280864
Energy: 0.462286425175109
Energy: 0.42613762276065065
Energy: 0.4284099682323912
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Energy: 0.4500808068402704
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Energy: 0.3970517332267992
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Energy: 0.4014143158763972
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Energy: 0.44533485414765506
Energy: 0.39447990776241565
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Energy: 0.3997573519544135
Energy: 0.4153435134468685
Energy: 0.4147231577712463
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Energy: 0.41541156931311807
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Energy: 0.399757351953389
Energy: 0.4153435134499798
Energy: 0.41472315776604807
Energy: 0.39975735195357875
Energy: 0.4121326925967801
Energy: 0.4120808323816289
Energy: 0.3959723121626079
Energy: 0.41213269259867735
Energy: 0.41210887481681063
Energy: 0.3959723121659469
Energy: 0.4121326925978425
Energy: 0.4120808323876999
Energy: 0.3959723121659469
Energy: 0.41213269259636276
Energy: 0.4248634847338385
Energy: 0.41082899891729524
Energy: 0.39785156223605944
Energy: 0.42486348473444563
Energy: 0.41069638177775775
Energy: 0.3978515622389811
Energy: 0.42486348473694985
Energy: 0.4108289989191924
Energy: 0.39785156224209245
Energy: 0.4248634847346732
Energy: 0.4375700781881182
Energy: 0.3997146074348018
Energy: 0.40523349159424593
Energy: 0.4375700781927094
Energy: 0.39971460742979326
Energy: 0.4052334915967502
Energy: 0.43757007818959803
Energy: 0.3997146074354089
Energy: 0.40523349159906474
Energy: 0.43757007818895305

minimum gb energy = 0.38703272803566957 eV
minimum distance =  2.57763049149963 Angstroms
sigma value = 185


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

Energy: 0.27124553927358824
Energy: 0.24201892066153363
Energy: 0.2420570529243927
Energy: 0.14332926202835466
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Energy: 0.16555405216151883
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Energy: 0.32536988405760076
Energy: 0.22136993857291523
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Energy: 0.18482776294871758
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Energy: 0.22136993857021284
Energy: 0.23596970422410216
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Energy: 0.19030967522064834
Energy: 0.24945815386519943
Energy: 0.16489840910568868
Energy: 0.17574394211889094
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Energy: 0.186250588122438
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Energy: 0.2501051001210513
Energy: 0.22774431544551746
Energy: 0.2827192353248677
Energy: 0.2501051001208036
Energy: 0.22774431544650836

minimum gb energy = 0.14332926202835466 eV
minimum distance =  2.66530569982404 Angstroms
sigma value = 33


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

Energy: 0.37465360945667336
Energy: 0.4061112592628673
Energy: 0.4061465521056038
Energy: 0.3638155079335351
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minimum gb energy = 0.3438957606068528 eV
minimum distance =  2.55399481689218 Angstroms
sigma value = 219


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

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Energy: 0.4993248525622518
Energy: 0.5168319270940187
Energy: 0.4952483322604359
Energy: 0.4993248525622518
Energy: 0.5168319270940187

minimum gb energy = 0.4122606954967796 eV
minimum distance =  2.62538072402058 Angstroms
sigma value = 15


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

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minimum gb energy = 0.48035152707188006 eV
minimum distance =  2.57536119617644 Angstroms
sigma value = 293


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

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Energy: 0.509360101878796
Energy: 0.5466337315082348
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Energy: 0.5157434119412054
Energy: 0.5093601018785926
Energy: 0.5466337315094545
Energy: 0.4902677509249929
Energy: 0.5520251830235336
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Energy: 0.49026775092356983
Energy: 0.5520251830247533
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Energy: 0.4902677509249929
Energy: 0.5520251830253633
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Energy: 0.49026775092438307
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Energy: 0.5197287288296081
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Energy: 0.5720512676112561
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Energy: 0.4963046613859077
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Energy: 0.496304661385501
Energy: 0.5720512676104429
Energy: 0.509882404898967
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Energy: 0.48898011633074934
Energy: 0.5098824049001868
Energy: 0.5524822260581753
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Energy: 0.5524822260589884
Energy: 0.48898011633095256
Energy: 0.50988240490039
Energy: 0.4864023843818771
Energy: 0.48554317347478887
Energy: 0.4959860139153537
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Energy: 0.48554317347682185
Energy: 0.4959860139157603
Energy: 0.48640238438106387
Energy: 0.5660410908322062
Energy: 0.5541350344973687
Energy: 0.4901920463423047
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Energy: 0.4901920463398651
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Energy: 0.5665561514229952
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Energy: 0.5714262483331106
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Energy: 0.5140252109887959
Energy: 0.5431649334304344
Energy: 0.49061924244681887
Energy: 0.5317163620727209
Energy: 0.5431649334296212
Energy: 0.4906192424455992
Energy: 0.5317163620739407
Energy: 0.5431649334304344
Energy: 0.49061924244600574
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Energy: 0.5431649334296212
Energy: 0.4907710830491477
Energy: 0.48933237744294183
Energy: 0.4908320925834078
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Energy: 0.48952433934258477
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Energy: 0.490771083049961
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Energy: 0.49083209258503424
Energy: 0.49077108304975764
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Energy: 0.4892188673038798
Energy: 0.6364050060698617
Energy: 0.5031815148161894
Energy: 0.48912133011834075
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Energy: 0.5031815148155795
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Energy: 0.555245926527629
Energy: 0.5002361677605439
Energy: 0.5283858667235697
Energy: 0.5552459265296433
Energy: 0.5002361677631867
Energy: 0.5283858667227566
Energy: 0.5552459265296433
Energy: 0.5002361677637966
Energy: 0.5283858667235697
Energy: 0.5552459265264091
Energy: 0.5731435582681894
Energy: 0.5074339868862898
Energy: 0.5201416478490826
Energy: 0.573143558267173
Energy: 0.5074339868862898
Energy: 0.5201121281088157
Energy: 0.5731435582692059
Energy: 0.5074339868887294
Energy: 0.5201416478452201
Energy: 0.5731435582681894
Energy: 0.48954667193752344
Energy: 0.5653641594850978
Energy: 0.5847805270982754
Energy: 0.4895466719383366
Energy: 0.5653641594867242
Energy: 0.5847805270978689
Energy: 0.4895466719387433
Energy: 0.5653641594863177
Energy: 0.5847805270984788
Energy: 0.4895466719373202
Energy: 0.5466337315057953
Energy: 0.5158317041486983
Energy: 0.5093513522796846
Energy: 0.5466337315088446
Energy: 0.5158617950214177
Energy: 0.5093515882022689
Energy: 0.5466337315072184
Energy: 0.5158317041501213
Energy: 0.5093513522804979
Energy: 0.5466337315096579
Energy: 0.49026775092438307
Energy: 0.5520251830241435
Energy: 0.5612400959370059
Energy: 0.4902677509233666
Energy: 0.55202518302516
Energy: 0.5612400959376157
Energy: 0.49026775092458635
Energy: 0.5520251830253633
Energy: 0.5612400959370059
Energy: 0.49026775092417973
Energy: 0.549308644754327
Energy: 0.5197287288296081
Energy: 0.5444932439369075
Energy: 0.5493086447539204
Energy: 0.5197287288318443
Energy: 0.5444932439360942
Energy: 0.5493086447567666
Energy: 0.5197287288320475
Energy: 0.5444932439354845
Energy: 0.5493086447567666
Energy: 0.5720512676122727
Energy: 0.5548699013741243
Energy: 0.4963764495426318
Energy: 0.5720512676132891
Energy: 0.5548699013743277
Energy: 0.4963705865133942
Energy: 0.5720512676132891
Energy: 0.5548699013757507
Energy: 0.4963764495385659
Energy: 0.5720512676108495
Energy: 0.50988240490039
Energy: 0.552482226057972
Energy: 0.488980116330546
Energy: 0.5098824049007966
Energy: 0.5524822260581753
Energy: 0.48898011633095256
Energy: 0.5098824048991704
Energy: 0.5524822260589884
Energy: 0.4889801163299362
Energy: 0.5098824049014066

minimum gb energy = 0.48554317347478887 eV
minimum distance =  2.57579807234509 Angstroms
sigma value = 293


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

Energy: 0.49370990712846774
Energy: 0.49425801282882165
Energy: 0.4941421570234995
Energy: 0.493709907126998
Energy: 0.4942580128291891
Energy: 0.4941421570220298
Energy: 0.4937099071277328
Energy: 0.49425801282808673
Energy: 0.4941421570253367
Energy: 0.49370990712589574
Energy: 0.4940868136273044
Energy: 0.49395745639912075
Energy: 0.4946209604062767
Energy: 0.4940868136273044
Energy: 0.49395745640022304
Energy: 0.49462096040443954
Energy: 0.4940868136284067
Energy: 0.49395745639912075
Energy: 0.4946209604059093
Energy: 0.4940868136280392
Energy: 0.4937487921792951
Energy: 0.49398743389074024
Energy: 0.5331781641773993
Energy: 0.4937487921789277
Energy: 0.49398743389037286
Energy: 0.5328905243330356
Energy: 0.4937487921792951
Energy: 0.4939874338900053
Energy: 0.5331698911915322
Energy: 0.4937487921778254
Energy: 0.533025116371087
Energy: 0.49380337233986554
Energy: 0.4937835271360393
Energy: 0.5329976460624212
Energy: 0.49380337233986554
Energy: 0.4937835271327491
Energy: 0.5330054700341004
Energy: 0.49380337233839583
Energy: 0.4937835271342188
Energy: 0.5331353139052083
Energy: 0.49441592366710213
Energy: 0.4939477547491284
Energy: 0.49382737647759933
Energy: 0.49441592366636733
Energy: 0.4939477547483935
Energy: 0.49382737648017133
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Energy: 0.4939477547491284
Energy: 0.4938273764772319
Energy: 0.4944159236674696
Energy: 0.49425801283029136
Energy: 0.4941421570234995
Energy: 0.4937099071277328
Energy: 0.49425801283029136
Energy: 0.4941421570253367
Energy: 0.493709907126998
Energy: 0.49425801283029136
Energy: 0.4941421570242344
Energy: 0.49370990712736545
Energy: 0.4942580128291891
Energy: 0.49395745640022304
Energy: 0.49462096040443954
Energy: 0.4940868136284067
Energy: 0.49395745639912075
Energy: 0.4946209604022349
Energy: 0.4940868136258346
Energy: 0.49395745640022304
Energy: 0.4946209604033372
Energy: 0.4940868136265695
Energy: 0.49395745639912075
Energy: 0.4939874338892705
Energy: 0.5331238934126897
Energy: 0.4937487921792951
Energy: 0.4939874338892705
Energy: 0.5330022154162641
Energy: 0.4937487921785602
Energy: 0.49398743388890315
Energy: 0.5330344409625701
Energy: 0.4937487921789277
Energy: 0.49398743389147515
Energy: 0.49380337233986554
Energy: 0.493783527133484
Energy: 0.5330173489815029
Energy: 0.49380337233839583
Energy: 0.49378352713458634
Energy: 0.532991014072735
Energy: 0.49380337233986554
Energy: 0.49378352713385143
Energy: 0.5330189585433645
Energy: 0.49380337233949806
Energy: 0.4939477547483935
Energy: 0.49382737647906905
Energy: 0.4944159236674696
Energy: 0.4939477547491284
Energy: 0.4938273764783342
Energy: 0.49441592366710213
Energy: 0.4939477547483935
Energy: 0.4938273764805388
Energy: 0.494415923665265
Energy: 0.4939477547491284
Energy: 0.4941421570242344
Energy: 0.4937099071262631
Energy: 0.49425801282955645
Energy: 0.4941421570238669
Energy: 0.49370990712810037
Energy: 0.49425801282955645
Energy: 0.4941421570227647
Energy: 0.4937099071262631
Energy: 0.4942580128306588
Energy: 0.4941421570231321
Energy: 0.49462096040517434
Energy: 0.4940868136265695
Energy: 0.49395745640022304
Energy: 0.4946209604029698
Energy: 0.4940868136291415
Energy: 0.49395745639912075
Energy: 0.4946209604048069
Energy: 0.4940868136284067
Energy: 0.49395745640022304
Energy: 0.4946209604022349
Energy: 0.5328840265657427
Energy: 0.4937487921785602
Energy: 0.49398743388963795
Energy: 0.5331407337695919
Energy: 0.4937487921792951
Energy: 0.4939874338892705
Energy: 0.5328851480938093
Energy: 0.49374879217966255
Energy: 0.4939874338874333
Energy: 0.5328831953123117
Energy: 0.4937835271353045
Energy: 0.5330255936412573
Energy: 0.49380337234060034
Energy: 0.4937835271323817
Energy: 0.5330154774667425
Energy: 0.49380337233839583
Energy: 0.4937835271342188
Energy: 0.5330049940339483
Energy: 0.49380337233913063
Energy: 0.49378352713385143
Energy: 0.4938273764812736
Energy: 0.49441592366636733
Energy: 0.4939477547483935
Energy: 0.4938273764779667
Energy: 0.4944159236674696
Energy: 0.4939477547491284
Energy: 0.49382737647906905
Energy: 0.49441592366783704
Energy: 0.4939477547483935
Energy: 0.49382737648017133
Energy: 0.49370990712810037
Energy: 0.49425801282882165
Energy: 0.4941421570234995
Energy: 0.4937099071262631
Energy: 0.4942580128306588
Energy: 0.4941421570242344
Energy: 0.49370990712736545
Energy: 0.4942580128291891
Energy: 0.49414215702239717
Energy: 0.493709907126998
Energy: 0.4940868136298764
Energy: 0.49395745639912075
Energy: 0.4946209604029698
Energy: 0.4940868136265695
Energy: 0.4939574564005905
Energy: 0.49462096040443954
Energy: 0.4940868136273044
Energy: 0.49395745639912075
Energy: 0.4946209604033372
Energy: 0.4940868136265695
Energy: 0.4937487921785602
Energy: 0.49398743388633104
Energy: 0.53300633605962
Energy: 0.4937487921778254
Energy: 0.4939874338870659
Energy: 0.5331459819301196
Energy: 0.4937487921778254
Energy: 0.4939874338874333
Energy: 0.5331570501042039
Energy: 0.4937487921778254
Energy: 0.5330210829049429
Energy: 0.49380337234023297
Energy: 0.4937835271323817
Energy: 0.5330428826678448
Energy: 0.49380337234133526
Energy: 0.49378352713385143
Energy: 0.53301663513315
Energy: 0.49380337233802835
Energy: 0.49378352713385143
Energy: 0.5331152707013357
Energy: 0.494415923665265
Energy: 0.4939477547491284
Energy: 0.4938273764805388
Energy: 0.4944159236689393
Energy: 0.4939477547483935
Energy: 0.4938273764772319
Energy: 0.4944159236667347
Energy: 0.4939477547491284
Energy: 0.4938273764779667
Energy: 0.49441592366783704
Energy: 0.4942580128291891
Energy: 0.4941421570234995
Energy: 0.49370990712810037
Energy: 0.4942580128291891
Energy: 0.49414215702166236
Energy: 0.49370990712663054
Energy: 0.4942580128306588
Energy: 0.4941421570231321
Energy: 0.4937099071277328
Energy: 0.49425801282845416
Energy: 0.49395745640022304
Energy: 0.4946209604029698
Energy: 0.4940868136273044
Energy: 0.49395745639912075
Energy: 0.4946209604048069
Energy: 0.49408681362693696
Energy: 0.49395745640022304
Energy: 0.4946209604055418
Energy: 0.49408681362693696
Energy: 0.49395745639912075

minimum gb energy = 0.49370990712589574 eV
minimum distance =  2.61043998864451 Angstroms
sigma value = 15


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

Energy: 0.5240748764554699
Energy: 0.5509452450340176
Energy: 0.5511546001101079
Energy: 0.5177289340323595
Energy: 0.55094524504068
Energy: 0.551154600113439
Energy: 0.5240748764554699
Energy: 0.5509452450356832
Energy: 0.551154600113439
Energy: 0.5177289340323595
Energy: 0.559321439692669
Energy: 0.5239184629875415
Energy: 0.5388621170903345
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Energy: 0.5593214396910035
Energy: 0.5327450368497292
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Energy: 0.583274175734176
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Energy: 0.5832741757325103
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Energy: 0.5832741757375071
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Energy: 0.5185304313165858
Energy: 0.5063554381993923
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Energy: 0.58845540916171
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Energy: 0.538156925201525
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Energy: 0.5671931594379895
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Energy: 0.5219163528019203
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Energy: 0.5185685885252086
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Energy: 0.5495515388189033
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Energy: 0.536809512162073
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Energy: 0.536809512162073
Energy: 0.5365773848006816
Energy: 0.5035940267734361
Energy: 0.5655311813018383
Energy: 0.536577384795685
Energy: 0.5035858669283633
Energy: 0.5655311812985072
Energy: 0.5365773848023472
Energy: 0.5035940267751016
Energy: 0.5655311813001728
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Energy: 0.5786546657534095
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Energy: 0.5057150470759394
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Energy: 0.5050198856320889
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Energy: 0.5050198856304233
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Energy: 0.6015072535113236
Energy: 0.5142842390871094
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Energy: 0.5835944122865062
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Energy: 0.5148743836024988
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Energy: 0.5582520105605546
Energy: 0.5148743836008334
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Energy: 0.5668297338198995
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Energy: 0.5668297338149029
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Energy: 0.536415800962565
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Energy: 0.5354569915959462
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Energy: 0.5893672373695499
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Energy: 0.5142241989305352
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Energy: 0.5254731943973122
Energy: 0.5605500737793023
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Energy: 0.5207287340498219
Energy: 0.5685097963487153
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Energy: 0.5301050773341477
Energy: 0.5247588480767418
Energy: 0.6496279049679949
Energy: 0.5046961650623131
Energy: 0.5247588480817386
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Energy: 0.5046961650639787
Energy: 0.5247588480834041
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Energy: 0.5247588480767418
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Energy: 0.5360746789085467
Energy: 0.5211246691665995
Energy: 0.5629019833257545
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Energy: 0.5211235954445604
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Energy: 0.5211246691632684
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Energy: 0.5097913867500874
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Energy: 0.5442478251026981
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Energy: 0.5750736668549171
Energy: 0.5654927668074717
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Energy: 0.5654927668108028
Energy: 0.5677295647888463
Energy: 0.5891852934398666
Energy: 0.5016522391627051
Energy: 0.546396052098715
Energy: 0.5885215931867185
Energy: 0.5017942548733925
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Energy: 0.546396052098715
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Energy: 0.5149077894826032
Energy: 0.5572997237250644
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Energy: 0.5149077894776065
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Energy: 0.5149077894809377
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Energy: 0.5475015219684408
Energy: 0.5964895562743625
Energy: 0.5670312487052744
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Energy: 0.5964895562726968
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Energy: 0.5545286382324601
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Energy: 0.5244671031767927
Energy: 0.5846139421356368
Energy: 0.553480774779584
Energy: 0.5177708697589541
Energy: 0.5846139421339712
Energy: 0.552422763294368
Energy: 0.5244671031817894
Energy: 0.5846139421389679
Energy: 0.5534807747829151
Energy: 0.5177708697572886
Energy: 0.5104381526319463
Energy: 0.6002380313728028
Energy: 0.5581223157821902
Energy: 0.5104381526319463
Energy: 0.6002380313761341
Energy: 0.5581223157888525
Energy: 0.5104381526319463
Energy: 0.6002380313744684
Energy: 0.5581223157871871
Energy: 0.5104381526319463
Energy: 0.5936971925167948
Energy: 0.5083734185376844
Energy: 0.5675944703334935
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Energy: 0.5083734185360188
Energy: 0.5675944703301623
Energy: 0.5936971925167948
Energy: 0.5083734185360188
Energy: 0.5675944703301623
Energy: 0.5936971925151292
Energy: 0.5469135267889164
Energy: 0.5569094817048454
Energy: 0.5116789922308549
Energy: 0.5469135267855852
Energy: 0.556909481706511
Energy: 0.5117664160469628
Energy: 0.5469135267905819
Energy: 0.5569094817031799
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Energy: 0.5390349272845326
Energy: 0.5034069480898521
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Energy: 0.6050409629087296
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Energy: 0.5034069480948488
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Energy: 0.5592162535490635
Energy: 0.5689808058361396
Energy: 0.5602139442423989
Energy: 0.5592162535490635
Energy: 0.5689808058361396
Energy: 0.5602139442357367
Energy: 0.5592162535523945
Energy: 0.5689808058378053
Energy: 0.5602139442340711
Energy: 0.5629149354027643
Energy: 0.5480867496724718
Energy: 0.5117249014752855
Energy: 0.5629149354010987
Energy: 0.5480867496708063
Energy: 0.5117249014802823
Energy: 0.5629149353977675
Energy: 0.5480867496758031
Energy: 0.5117249014786167
Energy: 0.5629149353977675
Energy: 0.5190997975168374
Energy: 0.5254963884481901
Energy: 0.536784411978966
Energy: 0.5190997975218341
Energy: 0.5254963884531868
Energy: 0.5367844119806315
Energy: 0.5190997975168374
Energy: 0.5254963884498557
Energy: 0.5367844119856283
Energy: 0.5190997975168374
Energy: 0.5570500787802533
Energy: 0.5260682657757567
Energy: 0.5176608276686828
Energy: 0.5570500787752566
Energy: 0.5260682657774223
Energy: 0.5176608276620206
Energy: 0.5570500787769223
Energy: 0.5260682657807534
Energy: 0.5176608276603549
Energy: 0.5570500787785878
Energy: 0.6582014646675631
Energy: 0.510559373912451
Energy: 0.547538202752797
Energy: 0.6582014646675631
Energy: 0.510559373912451
Energy: 0.5475382027577633
Energy: 0.6582014646692288
Energy: 0.5105593739141167
Energy: 0.5475382027577633
Energy: 0.6582014646658976
Energy: 0.5173555415533674
Energy: 0.5799427979908276
Energy: 0.5173863726658641
Energy: 0.5173555415566985
Energy: 0.5799427979874964
Energy: 0.5173863726658641
Energy: 0.5173555415566985
Energy: 0.5799427979924932
Energy: 0.5173863726708606
Energy: 0.5173555415533674
Energy: 0.5426511933564054
Energy: 0.5046394081446337
Energy: 0.640816754449301
Energy: 0.542651193358071
Energy: 0.5046390562456514
Energy: 0.640816754449301
Energy: 0.5426511933597366
Energy: 0.5046394081446337
Energy: 0.6408167544459699
Energy: 0.5426511933530742
Energy: 0.5760309558965178
Energy: 0.5188783953984063
Energy: 0.5586059291220451
Energy: 0.5760309558931865
Energy: 0.5188783954000717
Energy: 0.5586059291203797
Energy: 0.5760309558898555
Energy: 0.518878395403403
Energy: 0.5586059291203797
Energy: 0.576030955891521
Energy: 0.5562410860557802
Energy: 0.5329175865396322
Energy: 0.516850339450295
Energy: 0.5562410860557802
Energy: 0.5329175865429634
Energy: 0.5168508593758093
Energy: 0.5562410860507835
Energy: 0.5329175865412977
Energy: 0.5168503394519606
Energy: 0.5562410860557802
Energy: 0.5104910838894567
Energy: 0.5264653049565703
Energy: 0.5440269036095512
Energy: 0.5104910838911223
Energy: 0.5264653049532391
Energy: 0.5440269036078856
Energy: 0.5104910838877911
Energy: 0.526465304949908
Energy: 0.5440269036095512
Energy: 0.5104910838827944
Energy: 0.5177921621638664
Energy: 0.553728655905901
Energy: 0.5838945301982698
Energy: 0.5177921621671974
Energy: 0.553728655905901
Energy: 0.5838945301949386
Energy: 0.5177921621655319
Energy: 0.553728655905901
Energy: 0.5838945301999353
Energy: 0.517792162168863

minimum gb energy = 0.5016522391627051 eV
minimum distance =  2.57890732808405 Angstroms
sigma value = 437


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

Energy: 0.5146785432726261
Energy: 0.5402654438098801
Energy: 0.5400774982000134
Energy: 0.5146785432732328
Energy: 0.5402654438098801
Energy: 0.5400774981975863
Energy: 0.5146785432726261
Energy: 0.5402654438110938
Energy: 0.5400774981969794
Energy: 0.5146785432732328
Energy: 0.5938693216961962
Energy: 0.5069420720369922
Energy: 0.5596204976249236
Energy: 0.5938693216955894
Energy: 0.5069420720357786
Energy: 0.5596204976243169
Energy: 0.5938693216961962
Energy: 0.5069420720369922
Energy: 0.5596204976249236
Energy: 0.5938693216955894
Energy: 0.5786530876903045
Energy: 0.49769327253896106
Energy: 0.5662462740296372
Energy: 0.5786530876896978
Energy: 0.49769327253896106
Energy: 0.5662462740302441
Energy: 0.5786530876903045
Energy: 0.49769327253896106
Energy: 0.5662462740296372
Energy: 0.5786530876896978
Energy: 0.5472054853100385
Energy: 0.5769276458238907
Energy: 0.5498211524393566
Energy: 0.5472054853100385
Energy: 0.5769276458220978
Energy: 0.5498211524417838
Energy: 0.5472054853100385
Energy: 0.5769276458244974
Energy: 0.5498211524399634
Energy: 0.5472054853094319
Energy: 0.5627481439263103
Energy: 0.5147003661013216
Energy: 0.6187884185890218
Energy: 0.5627481439263103
Energy: 0.5147003661019284
Energy: 0.6187884185872015
Energy: 0.5627481439232763
Energy: 0.5147003661013216
Energy: 0.6187884185884152
Energy: 0.5627481439269172
Energy: 0.5550316559246573
Energy: 0.5530980163904083
Energy: 0.505726350830315
Energy: 0.5550316559246573
Energy: 0.5530980163873743
Energy: 0.5057263508309218
Energy: 0.5550316559246573
Energy: 0.5530980163898016
Energy: 0.5057263508297082
Energy: 0.5550316559252642
Energy: 0.5682338412154119
Energy: 0.5212785449597247
Energy: 0.49787474118592145
Energy: 0.5682338412166253
Energy: 0.5212785449597247
Energy: 0.49787474118592145
Energy: 0.568233841214805
Energy: 0.5212785449597247
Energy: 0.49787474118592145
Energy: 0.5682338412166253
Energy: 0.5384492045855741
Energy: 0.5502050747931827
Energy: 0.5434937172362948
Energy: 0.5384492045879737
Energy: 0.550205074789542
Energy: 0.5434937172369017
Energy: 0.5384492045855741
Energy: 0.550205074789542
Energy: 0.5434937172356881
Energy: 0.538449204587367
Energy: 0.6701051510459801
Energy: 0.5606774607067698
Energy: 0.515074960569105
Energy: 0.6701051510459801
Energy: 0.5606774607067698
Energy: 0.5150749605709253
Energy: 0.6701051510471937
Energy: 0.5606774607073767
Energy: 0.515074960569105
Energy: 0.6701051510447665
Energy: 0.5449879387411042
Energy: 0.5617622791057695
Energy: 0.56371257214025
Energy: 0.5449879387404974
Energy: 0.5617622791045559
Energy: 0.5637125721384294
Energy: 0.5449879387411042
Energy: 0.5617622791057695
Energy: 0.5637125721420703
Energy: 0.5449879387404974
Energy: 0.542588941912733
Energy: 0.5042327454415828
Energy: 0.5444078273720467
Energy: 0.5425889419103057
Energy: 0.5042327454415828
Energy: 0.5444078273720467
Energy: 0.542588941912733
Energy: 0.5042327454415828
Energy: 0.5444078273720467
Energy: 0.5425889419103057
Energy: 0.5870853282502839
Energy: 0.507387975717045
Energy: 0.5495049478248326
Energy: 0.587085328249677
Energy: 0.5073879757146178
Energy: 0.5495049478242259
Energy: 0.587085328249677
Energy: 0.5073879757176242
Energy: 0.5495049478236189
Energy: 0.587085328249677
Energy: 0.5150060267254598
Energy: 0.5868500098474423
Energy: 0.515103613303567
Energy: 0.5150060267248531
Energy: 0.586850011073862
Energy: 0.5151036133011397
Energy: 0.5150060267254598
Energy: 0.5868500095005199
Energy: 0.5151036133041736
Energy: 0.5150060267248531
Energy: 0.6222476139387084
Energy: 0.5218974208786546
Energy: 0.5440448875074301
Energy: 0.6222476139374948
Energy: 0.5218974208780478
Energy: 0.5440448875068232
Energy: 0.6222476139387084
Energy: 0.5218974208780478
Energy: 0.5440448875080368
Energy: 0.6222476139381017

minimum gb energy = 0.49769327253896106 eV
minimum distance =  2.5682749384522 Angstroms
sigma value = 33