Model name: model_name=EAM_Dynamo_MendelevSrolovitzAckland_2005_AlFe__MO_577453891941_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855312585830688
cohesive_energy=4.013297914458148
mass=55.845
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: 0.014074232003078052
Energy: 0.014545456022957218
Energy: 0.014318683260977147
Energy: 1.8515967554422137
Energy: 0.014318683261688054
Energy: 0.014545456022246312
Energy: 0.014074232003078052
Energy: 0.014545456023641795
Energy: 0.01431868326192502
Energy: 1.4458944808867369
Energy: 0.6817517896495714
Energy: 0.01603696368975884
Energy: 0.016397869623362444
Energy: 0.6713194418491185
Energy: 0.016397869622440903
Energy: 0.016036963689047935
Energy: 0.6817517896498083
Energy: 0.016036963689047935
Energy: 0.016397869623125477
Energy: 0.6713194418521463
Energy: 0.014074232002841086
Energy: 0.014545456022483281
Energy: 0.014318683261451083
Energy: 2.1347606631171665
Energy: 0.014318683261688054
Energy: 0.014545456022957218
Energy: 0.014074232002841086
Energy: 0.014545456022957218
Energy: 0.014318683262135657
Energy: 1.4458944808767578
Energy: 0.6817517896495714
Energy: 0.01603696368975884
Energy: 0.01639786962291484
Energy: 0.671319441852831
Energy: 0.016397869623125477
Energy: 0.016036963689047935
Energy: 0.6817517896493608
Energy: 0.016036963689047935
Energy: 0.016397869623362444
Energy: 0.671319441852831
Energy: 0.014074232003762628
Energy: 0.014545456022035674
Energy: 0.014318683261451083
Energy: 1.5570208772488328
Energy: 0.01431868326192502
Energy: 0.014545456022483281
Energy: 0.014074232003551991
Energy: 0.014545456022483281
Energy: 0.01431868326192502
Energy: 1.7590099321026111
Energy: 0.6817517896495714
Energy: 0.01603696368975884
Energy: 0.016397869623125477
Energy: 0.6713194418530679
Energy: 0.016397869622440903
Energy: 0.016036963689047935
Energy: 0.6817517896500453
Energy: 0.016036963689047935
Energy: 0.01639786962383638
Energy: 0.671319441852357
Energy: 0.014074232002841086
Energy: 0.014545456022246312
Energy: 0.014318683261688054
Energy: 2.1347606631169294
Energy: 0.01431868326192502
Energy: 0.014545456022720251
Energy: 0.014074232002841086
Energy: 0.014545456022957218
Energy: 0.014318683262135657
Energy: 1.8515563791020189

minimum gb energy = 0.014074232002841086 eV
minimum distance =  2.23691539983299 Angstroms
sigma value = 3


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

Energy: 1.5143814856718703
Energy: 1.4112722316377255
Energy: 1.4742562317189851
Energy: 1.405299863932701
Energy: 1.4540713906418505
Energy: 1.3454101259414697
Energy: 1.514381485681467
Energy: 1.4112722316382929
Energy: 1.4742562317133094
Energy: 1.4052998639309988
Energy: 1.4122107171530884
Energy: 1.330179076328804
Energy: 1.4472426135449874
Energy: 1.551097984738064
Energy: 1.3634007858811041
Energy: 1.314012183182913
Energy: 1.412210717157629
Energy: 1.3301790763339119
Energy: 1.4472426135422014
Energy: 1.5510979847374962
Energy: 1.3786912731466237
Energy: 1.3164104768361018
Energy: 1.3169781277313979
Energy: 1.3232522735701024
Energy: 1.4379320155136701
Energy: 1.2658256719836722
Energy: 1.3786912731415155
Energy: 1.3164104768338318
Energy: 1.3169781277279926
Energy: 1.3232522735661296
Energy: 1.3777090282887374
Energy: 1.3017829980457896
Energy: 1.291925456142253
Energy: 1.330953215226868
Energy: 1.2874555068040254
Energy: 1.3310409754877959
Energy: 1.377709028280224
Energy: 1.3017829980531679
Energy: 1.291925456147361
Energy: 1.3309532152308408
Energy: 1.3051546800369498
Energy: 1.3011122444029763
Energy: 1.2899678351108896
Energy: 1.2936389208697738
Energy: 1.3024014380189488
Energy: 1.3762947735617408
Energy: 1.3051546800386522
Energy: 1.3011122444012735
Energy: 1.2899678351114572
Energy: 1.293638920860693
Energy: 1.3919101749426135
Energy: 1.3356598415552103
Energy: 1.301129784256565
Energy: 1.267297018694374
Energy: 1.3205349655891394
Energy: 1.3217914465652658
Energy: 1.391910174939208
Energy: 1.3356598415580483
Energy: 1.3011297842639433
Energy: 1.2672970187227
Energy: 1.3181036743246242
Energy: 1.2913582544747
Energy: 1.3602689895598379
Energy: 1.324295953035063
Energy: 1.3542147547888757
Energy: 1.4758995544794955
Energy: 1.3181036743212187
Energy: 1.2913582544707272
Energy: 1.360268989566081
Energy: 1.3242959530361982
Energy: 1.407523540623832
Energy: 1.46652455207301
Energy: 1.3152713250872743
Energy: 1.3259919762186227
Energy: 1.3268240207685038
Energy: 1.4014618735597515
Energy: 1.4075235405915332
Energy: 1.4665245520923065
Energy: 1.3152713251581667
Energy: 1.3259919762129473
Energy: 1.3479282403331205
Energy: 1.4429589923655413
Energy: 1.396503498252042
Energy: 1.4403060476207896
Energy: 1.3378916657520314
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Energy: 1.442958992366109
Energy: 1.396503498260555
Energy: 1.4403060476185192
Energy: 1.4110797986103625
Energy: 1.4264674192605105
Energy: 1.412213715350621
Energy: 1.4918220550949504
Energy: 1.446469422640837
Energy: 1.4709729678948535
Energy: 1.4110797986114976
Energy: 1.4264674192610778
Energy: 1.4122137153472154
Energy: 1.4918220550938153
Energy: 1.300585576906581
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Energy: 1.3253595978571542
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Energy: 1.305776454433777
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Energy: 1.4084671939593754
Energy: 1.2942508263908472
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Energy: 1.3299547179794708
Energy: 1.2960083304166494
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Energy: 1.3299547179868492
Energy: 1.296008330414947
Energy: 1.2942181392097138
Energy: 1.3377351234267845
Energy: 1.3098650131369378
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Energy: 1.3659961908260148
Energy: 1.3107474306419298
Energy: 1.2942181392063086
Energy: 1.337735123416001
Energy: 1.3098650131397758
Energy: 1.308279727784219
Energy: 1.3434969750892147
Energy: 1.3102915582325763
Energy: 1.269416259147292
Energy: 1.319123302491363
Energy: 1.328128632276794
Energy: 1.381052635332283
Energy: 1.3434969750931873
Energy: 1.3102915582234955
Energy: 1.269416259149562
Energy: 1.3191233024885252
Energy: 1.3252233726920188
Energy: 1.355473355142361
Energy: 1.3603459746270115
Energy: 1.408229473908148
Energy: 1.354524508198383
Energy: 1.3259785050950887
Energy: 1.3252233726925864
Energy: 1.3554733551451987
Energy: 1.3603459746270115
Energy: 1.408229473908148
Energy: 1.5167646946447084
Energy: 1.298295472787509
Energy: 1.4249952456640127
Energy: 1.3747481755408195
Energy: 1.4749760529468001
Energy: 1.464641030466747
Energy: 1.5167646946208713
Energy: 1.298295472800563
Energy: 1.4249952456651478
Energy: 1.3363795508077085
Energy: 1.4719364368269734
Energy: 1.4049606267885395
Energy: 1.448429897134394
Energy: 1.3675369218510578
Energy: 1.4332879312801927
Energy: 1.3481998353200881
Energy: 1.4719364368281085
Energy: 1.404960649054562
Energy: 1.4484298971383671
Energy: 1.3675369218476523
Energy: 1.3268016973280925
Energy: 1.324183684688884
Energy: 1.445634051544817
Energy: 1.2868305171730101
Energy: 1.4002503173505472
Energy: 1.3123139066841405
Energy: 1.3268016973320655
Energy: 1.3241836846951272
Energy: 1.4456340515487898
Energy: 1.2868305171758478
Energy: 1.325363390406244
Energy: 1.4019762996933973
Energy: 1.2925512436006734
Energy: 1.2952159489615966
Energy: 1.3705462942205298
Energy: 1.3136810897009226
Energy: 1.3253633904034061
Energy: 1.4019762996928298
Energy: 1.2925512436080517
Energy: 1.2952159489740829
Energy: 1.2725030294989852
Energy: 1.3019097674393172
Energy: 1.3955775139389504
Energy: 1.4515961624500888
Energy: 1.3228888162232504
Energy: 1.314215353057639
Energy: 1.2725030294989852
Energy: 1.3019097674393172
Energy: 1.395577513937248
Energy: 1.4534420255598541
Energy: 1.2946647574443588
Energy: 1.2906941723018837
Energy: 1.301094174457298
Energy: 1.3050756402167065
Energy: 1.3462051830059019
Energy: 1.3908077208716378
Energy: 1.294664757452305
Energy: 1.2906941723024512
Energy: 1.3010941744607032
Energy: 1.3050756402121662
Energy: 1.318056363197189
Energy: 1.2942627886231115
Energy: 1.2840740642167314
Energy: 1.4841970005431664
Energy: 1.3198936042135108
Energy: 1.2874842915560012
Energy: 1.3180563631977567
Energy: 1.2942627886208415
Energy: 1.284074064222923
Energy: 1.4841970005431664
Energy: 1.3206117725637334
Energy: 1.3178097838593819
Energy: 1.3436482907669243
Energy: 1.3785301053612473
Energy: 1.4167279852809196
Energy: 1.4582931279481948
Energy: 1.32061177255749
Energy: 1.317809783855409
Energy: 1.3039691527798871
Energy: 1.3785301053589774
Energy: 1.3961918851970694
Energy: 1.4457048227489304
Energy: 1.3415171376523658
Energy: 1.453775871231734
Energy: 1.3142450672574533
Energy: 1.3437305553238392
Energy: 1.396191885191394
Energy: 1.4457048227546054
Energy: 1.3415171376563384
Energy: 1.4537758712374094
Energy: 1.4040738529682264
Energy: 1.4547975418823937
Energy: 1.3847163504867999
Energy: 1.4805175109881321
Energy: 1.3604354618859587
Energy: 1.4742562317189851
Energy: 1.404073852969929
Energy: 1.4547975418875017
Energy: 1.3847163504970161
Energy: 1.4805175109921052
Energy: 1.5510979847386313
Energy: 1.3634007858794015
Energy: 1.314012183182913
Energy: 1.4122107171530884
Energy: 1.3301790763265335
Energy: 1.4472426135382286
Energy: 1.5510979847420368
Energy: 1.3634007858782664
Energy: 1.314012183182913
Energy: 1.4122107171496832
Energy: 1.320611772560328
Energy: 1.4379320155153728
Energy: 1.3514966238629966
Energy: 1.378691273142083
Energy: 1.3164104768253184
Energy: 1.316978127732533
Energy: 1.32061177255749
Energy: 1.4379320155136701
Energy: 1.2658256725844526
Energy: 1.3786912731483258
Energy: 1.3309532152246495
Energy: 1.2874555068148088
Energy: 1.3304474761856946
Energy: 1.3777090282853324
Energy: 1.301782998042436
Energy: 1.291925456150766
Energy: 1.3309532152263006
Energy: 1.2874555068023226
Energy: 1.3304474761959106
Energy: 1.377709028283062

minimum gb energy = 1.2658256719836722 eV
minimum distance =  2.21924090841286 Angstroms
sigma value = 75


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

Energy: 1.6328413160230488
Energy: 1.4704818170773948
Energy: 1.439404663147646
Energy: 1.4552534827742234
Energy: 1.4520816007138853
Energy: 1.5622451028932494
Energy: 1.6328413161254658
Energy: 1.4704818170743483
Energy: 1.4394046633367186
Energy: 1.4552534827745005
Energy: 1.4261562247304007
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Energy: 1.4645582947241504
Energy: 1.539477227402484
Energy: 1.4378014583497931
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Energy: 1.5394772274085766
Energy: 1.3627086527006929
Energy: 1.3620532000146575
Energy: 1.3450006655822955
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Energy: 1.406614031173035
Energy: 1.4151389204522178
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Energy: 1.3450006655825726
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Energy: 1.4366907180607964
Energy: 1.3462727983540772
Energy: 1.3561743874332681
Energy: 1.3518271539821747
Energy: 1.3455016681110463
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Energy: 1.4366907180632889
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Energy: 1.335784486837065
Energy: 1.3402335105602023
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Energy: 1.5042491840346968
Energy: 1.3736260735878796
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Energy: 1.362732678547119
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Energy: 1.3457014236365918
Energy: 1.3668196094281755
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Energy: 1.3407520449500956
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Energy: 1.3537502075005736
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Energy: 1.4278320462477156
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Energy: 1.3815827683356707
Energy: 1.3537502075008505
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Energy: 1.376514444183426
Energy: 1.4680781508273317
Energy: 1.5408189909653585
Energy: 1.4357642803970483
Energy: 1.4180576945792949
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Energy: 1.4061055015718533
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Energy: 1.43925220892951
Energy: 1.4618534676000432
Energy: 1.4900735013864028
Energy: 1.4942733797461423
Energy: 1.4500032303582941
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minimum gb energy = 1.3356717008472387 eV
minimum distance =  2.19744621270774 Angstroms
sigma value = 105


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

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Energy: 1.359391628888401
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Energy: 1.4281087817372768
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Energy: 1.6115923805287076
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Energy: 1.4037914899898094
Energy: 1.3523703515559635
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Energy: 1.3365985049891296
Energy: 1.5135499916364548
Energy: 1.330679129650705
Energy: 1.5451990162787597
Energy: 1.3817802582256524
Energy: 1.3575479748644699
Energy: 1.3765483349753895
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Energy: 1.3606953572254095
Energy: 1.5451990162787597
Energy: 1.381780258251896
Energy: 1.3575479748647823
Energy: 1.3765483349791385
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Energy: 1.3822627463277646
Energy: 1.5278368657355135
Energy: 1.4289944353371284
Energy: 1.4004922443372165
Energy: 1.4209079195601315
Energy: 1.462918509389206
Energy: 1.3822627463255774
Energy: 1.5278368657320764
Energy: 1.428994435338378
Energy: 1.4282869181327371
Energy: 1.3600443689371744
Energy: 1.4124242404524965
Energy: 1.3748930342815233
Energy: 1.442349147476718
Energy: 1.3962481966118707
Energy: 1.428286918137111
Energy: 1.3600443689434227
Energy: 1.4124242404509342
Energy: 1.3748930342758996
Energy: 1.3412478100396332
Energy: 1.358239529413725
Energy: 1.4088935251205832
Energy: 1.3308793555244465
Energy: 1.5296715022438077
Energy: 1.332350394308125
Energy: 1.3412478100355716
Energy: 1.3582395294134126
Energy: 1.408893525118084
Energy: 1.3308793555281957
Energy: 1.3367248107795522
Energy: 1.4231019862088792
Energy: 1.3671746326201184
Energy: 1.3812328345767493
Energy: 1.3713654980653982
Energy: 1.3374124672020298
Energy: 1.3367248107783023
Energy: 1.4231019862085668
Energy: 1.367174632619806
Energy: 1.3812328345786238
Energy: 1.4174260490319837
Energy: 1.4137091892954499
Energy: 1.3658217031627977
Energy: 1.396572084143231
Energy: 1.3818467771127745
Energy: 1.5342461725706646
Energy: 1.4174260489767123
Energy: 1.4137091892926381
Energy: 1.3658217031596733
Energy: 1.3965720841413567

minimum gb energy = 1.2957059742609267 eV
minimum distance =  2.23230830144332 Angstroms
sigma value = 165


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

Energy: 1.382059651661867
Energy: 1.616309611407421
Energy: 1.3415036599909114
Energy: 1.4181193243250982
Energy: 1.3341380998428978
Energy: 1.6160547296017387
Energy: 1.3820596516586492
Energy: 1.616309611404203
Energy: 1.3415036599887664
Energy: 1.4181193244805483
Energy: 1.337806744883363
Energy: 1.3407375666826737
Energy: 1.3516152098334
Energy: 1.387015599923117
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Energy: 1.2741304898184598
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Energy: 1.3407375666858916
Energy: 1.3516152098355207
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Energy: 1.2774877247089307
Energy: 1.4652182973543966
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Energy: 1.274029075157342
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Energy: 1.2586328912480582
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Energy: 1.334582863939432
Energy: 1.2979473791918128
Energy: 1.276328707316405
Energy: 1.2586328912480582
Energy: 1.3761461340308587
Energy: 1.3620193944086654
Energy: 1.3255280984634945
Energy: 1.3367459614461787
Energy: 1.3398642878836746
Energy: 1.357851435406205
Energy: 1.6150055771976917
Energy: 1.3620193944075927
Energy: 1.3255280984613493
Energy: 1.3367459614461787
Energy: 1.3398642878858198
Energy: 1.3778075308070659
Energy: 1.305168918126507
Energy: 1.3591381265247404
Energy: 1.4648283543472684
Energy: 1.3460907673908173
Energy: 1.2741698556042111
Energy: 1.377807530797413
Energy: 1.3051689038333145
Energy: 1.3591381265225948
Energy: 1.4648283543461955
Energy: 1.2726608414121876
Energy: 1.4118773981146124
Energy: 1.354958835500356
Energy: 1.3131722159328179
Energy: 1.2547250111258712
Energy: 1.273341102020235
Energy: 1.2726608414111154
Energy: 1.4118773981124675
Energy: 1.354958835500356
Energy: 1.3131722159338906
Energy: 1.2739738345052478
Energy: 1.3687911361760172
Energy: 1.4652396769211644
Energy: 1.2774949085630463
Energy: 1.4049995454953281
Energy: 1.3526254577005277
Energy: 1.2739738345031026
Energy: 1.3687911361792349
Energy: 1.4652396769233096
Energy: 1.2774949085619738
Energy: 1.386189960671341
Energy: 1.3529373046678528
Energy: 1.344160381215604
Energy: 1.3379891665232315
Energy: 1.2744352919872861
Energy: 1.254649661705092
Energy: 1.386189960671341
Energy: 1.3529373046667803
Energy: 1.3441603812038054
Energy: 1.3379891665232315
Energy: 1.4199400571587364
Energy: 1.334138099845043
Energy: 1.6160547296017387
Energy: 1.3820596516575767
Energy: 1.616309611409566
Energy: 1.3415036599930568
Energy: 1.443254498128256
Energy: 1.3341380998471881
Energy: 1.6160547296017387
Energy: 1.382059651654359

minimum gb energy = 1.254649661705092 eV
minimum distance =  2.21664344053542 Angstroms
sigma value = 41


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

Energy: 1.3922207475511166
Energy: 1.2570014298274907
Energy: 1.1743546379258565
Energy: 1.3391613807276308
Energy: 1.1765300616993697
Energy: 1.2577093936569896
Energy: 1.3922207475527812
Energy: 1.257001429822497
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Energy: 1.315589271370602
Energy: 1.1749713178565935
Energy: 1.2742501826336046
Energy: 1.1505803870419944
Energy: 1.158019675177647
Energy: 1.1838980852111183
Energy: 1.31558927136436
Energy: 1.1749713178565935
Energy: 1.2742501826315236
Energy: 1.2330532999501784
Energy: 1.242038843022071
Energy: 1.3228467267938342
Energy: 1.1467351986935228
Energy: 1.1473107071813127
Energy: 1.3087844685649541
Energy: 1.2330532999456008
Energy: 1.2420388430162452
Energy: 1.3228467267984119
Energy: 1.146735198691026
Energy: 1.2584889574201519
Energy: 1.2293953094244368
Energy: 1.2724425479082722
Energy: 1.1494188224365032
Energy: 1.2745562038842821
Energy: 1.175791796797885
Energy: 1.258488957422649
Energy: 1.2293953094223558
Energy: 1.2724425479128498
Energy: 1.1494188224389998
Energy: 1.247051634098382
Energy: 1.23068323586398
Energy: 1.343417621176516
Energy: 1.1754645717384011
Energy: 1.3773713363958913
Energy: 1.176357909114575
Energy: 1.247051634095885
Energy: 1.2306832361218798
Energy: 1.343417621179429
Energy: 1.175464571737153
Energy: 1.149921555332212
Energy: 1.2298005384411694
Energy: 1.2653894682444922
Energy: 1.174901336445151
Energy: 1.2724713057347794
Energy: 1.1502648256280532
Energy: 1.1499215553309634
Energy: 1.2298005384440824
Energy: 1.26538946823825
Energy: 1.174901336440157
Energy: 1.3263293133719094
Energy: 1.2423233275625565
Energy: 1.2534671091776457
Energy: 1.3240451874473398
Energy: 1.148169877640705
Energy: 1.1480936250920113
Energy: 1.326329313365251
Energy: 1.2423233275650534
Energy: 1.2534671091788943
Energy: 1.3240451874523333
Energy: 1.1748804316749364
Energy: 1.3324730682647723
Energy: 1.229632142113137
Energy: 1.148779840536655
Energy: 1.14980513866622
Energy: 1.2955035157825971
Energy: 1.174880431676979
Energy: 1.3324730682660209
Energy: 1.2296321421148015
Energy: 1.1487798405391518
Energy: 1.1750810359578907
Energy: 1.3719476299896924
Energy: 1.2338318673721944
Energy: 1.2474171332396
Energy: 1.1741917306449756
Energy: 1.3766680964028604
Energy: 1.1750810359578907
Energy: 1.3719476299913569
Energy: 1.2338318629296812
Energy: 1.2474171332387678
Energy: 1.1499566440135127
Energy: 1.2757315222808894
Energy: 1.229252378988001
Energy: 1.2652691205636155
Energy: 1.1762856456832689
Energy: 1.2744616611535144
Energy: 1.1499566440151772
Energy: 1.2757315222779761
Energy: 1.2292523789863363
Energy: 1.26526912056441
Energy: 1.148351912797055
Energy: 1.3305187200718411
Energy: 1.2502703660593322
Energy: 1.2331002125824868
Energy: 1.3280947274306023
Energy: 1.1470200575256215
Energy: 1.1483519128016328
Energy: 1.3305187200743378
Energy: 1.2502703660572516
Energy: 1.233100212579158
Energy: 1.3011455025097005
Energy: 1.174673998240079
Energy: 1.3283144113491996
Energy: 1.2006825016940927
Energy: 1.145913124724053
Energy: 1.1500350245659914
Energy: 1.301145502501794
Energy: 1.1746739982388306
Energy: 1.3283144113512804
Energy: 1.2006825016841054
Energy: 1.3285309963252956
Energy: 1.1751047884967394
Energy: 1.3691475970144433
Energy: 1.2341122644732676
Energy: 1.247426432673034
Energy: 1.273725988153459
Energy: 1.328530996321134
Energy: 1.175104788498404
Energy: 1.3691475970173563
Energy: 1.2341122642960636
Energy: 1.3066377646623575
Energy: 1.1487945520200207
Energy: 1.3422188048810773
Energy: 1.2285531363367652
Energy: 1.265225786775214
Energy: 1.1812060297849394
Energy: 1.3066377646565313
Energy: 1.1487945520191882
Energy: 1.3422188048789967
Energy: 1.2285531363421751

minimum gb energy = 1.145913124724053 eV
minimum distance =  2.25811757827785 Angstroms
sigma value = 185


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

Energy: 1.463506809505416
Energy: 1.2013365692822497
Energy: 1.435230215323928
Energy: 1.5882578038496602
Energy: 1.4361190437131135
Energy: 1.201155694218781
Energy: 1.4635068095039339
Energy: 1.2013365692723699
Energy: 1.4352302153288676
Energy: 1.4257200271525448
Energy: 1.4657591861886308
Energy: 1.1970168836456445
Energy: 1.1577856382051672
Energy: 1.20019929284804
Energy: 1.173683671311184
Energy: 1.2772156588464687
Energy: 1.4657591861871488
Energy: 1.1970168836486084
Energy: 1.1577856381997333
Energy: 1.20019929285051
Energy: 1.4591823654473888
Energy: 1.1737124924622677
Energy: 1.485096882575826
Energy: 1.4341859870247606
Energy: 1.1785764401501704
Energy: 1.2073087967879454
Energy: 1.4591823654429428
Energy: 1.1737124924558908
Energy: 1.485096882575826
Energy: 1.4341859870217966
Energy: 1.4166307809634582
Energy: 1.1755864575488104
Energy: 1.1999235390177407
Energy: 1.1581847813021775
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Energy: 1.13079201763091
Energy: 1.4166307809629641
Energy: 1.1755864575473285
Energy: 1.1999235390202105
Energy: 1.1581847813026718
Energy: 1.5091230029046303
Energy: 1.1577486929242304
Energy: 1.2014002764403833
Energy: 1.437810224678618
Energy: 1.4510617804418793
Energy: 1.130186386278005
Energy: 1.5091230029036422
Energy: 1.1577486929227485
Energy: 1.2014002764393952
Energy: 1.4378102246840518
Energy: 1.1998893965468758
Energy: 1.3414745300911846
Energy: 1.2743239945699518
Energy: 1.174313350112132
Energy: 1.2502947275551886
Energy: 1.3857601005668763
Energy: 1.2887121122734777
Energy: 1.3414745300911846
Energy: 1.274323994564518
Energy: 1.1743133501032401
Energy: 1.174326014494596
Energy: 1.308963028413532
Energy: 1.4353749803903373
Energy: 1.2711097371601952
Energy: 1.3027933883713316
Energy: 1.1853041069659096
Energy: 1.174326014496078
Energy: 1.235310733670105
Energy: 1.4353749803903373
Energy: 1.2681285177519213
Energy: 1.4370780906398057
Energy: 1.2005536991075378
Energy: 1.1576894931750261
Energy: 1.1872483358128816
Energy: 1.1303066548646572
Energy: 1.4426723041017604
Energy: 1.4370780906457337
Energy: 1.2005536991105017
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Energy: 1.1872483358183155
Energy: 1.1582083886226529
Energy: 1.2000225062739205
Energy: 1.1771800879510324
Energy: 1.4880802005659937
Energy: 1.130617522597505
Energy: 1.1828723700094002
Energy: 1.158208388624629
Energy: 1.2000225062773786
Energy: 1.1771800879544903
Energy: 1.4880802005674756
Energy: 1.4351397285270522
Energy: 1.4949506635860164
Energy: 1.173545714514371
Energy: 1.2917503863944397
Energy: 1.1948408078418449
Energy: 1.1756740135075872
Energy: 1.4351397285305103
Energy: 1.4949506635830523
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Energy: 1.2917503863944397
Energy: 1.2001698661844415
Energy: 1.1577908659423926
Energy: 1.2018238662454666
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Energy: 1.3091929912370288
Energy: 1.1739609153570298
Energy: 1.2001698661834537
Energy: 1.1577908659418987
Energy: 1.2018238662509007
Energy: 1.4371183226661544
Energy: 1.4663605825866999
Energy: 1.4362791526050194
Energy: 1.194394887287982
Energy: 1.3857591281128108
Energy: 1.2013365692945996
Energy: 1.4352302153268919
Energy: 1.5244349299704825
Energy: 1.4362791526089713
Energy: 1.1943948872504833
Energy: 1.3857591281133048
Energy: 1.2001992928524858
Energy: 1.173683671307726
Energy: 1.3091929912394988
Energy: 1.4369955797992098
Energy: 1.1970168836471264
Energy: 1.1577856381987452
Energy: 1.200199292853474
Energy: 1.1736836713062442
Energy: 1.3091929912390046
Energy: 1.4369955798085954
Energy: 1.43432940596371
Energy: 1.1785764401521461
Energy: 1.3021515350231319
Energy: 1.4591823654424487
Energy: 1.1735772707156
Energy: 1.4949506635810763
Energy: 1.4343294059666742
Energy: 1.17857644015511
Energy: 1.302151535023626
Energy: 1.4591823654429428
Energy: 1.1580861887650817
Energy: 1.1795581996339943
Energy: 1.1307920176299222
Energy: 1.41663078096247
Energy: 1.1758007137081712
Energy: 1.1999608094894352
Energy: 1.1580861887710094
Energy: 1.1795581996409104
Energy: 1.1307920176274524
Energy: 1.416630780961976
Energy: 1.4378102246835576
Energy: 1.4510617804384214
Energy: 1.1301863856425078
Energy: 1.5091230029061122
Energy: 1.1577486929237364
Energy: 1.2014002764364313
Energy: 1.4378102246835576
Energy: 1.4510617804399033
Energy: 1.1301863868132669
Energy: 1.509123002908088
Energy: 1.174313350103734
Energy: 1.2398745320436089
Energy: 1.3857601005678644
Energy: 1.1998893965453938
Energy: 1.3414745300931605
Energy: 1.3219866003280525
Energy: 1.174313350107192
Energy: 1.239874532036693
Energy: 1.3857601005723101
Energy: 1.2061670965000584
Energy: 1.3274748222340877
Energy: 1.3027933883728136
Energy: 1.1853041069659096
Energy: 1.1743613510655415
Energy: 1.2356211753434476
Energy: 1.4354907145844171
Energy: 1.32747482223063
Energy: 1.3027933883713316
Energy: 1.1853041069683798
Energy: 1.1743613510591198
Energy: 1.1872483358104118
Energy: 1.1303066548621874
Energy: 1.442672304107688
Energy: 1.4370780906373357
Energy: 1.2006139964016522
Energy: 1.157716102851004
Energy: 1.1872483358104118
Energy: 1.1303066551071173
Energy: 1.4426723040983023
Energy: 1.4370780906417817
Energy: 1.4880802005674756
Energy: 1.1306175225994808
Energy: 1.182872370012858
Energy: 1.158208388624629
Energy: 1.2000225062729326
Energy: 1.1771800879490564
Energy: 1.4880802005689575
Energy: 1.1306175226004689
Energy: 1.18287237001187
Energy: 1.158208388623641
Energy: 1.2218230026549943
Energy: 1.1948408078487607
Energy: 1.1755103230572792
Energy: 1.4351397285261094
Energy: 1.4850968825738502
Energy: 1.1735457145099248
Energy: 1.2218230026495602
Energy: 1.194840807844315
Energy: 1.1755103230622188
Energy: 1.4351397285275465
Energy: 1.4655069717742757
Energy: 1.2772156588454806
Energy: 1.1735987220905257
Energy: 1.1999781345120644
Energy: 1.1577848187570325
Energy: 1.2015327685965869
Energy: 1.4655069717762068
Energy: 1.2772156588449868
Energy: 1.1735987220865736
Energy: 1.1999781345110763
Energy: 1.463506809502946
Energy: 1.2013365692921296
Energy: 1.435230215323928
Energy: 1.3709579151560098
Energy: 1.4361190437170654
Energy: 1.2011556942118653
Energy: 1.4635068095004762
Energy: 1.2013365692960816
Energy: 1.4352302153278798
Energy: 1.4416884359784254
Energy: 1.465759186191595
Energy: 1.1970168836476203
Energy: 1.1577856382061549
Energy: 1.200199292849522
Energy: 1.173683671309702
Energy: 1.2772156588444925
Energy: 1.4657591861891248
Energy: 1.1970168836500903
Energy: 1.1577856382007214
Energy: 1.20019929285051
Energy: 1.4591823654478826
Energy: 1.1737124924627618
Energy: 1.4850968825753321
Energy: 1.4341859870232787
Energy: 1.178576440154122
Energy: 1.2073087967879454
Energy: 1.4591823654444247
Energy: 1.1737124924593039
Energy: 1.4850968825748379
Energy: 1.4341859870203146
Energy: 1.416630780961976
Energy: 1.1755864575502923
Energy: 1.1999235390211984
Energy: 1.158184781299708
Energy: 1.1795581996399225
Energy: 1.1307920176314041
Energy: 1.4166307809634582
Energy: 1.1755864575488104
Energy: 1.1999235390197165
Energy: 1.1581847813011898
Energy: 1.5091230029085823
Energy: 1.1577486929271945
Energy: 1.2014002764393952
Energy: 1.4378102246801
Energy: 1.4510617804394093
Energy: 1.1301863828102314
Energy: 1.5091230029071003
Energy: 1.1577486929222545
Energy: 1.2014002764403833
Energy: 1.4378102246835576
Energy: 1.1795439758508026
Energy: 1.3414745300911846
Energy: 1.274323994553156
Energy: 1.17431335010818
Energy: 1.2502947275546947
Energy: 1.3857601005688522
Energy: 1.1795439758527788
Energy: 1.3414745300882205
Energy: 1.2743239945496982
Energy: 1.1743133501032401
Energy: 1.174326014496078
Energy: 1.235310733671587
Energy: 1.4353749803898435
Energy: 1.309904221222383
Energy: 1.3027933883713316
Energy: 1.1853041069629457
Energy: 1.174326014497066
Energy: 1.235310733676527
Energy: 1.4353749803903373
Energy: 1.3274748222301358
Energy: 1.4370780906383236
Energy: 1.2005536991095138
Energy: 1.15768949317305
Energy: 1.1872483358148576
Energy: 1.130306654588651
Energy: 1.4426723041017604
Energy: 1.4370780906427698
Energy: 1.2005536991144536
Energy: 1.157689493172062
Energy: 1.1872483358099177
Energy: 1.1582083886241348
Energy: 1.2000225062758967
Energy: 1.1771800879510324
Energy: 1.4880802005635236
Energy: 1.1306175225960229
Energy: 1.182872370007918
Energy: 1.158208388623641
Energy: 1.2000225062778724
Energy: 1.1771800879530083
Energy: 1.4880802005694513
Energy: 1.4351397285270522
Energy: 1.4949506635835463
Energy: 1.173545714514865
Energy: 1.291750386392464
Energy: 1.1948408078457968
Energy: 1.175674013508575
Energy: 1.4351397285290284
Energy: 1.4949506635810763
Energy: 1.173545714513383
Energy: 1.291750386393946
Energy: 1.2001698661844415
Energy: 1.1577908659423926
Energy: 1.2018238662439846
Energy: 1.4371183226710942
Energy: 1.3091929912385107
Energy: 1.173960915357524
Energy: 1.2001698661834537
Energy: 1.1577908659443688
Energy: 1.2018238662518888
Energy: 1.4371183226671425

minimum gb energy = 1.1301863828102314 eV
minimum distance =  2.18055293744413 Angstroms
sigma value = 33


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

Energy: 1.3693171809481086
Energy: 1.4467711422880698
Energy: 1.3892013240735301
Energy: 1.4307151865213592
Energy: 1.3894070437286752
Energy: 1.4464779399220593
Energy: 1.369317180951363
Energy: 1.4467711422864429
Energy: 1.3892013240724457
Energy: 1.383357380280464
Energy: 1.5117123171040139
Energy: 1.3622385579668694
Energy: 1.35899650562226
Energy: 1.2915893813786257
Energy: 1.2323815333501877
Energy: 1.2839404949212119
Energy: 1.511712317104285
Energy: 1.3622385579793195
Energy: 1.358996505622531
Energy: 1.29158938137049
Energy: 1.367448244487266
Energy: 1.2070082270617346
Energy: 1.4292265097720551
Energy: 1.5437558763852257
Energy: 1.234704479737997
Energy: 1.2915681150574458
Energy: 1.3674482444709948
Energy: 1.2070082270649887
Energy: 1.429226509777479
Energy: 1.5437558763920052
Energy: 1.3313895541477883
Energy: 1.20669258775691
Energy: 1.2768721927504512
Energy: 1.347744388972607
Energy: 1.3961439110797722
Energy: 1.4740929645226675
Energy: 1.3313895541399487
Energy: 1.206692587762038
Energy: 1.2768721927523496
Energy: 1.347744388972607
Energy: 1.2794603026629408
Energy: 1.2064191446758668
Energy: 1.3328621421082996
Energy: 1.474109100929022
Energy: 1.3960689127677908
Energy: 1.3467226990746894
Energy: 1.2794603026659237
Energy: 1.2064191446788497
Energy: 1.332862142111825
Energy: 1.4741091009330896
Energy: 1.5438071416484442
Energy: 1.206348988948169
Energy: 1.3712245084762182
Energy: 1.2922542654254734
Energy: 1.2334354316680571
Energy: 1.5440568489929396
Energy: 1.5438071416500716
Energy: 1.2063489889459997
Energy: 1.3712245084721504
Energy: 1.2922542654257445
Energy: 1.3504858664833732
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Energy: 1.510593521060158
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Energy: 1.2920111592873011
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Energy: 1.2914031253765215
Energy: 1.5105935210531072
Energy: 1.2855346210765368
Energy: 1.3870146046728682
Energy: 1.4469862429540017
Energy: 1.3694578760581568
Energy: 1.4883897649672386
Energy: 1.2074345093110752
Energy: 1.2936860357436026
Energy: 1.387014604674495
Energy: 1.4469862429618663
Energy: 1.3694578760505636
Energy: 1.488389764962382
Energy: 1.2320406890839117
Energy: 1.293562693692825
Energy: 1.511339092769338
Energy: 1.3601952113317044
Energy: 1.355229974593415
Energy: 1.2918855722272218
Energy: 1.2320406890812
Energy: 1.2935626936925537
Energy: 1.5113390927712362
Energy: 1.3601952137477111
Energy: 1.2348684485974228
Energy: 1.2926043499568047
Energy: 1.3674209573002705
Energy: 1.2060659181142603
Energy: 1.4276590177832273
Energy: 1.5461015478726672
Energy: 1.2348684485995924
Energy: 1.2926043499527369
Energy: 1.3674209573024398
Energy: 1.2060659181183284
Energy: 1.4883176565711862
Energy: 1.3647698905405827
Energy: 1.413627786962402
Energy: 1.2064914663944424
Energy: 1.2779592255459482
Energy: 1.3469140636076957
Energy: 1.488317656569559
Energy: 1.3647698905416674
Energy: 1.4136277869667413
Energy: 1.206491466398239
Energy: 1.3961656560493212
Energy: 1.347116901386207
Energy: 1.279225726760454
Energy: 1.205884634805519
Energy: 1.330588332509039
Energy: 1.4767778712076698
Energy: 1.3961656560544737
Energy: 1.3471169013927156
Energy: 1.279225726760183
Energy: 1.2058846348011802
Energy: 1.23301442474108
Energy: 1.3976464140887659
Energy: 1.5437290334262397
Energy: 1.2066388885277395
Energy: 1.3560083513873888
Energy: 1.2923651512385042
Energy: 1.2330144247394528
Energy: 1.3976464140944609
Energy: 1.5437290334240703
Energy: 1.2066388885323496
Energy: 1.2323371210448144
Energy: 1.2932439992023652
Energy: 1.3524730258565059
Energy: 1.2943959214421863
Energy: 1.5109732594926766
Energy: 1.2852766754724823
Energy: 1.2323371210423735
Energy: 1.2932439992029077
Energy: 1.3524730258529805
Energy: 1.2943959214408303
Energy: 1.2090234082947027
Energy: 1.292396741965562
Energy: 1.3897352329058463
Energy: 1.4463680421450071
Energy: 1.3703352080926656
Energy: 1.4888546538666405
Energy: 1.2090234082632694
Energy: 1.292396741958265
Energy: 1.389735232910999
Energy: 1.4463680421368714
Energy: 1.2071975634564958
Energy: 1.2924399703547746
Energy: 1.23187383439165
Energy: 1.2929562447331222
Energy: 1.3950183814488033
Energy: 1.3981112194597527
Energy: 1.2071975634605632
Energy: 1.2924399703580043
Energy: 1.231873834381616
Energy: 1.2929562447331222
Energy: 1.3129113381994133
Energy: 1.4774896183869306
Energy: 1.2359322904021306
Energy: 1.292041005750276
Energy: 1.2760193047492703
Energy: 1.2058241006186512
Energy: 1.3129113381964301
Energy: 1.4774896183828627
Energy: 1.2359322904059276
Energy: 1.2920410057505474
Energy: 1.2777388099501976
Energy: 1.346346487670757
Energy: 1.4894118418325337
Energy: 1.2068364854397973
Energy: 1.415534593999907
Energy: 1.2065291511040654
Energy: 1.2777388099550544
Energy: 1.3463464876653577
Energy: 1.4894118418371438
Energy: 1.2068364854444076
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Energy: 1.461256052564813
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Energy: 1.5009873065459438
Energy: 1.3534714603364866
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Energy: 1.5015093064195062
Energy: 1.4542817324368404
Energy: 1.2088036956976462
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Energy: 1.275937157042362
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Energy: 1.2341904251087525
Energy: 1.4039459424787506
Energy: 1.208803697422175
Energy: 1.282540736489316
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Energy: 1.293220201024696
Energy: 1.234157729671817
Energy: 1.3654760768711716
Energy: 1.3526491460227674
Energy: 1.2949778298655403
Energy: 1.233461124199764
Energy: 1.2072019477758498
Energy: 1.2341577296832067
Energy: 1.365476076870358
Energy: 1.3526491460393097
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Energy: 1.5456961381392185
Energy: 1.2775120668507944
Energy: 1.3465524134019826
Energy: 1.4883691023226677
Energy: 1.344113022030355

minimum gb energy = 1.205622504983099 eV
minimum distance =  2.19293880345351 Angstroms
sigma value = 219


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

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Energy: 1.1982094588746006
Energy: 1.3139067586536743
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Energy: 1.1979455894509015
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Energy: 1.2226457831021504
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Energy: 1.2990878991536892
Energy: 1.2346366973123968
Energy: 1.197874572194675
Energy: 1.3809706716441628
Energy: 1.197693976517571
Energy: 1.3765263634987561

minimum gb energy = 1.195291987301399 eV
minimum distance =  2.30915350931177 Angstroms
sigma value = 15


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

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Energy: 1.444949461368632
Energy: 1.3444385899247477
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Energy: 1.4328030676089367
Energy: 1.47409463396569
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minimum gb energy = 1.32242484185775 eV
minimum distance =  2.22410399926192 Angstroms
sigma value = 293


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

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Energy: 1.5240959107587506
Energy: 1.3318637775782154
Energy: 1.4375070544117046
Energy: 1.4038529048762822
Energy: 1.3739663001002478
Energy: 1.536730775072627
Energy: 1.4612150477321417
Energy: 1.3923498002010113
Energy: 1.6030519304347062
Energy: 1.3931899918919262
Energy: 1.4609558725495557
Energy: 1.5367307750762753
Energy: 1.461215047747141
Energy: 1.392349800201417
Energy: 1.6030519304363275
Energy: 1.331746293737382
Energy: 1.5236064453525184
Energy: 1.3922764845255315
Energy: 1.373938901071804
Energy: 1.403651347308283
Energy: 1.4372540944550647
Energy: 1.3317462937365712
Energy: 1.5236064453513023
Energy: 1.3922764845263425
Energy: 1.3739389010705878
Energy: 1.455959699720807
Energy: 1.4117307996089958
Energy: 1.4404081528884012
Energy: 1.3958852774745822
Energy: 1.40530025501446
Energy: 1.3172419773701225
Energy: 1.4559596997220234
Energy: 1.411730799606158
Energy: 1.4404081528896175
Energy: 1.3958852774928248
Energy: 1.416255718721526
Energy: 1.414417739530024
Energy: 1.5265742607642
Energy: 1.4360771504432865
Energy: 1.3969800532670558
Energy: 1.4067711912019576
Energy: 1.416255718749498
Energy: 1.414417739530024
Energy: 1.5265742607666324
Energy: 1.436077150457844
Energy: 1.3568570759320449
Energy: 1.4955186889219618
Energy: 1.4319370658552377
Energy: 1.406046862578368
Energy: 1.5958638793916342
Energy: 1.3303458166592461
Energy: 1.3568570759316392
Energy: 1.4955186889195293
Energy: 1.431937065854427
Energy: 1.4060468625763411
Energy: 1.363927550843648
Energy: 1.3817244181633186
Energy: 1.3737997235661445
Energy: 1.5407109120083924
Energy: 1.4039429597936055
Energy: 1.431367953753775
Energy: 1.3639275508424318
Energy: 1.3817244181653456
Energy: 1.373799723401628
Energy: 1.5407109120108249
Energy: 1.3976760882177661
Energy: 1.3845507898891594
Energy: 1.4418260228905255
Energy: 1.4821516251467755
Energy: 1.4237441283789705
Energy: 1.4974750567044885
Energy: 1.3976760882165498
Energy: 1.3845507898903757
Energy: 1.4418260228913364
Energy: 1.4821516251475861
Energy: 1.4067689113697375
Energy: 1.4192482027053834
Energy: 1.419240917684763
Energy: 1.4066645431079052
Energy: 1.361769698666517
Energy: 1.3612626443750042
Energy: 1.406768911371359
Energy: 1.4192482027061943
Energy: 1.4192409176859793
Energy: 1.4066645431083107
Energy: 1.4819045751705933
Energy: 1.4416955248392578
Energy: 1.38461389462104
Energy: 1.397687454915071
Energy: 1.5006458712706643
Energy: 1.424272700013
Energy: 1.4819045753910545
Energy: 1.4416955248388523
Energy: 1.3846138946186075
Energy: 1.397687454915071
Energy: 1.5406783934844734
Energy: 1.3759440787071042
Energy: 1.3816527615665868
Energy: 1.3639810173342124
Energy: 1.432214392079631
Energy: 1.4038550479631569
Energy: 1.5406783934844734
Energy: 1.375944078705888
Energy: 1.381652761567803
Energy: 1.3639810173350233
Energy: 1.4062128923857133
Energy: 1.4311304125758664
Energy: 1.4955186889203402
Energy: 1.3561315624753738
Energy: 1.330334871757332
Energy: 1.5958638793904178
Energy: 1.4062128923865242
Energy: 1.4311304125758664
Energy: 1.495518688921151
Energy: 1.3561315624769954
Energy: 1.4559761468837962
Energy: 1.5264410754740736
Energy: 1.41574395919832
Energy: 1.4170382497486473
Energy: 1.406202962555518
Energy: 1.3970155707721057
Energy: 1.4559761468862287
Energy: 1.5264410754752897
Energy: 1.4157439591987253
Energy: 1.4170382497612144

minimum gb energy = 1.3172419773672845 eV
minimum distance =  2.20822944971787 Angstroms
sigma value = 293


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

Energy: 1.139245133966334
Energy: 1.4046241055179034
Energy: 1.1698237857216898
Energy: 1.6020411262151928
Energy: 1.1698338769623526
Energy: 1.4040983992261882
Energy: 1.1392451339670668
Energy: 1.4046241055171707
Energy: 1.1698237857246205
Energy: 1.4579114534375384
Energy: 1.246155524731068
Energy: 1.7348855191276702
Energy: 1.169893314846115
Energy: 1.564924650173094
Energy: 1.5872912344385446
Energy: 1.1708918878971424
Energy: 1.2461555247318006
Energy: 1.4966104905057362
Energy: 1.169893314846115
Energy: 1.5649246501723613
Energy: 1.2141359346178595
Energy: 1.1362279376948103
Energy: 1.528475407909264
Energy: 1.1360581806193093
Energy: 1.2916180632009855
Energy: 1.1726003332072827
Energy: 1.2141359346237213
Energy: 1.1362279376948103
Energy: 1.528475407909264
Energy: 1.136058180617844
Energy: 1.5286246936570471
Energy: 1.1362093322262536
Energy: 1.2141345604434204
Energy: 1.172611985459683
Energy: 1.2916663464889013
Energy: 1.1361126905446466
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Energy: 1.1362093322269862
Energy: 1.2141345604426874
Energy: 1.1726119854611485
Energy: 1.1698742878652597
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Energy: 1.2460596366369574
Energy: 1.1709056406917968
Energy: 1.5873976286861204
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Energy: 1.1698742878645272
Energy: 1.748923076621439
Energy: 1.2460596366376901
Energy: 1.170905640693262
Energy: 1.1698338769616201
Energy: 1.404098399224723
Energy: 1.139245133966334
Energy: 1.4046241055303261
Energy: 1.1698237857224225
Energy: 1.456670460820699
Energy: 1.1698338769616201
Energy: 1.4040983992254554
Energy: 1.1392451339670668
Energy: 1.4046241055171707
Energy: 1.587291234437812
Energy: 1.1708918878971424
Energy: 1.246155524730335
Energy: 1.7348855191276702
Energy: 1.169893314848313
Energy: 1.5649246501716285
Energy: 1.5872912344385446
Energy: 1.1708918878993404
Energy: 1.246155524731068
Energy: 1.6255679558687288
Energy: 1.2916180632002527
Energy: 1.1726003332080155
Energy: 1.2141359346178595
Energy: 1.1362279376948103
Energy: 1.5284754079085312
Energy: 1.1360581806215078
Energy: 1.2916180632009855
Energy: 1.1726003332072827
Energy: 1.2141359346237213
Energy: 1.1362279376948103
Energy: 1.2916663464889013
Energy: 1.136112690540983
Energy: 1.5286246936570471
Energy: 1.1362093322262536
Energy: 1.214134560444153
Energy: 1.172611985459683
Energy: 1.2916663464889013
Energy: 1.1361126905424483
Energy: 1.5286246936555816
Energy: 1.136209332225521
Energy: 1.5873976286853877
Energy: 1.512120083590944
Energy: 1.1698742878667252
Energy: 1.6883375192185985
Energy: 1.2460596366376901
Energy: 1.1709056406917968
Energy: 1.5873976286846552
Energy: 1.395922309115571
Energy: 1.169874287867458
Energy: 1.74892307662437
Energy: 1.1698237857231553
Energy: 1.6058090948030532
Energy: 1.1698338769623526
Energy: 1.404098399224723
Energy: 1.1392451339670668
Energy: 1.4046241055230324
Energy: 1.1698237857224225
Energy: 1.4594863562575708
Energy: 1.1698338769623526
Energy: 1.4040983992232574
Energy: 1.1698933148475803
Energy: 1.5649246501708958
Energy: 1.587291234437812
Energy: 1.1708918878971424
Energy: 1.2461555247318006
Energy: 1.7348855191320662
Energy: 1.169893314846115
Energy: 1.5649246501716285
Energy: 1.5872912344385446
Energy: 1.1708918878993404
Energy: 1.5284754079085312
Energy: 1.1360581806163785
Energy: 1.2916180632017182
Energy: 1.1726003332080155
Energy: 1.214135934619325
Energy: 1.1362279376948103
Energy: 1.5284754079085312
Energy: 1.1360581806185768
Energy: 1.291618063202451
Energy: 1.1726003332072827
Energy: 1.2141345604507474
Energy: 1.1726119854611485
Energy: 1.291666346489634
Energy: 1.1361126905424483
Energy: 1.5286246936570471
Energy: 1.1362093322291846
Energy: 1.2141345604456184
Energy: 1.172611985459683
Energy: 1.291666346489634
Energy: 1.1361126905402503
Energy: 1.2460596366376901
Energy: 1.1709056406947276
Energy: 1.5873976286861204
Energy: 1.3959223091097093
Energy: 1.1698742878652597
Energy: 1.5004885839580355
Energy: 1.246059636640621
Energy: 1.170905640691064
Energy: 1.5873976286846552
Energy: 1.3959223091097093
Energy: 1.1392451339670668
Energy: 1.4046241055142397
Energy: 1.1698237857231553
Energy: 1.4821005179888354
Energy: 1.1698338769630856
Energy: 1.4040983992254554
Energy: 1.139245133966334
Energy: 1.4046241055171707
Energy: 1.1698237857216898
Energy: 1.605809094808915
Energy: 1.246155524731068
Energy: 1.8226604032248
Energy: 1.169893314850511
Energy: 1.5649246501708958
Energy: 1.587291234437812
Energy: 1.1708918878971424
Energy: 1.2461555247296026
Energy: 1.8226604032233344
Energy: 1.169893314848313
Energy: 1.5649246501723613
Energy: 1.2141359346207905
Energy: 1.1362279376955429
Energy: 1.5284754079085312
Energy: 1.1360581806200423
Energy: 1.2916180631987875
Energy: 1.1726003332087482
Energy: 1.2141359346185925
Energy: 1.1362279376955429
Energy: 1.528475407909264
Energy: 1.1360581806163785
Energy: 1.5286246936563144
Energy: 1.1362093322247881
Energy: 1.2141345604448857
Energy: 1.1726119854611485
Energy: 1.291666346489634
Energy: 1.1361126905439138
Energy: 1.5286246936570471
Energy: 1.136209332225521
Energy: 1.2141345604426874
Energy: 1.172611985459683
Energy: 1.1698742878652597
Energy: 1.5004885839580355
Energy: 1.2460596366376901
Energy: 1.1709056406925296
Energy: 1.5873976286853877
Energy: 1.3959223091119073
Energy: 1.169874287867458
Energy: 1.500488583957303
Energy: 1.2460596366391556
Energy: 1.1709056406954605
Energy: 1.1698338769623526
Energy: 1.4040983992298515
Energy: 1.1392451339670668
Energy: 1.4046241055208342
Energy: 1.169823785723888
Energy: 1.4821005179881026
Energy: 1.1698338769623526
Energy: 1.4040983992320497
Energy: 1.139245133966334
Energy: 1.4046241055142397
Energy: 1.5872912344392773
Energy: 1.170891887900806
Energy: 1.2461555247325335
Energy: 1.8226604032262652
Energy: 1.169893314846115
Energy: 1.5649246501716285
Energy: 1.587291234437812
Energy: 1.1708918878993404
Energy: 1.2461555247274043
Energy: 1.8226604032240672

minimum gb energy = 1.1360581806163785 eV
minimum distance =  2.27066811796463 Angstroms
sigma value = 15


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

Energy: 1.5812707817051297
Energy: 1.350662357558016
Energy: 1.4000848496255092
Energy: 1.3724537163879482
Energy: 1.3997198710553242
Energy: 1.3504965699782119
Energy: 1.5812707817041334
Energy: 1.3506623575725998
Energy: 1.4000848496278342
Energy: 1.3724537168683364
Energy: 1.4167343802009433
Energy: 1.4493343229591866
Energy: 1.399106387967751
Energy: 1.378047881967289
Energy: 1.3921213630622986
Energy: 1.3426641612840406
Energy: 1.4167343802019396
Energy: 1.4493343229591866
Energy: 1.399106387965094
Energy: 1.3780478819729356
Energy: 1.4462454133790343
Energy: 1.3880784147012257
Energy: 1.4722304970395974
Energy: 1.38906809966913
Energy: 1.445462508889548
Energy: 1.4223007824242508
Energy: 1.4462454133757128
Energy: 1.3880784147005614
Energy: 1.4722304970346152
Energy: 1.3890680996654767
Energy: 1.4852332728477324
Energy: 1.3541817858672593
Energy: 1.391774622651978
Energy: 1.3453263039741183
Energy: 1.4202232642558708
Energy: 1.3431040555725566
Energy: 1.4852332728507218
Energy: 1.3541817858659309
Energy: 1.3917746226506496
Energy: 1.3453263039741183
Energy: 1.4003048186794527
Energy: 1.4565090835339802
Energy: 1.3405911971067288
Energy: 1.4107273625184333
Energy: 1.332463655553014
Energy: 1.3447578615473548
Energy: 1.4003048186781242
Energy: 1.4697193052127508
Energy: 1.3405911971097177
Energy: 1.4107273625171048
Energy: 1.401381841249326
Energy: 1.4568287685991266
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Energy: 1.3739154509383984
Energy: 1.3520390608317663
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Energy: 1.40138184124999
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Energy: 1.4142911748272562
Energy: 1.3739154509413876
Energy: 1.4839422497066763
Energy: 1.2990926523762063
Energy: 1.3042490133840727
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Energy: 1.4030111054860914
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Energy: 1.3042490133837406
Energy: 1.399557932899336
Energy: 1.3501555195871502
Energy: 1.5335340463973754
Energy: 1.4041548360542087
Energy: 1.363410668420611
Energy: 1.3321007548170425
Energy: 1.4007288236222715
Energy: 1.3501555195901396
Energy: 1.5335340463963791
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Energy: 1.3634106684133038
Energy: 1.360633680968396
Energy: 1.4673256457968227
Energy: 1.4789586569304625
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Energy: 1.3452674912688365
Energy: 1.3606336809667356
Energy: 1.4673256457971549
Energy: 1.47895865693312
Energy: 1.3887251221300556
Energy: 1.364346764386751
Energy: 1.4089674949054758
Energy: 1.3534036666292992
Energy: 1.5033806840683073
Energy: 1.3938474594470187
Energy: 1.379861787174721
Energy: 1.3643467643864189
Energy: 1.4089674949061404
Energy: 1.35340366663096
Energy: 1.5033806840689714
Energy: 1.3464253595626425
Energy: 1.405908793112242
Energy: 1.3026600975232328
Energy: 1.4878211321897357
Energy: 1.335314315794994
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Energy: 1.3464253595619782
Energy: 1.4059087931119103
Energy: 1.3026600975212401
Energy: 1.4878211321824286
Energy: 1.3854832002833943
Energy: 1.4542975672262608
Energy: 1.4850580535450586
Energy: 1.3447448660544734
Energy: 1.3932212344181802
Energy: 1.3341396464528672
Energy: 1.3854832002800732
Energy: 1.4542975672246001
Energy: 1.4850580537070803
Energy: 1.3447448660544734
Energy: 1.4255632377864074
Energy: 1.3680837945032682
Energy: 1.5240427454241146
Energy: 1.454735680139357
Energy: 1.375271995275287
Energy: 1.3275006865519765
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Energy: 1.3680837945045965
Energy: 1.5240427454204613
Energy: 1.454735680139689
Energy: 1.3392718567792228
Energy: 1.4838750054207288
Energy: 1.3567381529558726
Energy: 1.413090769540126
Energy: 1.3843481969725286
Energy: 1.3865380365340905
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Energy: 1.483875005422057
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Energy: 1.4130907695361403
Energy: 1.387107899981689
Energy: 1.53492636417441
Energy: 1.4592927366971087
Energy: 1.4114396616042926
Energy: 1.4041210860382032
Energy: 1.3253244140090563
Energy: 1.3871078999803605
Energy: 1.5349263641734134
Energy: 1.4592927366944515
Energy: 1.4114396616019678
Energy: 1.330228973806406
Energy: 1.395531158393468
Energy: 1.479367581182449
Energy: 1.482147660100145
Energy: 1.3684915802659119
Energy: 1.3941698656867558
Energy: 1.330228973804745
Energy: 1.3955311583941323
Energy: 1.479367581182781
Energy: 1.482147660100145
Energy: 1.4544507136490272
Energy: 1.3648302422975434
Energy: 1.3703502191676316
Energy: 1.3650519474087308
Energy: 1.510816671778435
Energy: 1.39246291149184
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Energy: 1.370350219168628
Energy: 1.3650519474671563
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Energy: 1.384278958674092
Energy: 1.4334507286521645
Energy: 1.3067486964863784
Energy: 1.5345448711955152
Energy: 1.4074784061867391
Energy: 1.382396121892136
Energy: 1.384278958678078
Energy: 1.433450728653161
Energy: 1.306748696487707
Energy: 1.3175368457462584
Energy: 1.3927074360001812
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Energy: 1.489754189645939
Energy: 1.3581745075349814
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Energy: 1.4897541896432818
Energy: 1.3458955509738668
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Energy: 1.377738871923849
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Energy: 1.377738871925842
Energy: 1.5102125343696609
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Energy: 1.4014179630894572
Energy: 1.3502558283175947
Energy: 1.478992129754682
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Energy: 1.3298627650053918
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Energy: 1.3502558283169304
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Energy: 1.403788146855437
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Energy: 1.5554022892882802
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Energy: 1.419963528963207
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Energy: 1.4178530021496945
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Energy: 1.4199635289635393
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Energy: 1.3925542406071412
Energy: 1.4140829327934783
Energy: 1.333362818833998
Energy: 1.3540278956878329
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Energy: 1.4464673376386785
Energy: 1.3925542406071412
Energy: 1.4140829327918176
Energy: 1.3333628188343303
Energy: 1.3540278956735514
Energy: 1.3925790410870955
Energy: 1.4025798899527124
Energy: 1.3256429107778778
Energy: 1.3866950192009775
Energy: 1.3176313704373894
Energy: 1.4727731465206304
Energy: 1.3925790410864312
Energy: 1.402579889948727
Energy: 1.3256429107802028
Energy: 1.3866950191993168
Energy: 1.4525227449363463
Energy: 1.3505730524610755
Energy: 1.383196602938901
Energy: 1.3703410652150672
Energy: 1.4592790339922437
Energy: 1.3538983301533551
Energy: 1.4525227449390035
Energy: 1.3505730524600792
Energy: 1.383196602941558
Energy: 1.37034106521706
Energy: 1.4264406555415767
Energy: 1.3440302344929285
Energy: 1.4012358084998813
Energy: 1.3792671466169197
Energy: 1.4744721739933324
Energy: 1.353580468509489
Energy: 1.4264406555442337
Energy: 1.3440302344932604
Energy: 1.401235808499549
Energy: 1.3792671466182485
Energy: 1.314625435117711
Energy: 1.4343658450065473
Energy: 1.3346290381287595
Energy: 1.347342749035606
Energy: 1.3961368597532584
Energy: 1.4807296434329125
Energy: 1.3146254351160502
Energy: 1.434365845008208
Energy: 1.3346290381310848
Energy: 1.347342749035606
Energy: 1.4851237311613132
Energy: 1.372917161364582
Energy: 1.396053835007522
Energy: 1.5754638707575572
Energy: 1.3976619117128974
Energy: 1.4461239122266911
Energy: 1.4851237311613132
Energy: 1.3729171613652464
Energy: 1.396053835007522
Energy: 1.5754638707595499
Energy: 1.299316333611206
Energy: 1.4859784593643528
Energy: 1.3908117466889494
Energy: 1.3831318803301635
Energy: 1.4844225718223976
Energy: 1.398553638542897
Energy: 1.2993163336092433
Energy: 1.4859784593633565
Energy: 1.3908117466866243
Energy: 1.3831318803301635
Energy: 1.3807671585936396
Energy: 1.3941170762141117
Energy: 1.3703234745234159
Energy: 1.384851561904544
Energy: 1.370290383278846
Energy: 1.4958943399049527
Energy: 1.3807671584047454
Energy: 1.3941170762151083
Energy: 1.3872482058533007
Energy: 1.3848515619032156
Energy: 1.4847794312455636
Energy: 1.3940665788496933
Energy: 1.37478463288738
Energy: 1.3219477369991988
Energy: 1.4105328496493061
Energy: 1.383876953673222
Energy: 1.4847794312518743
Energy: 1.394066578849029
Energy: 1.374784632884391
Energy: 1.321947737000195
Energy: 1.3051912425403478
Energy: 1.4482033033444304
Energy: 1.3847025267273738
Energy: 1.3953363597779016
Energy: 1.3764232381654025
Energy: 1.4209579764768543
Energy: 1.3051912425443333
Energy: 1.4482033033440982
Energy: 1.384702526729699
Energy: 1.3953363597782338
Energy: 1.3089880950728914
Energy: 1.4586649721725744
Energy: 1.3745602991623749
Energy: 1.393452379269979
Energy: 1.3464576501365733
Energy: 1.378094844729349
Energy: 1.3089880950695703
Energy: 1.458664972173903
Energy: 1.374560299162043
Energy: 1.393452379269647
Energy: 1.5487794999777669
Energy: 1.3130980710651559
Energy: 1.402242679905527
Energy: 1.3125012041802104
Energy: 1.3953460014412955
Energy: 1.3940215504128748
Energy: 1.4494764338186399
Energy: 1.3130980710634952
Energy: 1.4022426799075198
Energy: 1.312501204181539
Energy: 1.4468167014100095
Energy: 1.4761716765933204
Energy: 1.3715105703407366
Energy: 1.337027147795465
Energy: 1.4044588270764435
Energy: 1.3942002234156807
Energy: 1.4468167014076847
Energy: 1.4761716765913278
Energy: 1.3715105703350905
Energy: 1.3370271477981222
Energy: 1.3652530320181147
Energy: 1.3988911352903237
Energy: 1.4729215502852706
Energy: 1.4013276077353205
Energy: 1.3944833037855608
Energy: 1.48415474816536
Energy: 1.3652530320184468
Energy: 1.398891135290656
Energy: 1.472921550285935
Energy: 1.4013276077379775
Energy: 1.4674513314913966
Energy: 1.404609975285665
Energy: 1.4546143103203648
Energy: 1.563575611650333
Energy: 1.397379422933845
Energy: 1.373870230750496
Energy: 1.4674513314917286
Energy: 1.404609975288654
Energy: 1.454614310320697
Energy: 1.5635756116493364
Energy: 1.3720278766969551
Energy: 1.4742022051755754
Energy: 1.3687599574953573
Energy: 1.3478173451065494
Energy: 1.3375702145394464
Energy: 1.408200012499481
Energy: 1.3720278766923053
Energy: 1.474202205176572
Energy: 1.3687599574956895
Energy: 1.3478173451035604
Energy: 1.3892596633374186
Energy: 1.3530262940750983
Energy: 1.4974251035653596
Energy: 1.3925096646353057
Energy: 1.401188400136199
Energy: 1.3396151021112632
Energy: 1.3892596633350938
Energy: 1.3530262940734379
Energy: 1.4974251035633668
Energy: 1.3925096646346413
Energy: 1.3964206578306526
Energy: 1.302283544221604
Energy: 1.507886088553385
Energy: 1.3642950476472486
Energy: 1.3925287667076565
Energy: 1.3449675683838074
Energy: 1.3964206578200242
Energy: 1.3022835442252576
Energy: 1.507886088567999
Energy: 1.3642950476492415
Energy: 1.3632927277160527
Energy: 1.5392288995413814
Energy: 1.3003867945902674
Energy: 1.3263594005859456
Energy: 1.327074284545813
Energy: 1.391386335734705
Energy: 1.3632927277193743
Energy: 1.539228899545367
Energy: 1.3003867945932563
Energy: 1.3263594005876063
Energy: 1.3885380046204887
Energy: 1.5180772802081182
Energy: 1.3535371863486856
Energy: 1.389270246441969
Energy: 1.3341599076634012
Energy: 1.4245453088785045
Energy: 1.3885380046237799
Energy: 1.5180772802091147
Energy: 1.3535371979201218
Energy: 1.3892702464423012
Energy: 1.4212020169237458
Energy: 1.3721229120470366
Energy: 1.472623801528759
Energy: 1.4446145130624353
Energy: 1.377889849041334
Energy: 1.3343874069988553
Energy: 1.4212020169210888
Energy: 1.3721229120440475
Energy: 1.4726238015270985
Energy: 1.444614513061771
Energy: 1.3598716737242982
Energy: 1.4253723255538975
Energy: 1.41118369466401
Energy: 1.4552101178223096
Energy: 1.3905593964085083
Energy: 1.3841976798710276
Energy: 1.3598716739799215
Energy: 1.425372325552901
Energy: 1.4111836946673313
Energy: 1.4552101178226418
Energy: 1.3843342294230605
Energy: 1.3775954136435251
Energy: 1.408057912975618
Energy: 1.354307083490784
Energy: 1.482384080319592
Energy: 1.3272568774382814
Energy: 1.384334229421098
Energy: 1.3775954136425288
Energy: 1.408057912983589
Energy: 1.3543070834911162
Energy: 1.3430492433777856
Energy: 1.370348275812119
Energy: 1.4648197003032173
Energy: 1.5642909309577246
Energy: 1.378570960560037
Energy: 1.4677467375185171
Energy: 1.343049243377121
Energy: 1.3703482758134475
Energy: 1.4648197003038819
Energy: 1.5642909309560635
Energy: 1.3128396126733175
Energy: 1.3442974859742174
Energy: 1.3482973474383528
Energy: 1.5279968369348425
Energy: 1.4298806122248806
Energy: 1.3955996361142617
Energy: 1.312839612674978
Energy: 1.3442974859768746
Energy: 1.348297347443667
Energy: 1.5279968369398242
Energy: 1.3929474836217461
Energy: 1.3657021374499942
Energy: 1.4802291370472065
Energy: 1.305354944855865
Energy: 1.3979425354413977
Energy: 1.31184554407626
Energy: 1.3929474836207496
Energy: 1.3657021374486658
Energy: 1.4802291370468743
Energy: 1.3053549448591861

minimum gb energy = 1.2990926523762063 eV
minimum distance =  2.25096680538875 Angstroms
sigma value = 437


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

Energy: 1.488818978479755
Energy: 1.5682225002705765
Energy: 1.3907756779363458
Energy: 1.4989046862598547
Energy: 1.4108162124406127
Energy: 1.4763462295066665
Energy: 1.4888189784761245
Energy: 1.5682225002742067
Energy: 1.3907756779714366
Energy: 1.4989046860844557
Energy: 1.4042276440906094
Energy: 1.5344880247327204
Energy: 1.3798779949723288
Energy: 1.3756611826836056
Energy: 1.4635888472482548
Energy: 1.408055398343502
Energy: 1.4042276440930292
Energy: 1.5344880247315105
Energy: 1.3798779949699087
Energy: 1.3756611826848157
Energy: 1.3428218168293307
Energy: 1.4261276783900012
Energy: 1.5428415540472658
Energy: 1.3590464020217525
Energy: 1.4905162387163264
Energy: 1.443220841339642
Energy: 1.3428218168281207
Energy: 1.4261276783875811
Energy: 1.5428415540521057
Energy: 1.3590464020205424
Energy: 1.6169094221658356
Energy: 1.4144254601152544
Energy: 1.3905141902824707
Energy: 1.3519755559942679
Energy: 1.3774697362056039
Energy: 1.4371390972789118
Energy: 1.6169094221622053
Energy: 1.4144254601140442
Energy: 1.3905141902824707
Energy: 1.351975555995478
Energy: 1.3554261890347619
Energy: 1.3614197262584573
Energy: 1.375489206574925
Energy: 1.6415795935029116
Energy: 1.346858359812517
Energy: 1.3674972036544777
Energy: 1.3554261890383918
Energy: 1.3614197262608776
Energy: 1.375489206577345
Energy: 1.6415795935053314
Energy: 1.3453172748795534
Energy: 1.5040533594357959
Energy: 1.363039375268582
Energy: 1.3485082192724676
Energy: 1.3385071685023766
Energy: 1.5175375586132078
Energy: 1.3453172748819733
Energy: 1.504053359423696
Energy: 1.3630393752661618
Energy: 1.3485082192736777
Energy: 1.5311043276593024
Energy: 1.3553484220165222
Energy: 1.445569172117169
Energy: 1.3485837439401067
Energy: 1.3697660400195881
Energy: 1.4262881654100819
Energy: 1.5311043276617224
Energy: 1.3553484220189425
Energy: 1.4455691721220092
Energy: 1.3485837439353217
Energy: 1.363235228248901
Energy: 1.4452201427858022
Energy: 1.378751988666524
Energy: 1.3471409667581458
Energy: 1.5317242829585604
Energy: 1.413816569556553
Energy: 1.363235228246481
Energy: 1.4452201427870124
Energy: 1.3787519886544237
Energy: 1.3471409667557255
Energy: 1.419175716761903
Energy: 1.3918230959962503
Energy: 1.6017214239334234
Energy: 1.3451747896785502
Energy: 1.3914718264581751
Energy: 1.4677860438823458
Energy: 1.419175716763113
Energy: 1.3918230960010904
Energy: 1.6017214239346336
Energy: 1.3451747896979107
Energy: 1.4030493754172237
Energy: 1.4038455396252458
Energy: 1.3649741557398425
Energy: 1.3543416733509184
Energy: 1.374297975121113
Energy: 1.6109606912647487
Energy: 1.4030493753265267
Energy: 1.4038455396688068
Energy: 1.3649741557422628
Energy: 1.3543416733521283
Energy: 1.578695977674874
Energy: 1.4168741456878013
Energy: 1.3752909754220508
Energy: 1.3755468300247602
Energy: 1.4405626184982927
Energy: 1.36245477188275
Energy: 1.5786959776760836
Energy: 1.4168741456950067
Energy: 1.3752909754220508
Energy: 1.3755468300296003
Energy: 1.3231291037579815
Energy: 1.4358973653089058
Energy: 1.5675675427932825
Energy: 1.3267800597466575
Energy: 1.556935008670115
Energy: 1.4460829134910347
Energy: 1.3231291037603468
Energy: 1.4358973653089058
Energy: 1.5675675427969125
Energy: 1.3267800597466575
Energy: 1.321266771242471
Energy: 1.4157256454076808
Energy: 1.4881233406719958
Energy: 1.3758625234310589
Energy: 1.375919098731408
Energy: 1.435313773785295
Energy: 1.3212667712485213
Energy: 1.4157256454052605
Energy: 1.4881233406732057
Energy: 1.3758625234334787
Energy: 1.5131397155522406
Energy: 1.4931353984638203
Energy: 1.3769519956157756
Energy: 1.5612844155898407
Energy: 1.3643263746375052
Energy: 1.4682978576545143
Energy: 1.5131397155679709
Energy: 1.4931353980453161
Energy: 1.3769519956133556
Energy: 1.5612844155910508

minimum gb energy = 1.321266771242471 eV
minimum distance =  2.22315261037866 Angstroms
sigma value = 33