Model name: model_name=Sim_LAMMPS_EAM_EichBeinkeSchmitz_2015_FeCr__SM_731771351835_000
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=2.855312466621399
cohesive_energy=4.013297947344727
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: 0.014075695865157223
Energy: 0.014547010692898403
Energy: 0.01432008958936832
Energy: 1.851508592709302
Energy: 0.01432008958936832
Energy: 0.014547010692661436
Energy: 0.014075695865394193
Energy: 0.014547010692898403
Energy: 0.014320089589605286
Energy: 1.4458973738285679
Energy: 0.6817533776950969
Energy: 0.01603857083964843
Energy: 0.01639938828093853
Energy: 0.6713212263727905
Energy: 0.01639938828070156
Energy: 0.01603857083941146
Energy: 0.6817533776948599
Energy: 0.016038570838489915
Energy: 0.016399388281386137
Energy: 0.6713212263727905
Energy: 0.014075695865157223
Energy: 0.014547010692661436
Energy: 0.014320089589131349
Energy: 1.7590118764373153
Energy: 0.01432008958936832
Energy: 0.014547010692187496
Energy: 0.014075695865394193
Energy: 0.014547010692187496
Energy: 0.014320089589131349
Energy: 1.4458973738304108
Energy: 0.6817533776955444
Energy: 0.01603857083941146
Energy: 0.016399388280464593
Energy: 0.6713212263727905
Energy: 0.01639938828070156
Energy: 0.01603857083941146
Energy: 0.6817533776948599
Energy: 0.016038570838937522
Energy: 0.016399388281175497
Energy: 0.6713212263727905
Energy: 0.014075695865157223
Energy: 0.014547010692898403
Energy: 0.014320089589131349
Energy: 1.4458973738294894
Energy: 0.01432008958936832
Energy: 0.014547010692424466
Energy: 0.014075695865394193
Energy: 0.014547010692661436
Energy: 0.014320089589131349
Energy: 1.4458973738299632
Energy: 0.681753377694623
Energy: 0.01603857083964843
Energy: 0.01639938828070156
Energy: 0.6713212263727905
Energy: 0.01639938828070156
Energy: 0.01603857083941146
Energy: 0.6817533776957815
Energy: 0.016038570838489915
Energy: 0.016399388281386137
Energy: 0.6713212263727905
Energy: 0.014075695864920254
Energy: 0.014547010692661436
Energy: 0.01432008958936832
Energy: 1.4458973738294894
Energy: 0.01432008958936832
Energy: 0.014547010691976859
Energy: 0.014075695865394193
Energy: 0.014547010692661436
Energy: 0.014320089589605286
Energy: 1.4458973738327277

minimum gb energy = 0.014075695864920254 eV
minimum distance =  2.26848718829343 Angstroms
sigma value = 3


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

Energy: 1.514383247436086
Energy: 1.4108073017792213
Energy: 1.4742723473830324
Energy: 1.4053022789870924
Energy: 1.4540714978016362
Energy: 1.345802287573771
Energy: 1.5143832474366536
Energy: 1.4108073018047615
Energy: 1.4742723473830324
Energy: 1.4053022789865253
Energy: 1.4122230318954248
Energy: 1.3300580053746234
Energy: 1.4472493292326727
Energy: 1.5511011632781142
Energy: 1.3634000188424358
Energy: 1.314014645485838
Energy: 1.412223031897695
Energy: 1.3300580053723532
Energy: 1.4472493292315376
Energy: 1.5511011632792495
Energy: 1.378683480364988
Energy: 1.3164193193316005
Energy: 1.3169820693106562
Energy: 1.3232439578291921
Energy: 1.43793471523305
Energy: 1.2670310077875166
Energy: 1.3786834803638528
Energy: 1.3164193193350058
Energy: 1.3169820693100889
Energy: 1.3232439578274897
Energy: 1.3777103134816613
Energy: 1.3017852099640779
Energy: 1.2919303514028457
Energy: 1.3309563947257916
Energy: 1.286617543307202
Energy: 1.331043368237982
Energy: 1.3777103134799586
Energy: 1.3017852099629428
Energy: 1.2919303514034135
Energy: 1.3309563947269265
Energy: 1.3051590700520208
Energy: 1.3011139130599707
Energy: 1.2899690674487527
Energy: 1.293640333209123
Energy: 1.3024040285608247
Energy: 1.37629691711413
Energy: 1.3051590700520208
Energy: 1.301113913059403
Energy: 1.289969067448185
Energy: 1.2936403332096909
Energy: 1.391928002792787
Energy: 1.3356626692034475
Energy: 1.3011309192858498
Energy: 1.2670347209238542
Energy: 1.3205184715039526
Energy: 1.3217949917501624
Energy: 1.3919280027933545
Energy: 1.3356626692034475
Energy: 1.3011309192864173
Energy: 1.2670347209300972
Energy: 1.3181062019516092
Energy: 1.2913604050526108
Energy: 1.360270706555737
Energy: 1.3240991362988774
Energy: 1.3542170381282652
Energy: 1.4759020551931905
Energy: 1.3181062019516092
Energy: 1.291360405053746
Energy: 1.360270706556872
Energy: 1.3240991362954724
Energy: 1.4802514972727518
Energy: 1.4664132883129413
Energy: 1.3153994337999448
Energy: 1.3259890262958105
Energy: 1.327159023469283
Energy: 1.4014956182781888
Energy: 1.4802514972727518
Energy: 1.46641328829705
Energy: 1.3153994337931343
Energy: 1.3259890262941076
Energy: 1.347930616391607
Energy: 1.4425140834954662
Energy: 1.396037023677591
Energy: 1.44007498152791
Energy: 1.3379025700200635
Energy: 1.429555537908314
Energy: 1.3479306163927425
Energy: 1.4425140834931958
Energy: 1.3960370236747532
Energy: 1.4400749815324503
Energy: 1.3711982507248248
Energy: 1.4264923913079621
Energy: 1.4122162031652814
Energy: 1.4918252108703403
Energy: 1.4826545594745766
Energy: 1.4709696268850503
Energy: 1.4108669114411845
Energy: 1.42649239130853
Energy: 1.4122162031658487
Energy: 1.4918252108697727
Energy: 1.3005757516322347
Energy: 1.3477914728377831
Energy: 1.3587107863379198
Energy: 1.325338162898169
Energy: 1.3143158693197818
Energy: 1.386726566914866
Energy: 1.3005757516339371
Energy: 1.3477914728383507
Energy: 1.3587107863379198
Energy: 1.3253381628976013
Energy: 1.3057905457153376
Energy: 1.266798571453929
Energy: 1.3033343019236354
Energy: 1.4084664138239258
Energy: 1.3755027542147826
Energy: 1.330912324731507
Energy: 1.3057905457142023
Energy: 1.2667985714550642
Energy: 1.3033343019236354
Energy: 1.4084664138233582
Energy: 1.2942598428288856
Energy: 1.3136357673192751
Energy: 1.3294222717239863
Energy: 1.2960103353066734
Energy: 1.3303652178923286
Energy: 1.420107257722534
Energy: 1.2942598428294534
Energy: 1.3136357673204102
Energy: 1.3294222717239863
Energy: 1.296010335307241
Energy: 1.294437754010152
Energy: 1.3377374707085365
Energy: 1.309867449236024
Energy: 1.3082855973621077
Energy: 1.3659962418458709
Energy: 1.3107488147074804
Energy: 1.2944377540095846
Energy: 1.337737470709104
Energy: 1.3098674492365918
Energy: 1.3082855973609726
Energy: 1.3435027722314192
Energy: 1.3102935386344665
Energy: 1.2694122559303336
Energy: 1.319127740053382
Energy: 1.3281338483424434
Energy: 1.3806220298009553
Energy: 1.3435027722325543
Energy: 1.3102935386333314
Energy: 1.2694122559314687
Energy: 1.319127740052247
Energy: 1.3252215773754314
Energy: 1.3551478031294963
Energy: 1.3603490085595746
Energy: 1.4082317429275517
Energy: 1.3704038459623424
Energy: 1.3259812463432274
Energy: 1.3252215773765668
Energy: 1.3551478031328503
Energy: 1.3603490085590069
Energy: 1.4082317429269842
Energy: 1.5154023881364913
Energy: 1.299288554788498
Energy: 1.4249946323664415
Energy: 1.376879495179436
Energy: 1.4750012238827046
Energy: 1.4640868484973348
Energy: 1.5154023881143566
Energy: 1.2992885547936057
Energy: 1.4249946323664415
Energy: 1.3363273060639018
Energy: 1.47193755287101
Energy: 1.4060348018854476
Energy: 1.4484374148615384
Energy: 1.367538948253211
Energy: 1.4332900809277875
Energy: 1.3482037749011841
Energy: 1.4719375528693073
Energy: 1.4060348013533412
Energy: 1.4484374148632408
Energy: 1.367538948254346
Energy: 1.3268109149478953
Energy: 1.3241944218513007
Energy: 1.4462332691196245
Energy: 1.2869141208154293
Energy: 1.4002521063695061
Energy: 1.3123161836244084
Energy: 1.326810914945625
Energy: 1.3241944218524357
Energy: 1.446233269119057
Energy: 1.2869141208171322
Energy: 1.325370267376568
Energy: 1.4020111448887649
Energy: 1.29255335740254
Energy: 1.295217856874426
Energy: 1.3705167016227038
Energy: 1.313686746943812
Energy: 1.3253702673760006
Energy: 1.40201114488536
Energy: 1.29255335740254
Energy: 1.2952178568738582
Energy: 1.272523151630378
Energy: 1.3019122281443252
Energy: 1.3955799004938243
Energy: 1.4440051671505687
Energy: 1.3229012796005795
Energy: 1.306846592794641
Energy: 1.2725231516315132
Energy: 1.30191222814319
Energy: 1.3955799004932568
Energy: 1.4440051671500014
Energy: 1.294668628644086
Energy: 1.2906961454953652
Energy: 1.3011024809366931
Energy: 1.3050650313245267
Energy: 1.346214386913044
Energy: 1.3908100150364924
Energy: 1.2946686286435183
Energy: 1.2906961454953652
Energy: 1.301102480938963
Energy: 1.3050650313239593
Energy: 1.3180565659579835
Energy: 1.2942263419805065
Energy: 1.284075948070302
Energy: 1.484199588793065
Energy: 1.3198959089476956
Energy: 1.2874856553849965
Energy: 1.3180565659585513
Energy: 1.2942263419816415
Energy: 1.284075948070302
Energy: 1.484199588793065
Energy: 1.3206145061362744
Energy: 1.3177593256433493
Energy: 1.3436508055372995
Energy: 1.3785476100226335
Energy: 1.2992772743396261
Energy: 1.4582371414833597
Energy: 1.320614506135707
Energy: 1.317759325646187
Energy: 1.3039673770826294
Energy: 1.3785476100209308
Energy: 1.3959139754240737
Energy: 1.4457054595302425
Energy: 1.3417020701021591
Energy: 1.4535853103517924
Energy: 1.3142469210702636
Energy: 1.3440796028848123
Energy: 1.3959139754399652
Energy: 1.44570545953081
Energy: 1.341702070107267
Energy: 1.4535853103495222
Energy: 1.4137294291468658
Energy: 1.454802694214385
Energy: 1.3847220658700048
Energy: 1.48054115287002
Energy: 1.3617421874988715
Energy: 1.4742723473813295
Energy: 1.4040764589899866
Energy: 1.4548026942160879
Energy: 1.3847220658688695
Energy: 1.4805411528666148
Energy: 1.5511011632775469
Energy: 1.3634000188435709
Energy: 1.3140146454847028
Energy: 1.4122230318982623
Energy: 1.3300580053621889
Energy: 1.4472493292315376
Energy: 1.551101163278682
Energy: 1.3634000188424358
Energy: 1.3140146454852704
Energy: 1.4122230318971272
Energy: 1.3206145061362744
Energy: 1.4379347152324824
Energy: 1.3514783346112342
Energy: 1.378683480364988
Energy: 1.3164193193321678
Energy: 1.3169820693106562
Energy: 1.320614506135707
Energy: 1.4379347152319149
Energy: 1.2670310077268403
Energy: 1.3786834803644201
Energy: 1.330956394726359
Energy: 1.286617543324796
Energy: 1.3304498636456448
Energy: 1.3777103134799586
Energy: 1.3017852099646456
Energy: 1.2919303514045486
Energy: 1.330956394727494
Energy: 1.2866175433236609
Energy: 1.330449863646212
Energy: 1.3777103134816613

minimum gb energy = 1.266798571453929 eV
minimum distance =  2.21918590365193 Angstroms
sigma value = 75


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

Energy: 1.633435010437449
Energy: 1.4728744715102322
Energy: 1.4392898512349503
Energy: 1.407409436228411
Energy: 1.4532758379062052
Energy: 1.5622452254204022
Energy: 1.6334350104391107
Energy: 1.472874471506632
Energy: 1.4392898470697113
Energy: 1.4552437875884565
Energy: 1.4260779083238322
Energy: 1.4476288894243348
Energy: 1.4645613779269726
Energy: 1.5708247834416746
Energy: 1.4378031765353718
Energy: 1.4405622063868164
Energy: 1.426077908324109
Energy: 1.4590375395156534
Energy: 1.4645613779272495
Energy: 1.5394785647586844
Energy: 1.362710297626929
Energy: 1.3620549210424886
Energy: 1.3449996749864934
Energy: 1.3542306501377843
Energy: 1.406615120430242
Energy: 1.415136217968871
Energy: 1.362710297626929
Energy: 1.3620549210422115
Energy: 1.34499967498677
Energy: 1.3542306501377843
Energy: 1.403527739950562
Energy: 1.4366831945686913
Energy: 1.346269137781803
Energy: 1.3561767652813685
Energy: 1.3518295923625678
Energy: 1.3456692897791804
Energy: 1.403527739950562
Energy: 1.436683194565922
Energy: 1.3462691377809723
Energy: 1.3561767652813685
Energy: 1.3357896932093667
Energy: 1.3402365184273455
Energy: 1.4650707161283845
Energy: 1.4378901474461219
Energy: 1.5042509463200333
Energy: 1.373576942973732
Energy: 1.3357896932101974
Energy: 1.3402365184270686
Energy: 1.4650707161289382
Energy: 1.4378901474450139
Energy: 1.5216384001054168
Energy: 1.5329950680510414
Energy: 1.3998315046752827
Energy: 1.4357715862352016
Energy: 1.452111165800359
Energy: 1.468734620388626
Energy: 1.521638400105694
Energy: 1.5329950680532567
Energy: 1.3998315046738978
Energy: 1.4357715862365863
Energy: 1.5480888953269707
Energy: 1.4940878384213967
Energy: 1.4960076044456831
Energy: 1.461541369035098
Energy: 1.4263551055784822
Energy: 1.5066943435368032
Energy: 1.5480888953269707
Energy: 1.4940878384266583
Energy: 1.4960076044481756
Energy: 1.461541369035098
Energy: 1.4499682717777496
Energy: 1.5080458566450883
Energy: 1.3667884562091068
Energy: 1.460503607589185
Energy: 1.5145135147664166
Energy: 1.4177995607900864
Energy: 1.4499682717783033
Energy: 1.508045856646196
Energy: 1.3667884562096606
Energy: 1.4605036075883542
Energy: 1.3979448377246273
Energy: 1.3417753943682202
Energy: 1.3645114738965676
Energy: 1.345225204083979
Energy: 1.3520427022844412
Energy: 1.3694264224297574
Energy: 1.3979448377235195
Energy: 1.3417753943682202
Energy: 1.3645114738985062
Energy: 1.3452252040848096
Energy: 1.3627344536697519
Energy: 1.4277856118048082
Energy: 1.5258242226667262
Energy: 1.3457014449089832
Energy: 1.3668223435551177
Energy: 1.3538931397905054
Energy: 1.3627344536675363
Energy: 1.4277856118039773
Energy: 1.525824222667557
Energy: 1.3457014449089832
Energy: 1.409790059701627
Energy: 1.4117875014202566
Energy: 1.3416487940089927
Energy: 1.430020710110278
Energy: 1.4376025749950532
Energy: 1.466691294905402
Energy: 1.4097900597032884
Energy: 1.3918878210187222
Energy: 1.3416487940095463
Energy: 1.437777006203059
Energy: 1.493013898260764
Energy: 1.5153249242869704
Energy: 1.5246463739626825
Energy: 1.3972498919362686
Energy: 1.4403568825598203
Energy: 1.4202561130498579
Energy: 1.493013898261041
Energy: 1.5153249242886324
Energy: 1.5246463739618519
Energy: 1.3972498919368226
Energy: 1.4344068509433878
Energy: 1.4219329962829383
Energy: 1.4947536984909984
Energy: 1.469220557240003
Energy: 1.46083328879202
Energy: 1.4425127544267575
Energy: 1.434406850942557
Energy: 1.4219329962832152
Energy: 1.4947536985684906
Energy: 1.4692205572422188
Energy: 1.4687977770588123
Energy: 1.4417953235452252
Energy: 1.4443483972524012
Energy: 1.3718987146091903
Energy: 1.504789172824695
Energy: 1.4176150121690907
Energy: 1.4687977770601968
Energy: 1.4417953235443945
Energy: 1.4443483972521243
Energy: 1.3718987146100212
Energy: 1.5659580633411097
Energy: 1.4501419817081584
Energy: 1.3411333347387617
Energy: 1.3764657482124019
Energy: 1.3457860116311582
Energy: 1.3536651662215835
Energy: 1.5659580633408325
Energy: 1.4501419817078813
Energy: 1.3411333347390388
Energy: 1.4278338421932406
Energy: 1.3577166262802984
Energy: 1.345964287416855
Energy: 1.4188211829392463
Energy: 1.3408865713890248
Energy: 1.3445234774334114
Energy: 1.3746624047836518
Energy: 1.3577166262797447
Energy: 1.3459642874165783
Energy: 1.4188211829384154
Energy: 1.3408865713890248
Energy: 1.4976248837317083
Energy: 1.3794638577957163
Energy: 1.3930585802791293
Energy: 1.3421563756999884
Energy: 1.437721518066413
Energy: 1.440813201859211
Energy: 1.4976248837317083
Energy: 1.3794638575598663
Energy: 1.3930585802796833
Energy: 1.3421563756997112
Energy: 1.4102190702851385
Energy: 1.4669807388282596
Energy: 1.5521776350364207
Energy: 1.5032697863151843
Energy: 1.3925511884948851
Energy: 1.4336410459189182
Energy: 1.4102190702837536
Energy: 1.4669807388282596
Energy: 1.552177635035867
Energy: 1.5032697863165687
Energy: 1.4493366228225562
Energy: 1.4603229204749884
Energy: 1.4151494991101323
Energy: 1.507382731539479
Energy: 1.5773019451790091
Energy: 1.4731782554578505
Energy: 1.4493366228220024
Energy: 1.4603229204749884
Energy: 1.4151494991090243
Energy: 1.5073827315369865
Energy: 1.423412959099876
Energy: 1.4366364106011722
Energy: 1.438335311478265
Energy: 1.3406705230128284
Energy: 1.3930585802805142
Energy: 1.4862260033751882
Energy: 1.423412959100153
Energy: 1.4366364105931406
Energy: 1.438335311478819
Energy: 1.3406705230125517
Energy: 1.3570607756974293
Energy: 1.3746624047833746
Energy: 1.34604223260344
Energy: 1.340753539793052
Energy: 1.4188211829373074
Energy: 1.3454827138838559
Energy: 1.3570607756963213
Energy: 1.3746624047836518
Energy: 1.3460422326056305
Energy: 1.3407535397927748
Energy: 1.3815844172987612
Energy: 1.3537519389841013
Energy: 1.3455436600498718
Energy: 1.3765161363177147
Energy: 1.3412666690299584
Energy: 1.411230066781937
Energy: 1.3815844172982075
Energy: 1.353751938984655
Energy: 1.3455436600484871
Energy: 1.3765161363188227
Energy: 1.4681122639816484
Energy: 1.4853979589131188
Energy: 1.4358381764089572
Energy: 1.3718075117411899
Energy: 1.4427963584016401
Energy: 1.4400976653390234
Energy: 1.468112263980264
Energy: 1.4853979589100723
Energy: 1.4358381764078492
Energy: 1.3718075117411899
Energy: 1.4433217639282305
Energy: 1.4289348923821215
Energy: 1.461855054201678
Energy: 1.4899682865136392
Energy: 1.4932568385026086
Energy: 1.404167782373146
Energy: 1.4433217639279534
Energy: 1.4289348923821215
Energy: 1.461855054201401
Energy: 1.489968286515578
Energy: 1.4942874796428804
Energy: 1.450005286300298
Energy: 1.434508656058536
Energy: 1.4674555015408681
Energy: 1.586178575491844
Energy: 1.5864299290059054
Energy: 1.494287479645096
Energy: 1.4500052862994672
Energy: 1.4345086560599207
Energy: 1.467455501541699
Energy: 1.6202649461787402
Energy: 1.3927071067664019
Energy: 1.4382316445307388
Energy: 1.4417021228660645
Energy: 1.3416803779296989
Energy: 1.391875294540693
Energy: 1.6202649461790173
Energy: 1.3927071067669556
Energy: 1.4382316445318462
Energy: 1.4417021228660645
Energy: 1.366320369505373
Energy: 1.3535826676659621
Energy: 1.3668223435470868
Energy: 1.3450194040062222
Energy: 1.4444383709117397
Energy: 1.4277856118070238
Energy: 1.3663203695048194
Energy: 1.35358266766707
Energy: 1.3668223435484714
Energy: 1.345019404006776
Energy: 1.3548362568943642
Energy: 1.575233080057439
Energy: 1.3524537022705325
Energy: 1.3455910378976907
Energy: 1.3356737079110796
Energy: 1.341359638999468
Energy: 1.3548362568946413
Energy: 1.575233080057993
Energy: 1.3524537022710863
Energy: 1.3455910378976907
Energy: 1.4417225629706334
Energy: 1.4379101639420802
Energy: 1.4979950046649255
Energy: 1.462916086224461
Energy: 1.3690147186868915
Energy: 1.44181471308912
Energy: 1.4417225629709105
Energy: 1.4379101639406955
Energy: 1.4979950046665869
Energy: 1.4629160862227994
Energy: 1.4774823723164185
Energy: 1.4388960868361544
Energy: 1.4409703026084184
Energy: 1.4713884516756908
Energy: 1.5595466747275777
Energy: 1.4938822689112723
Energy: 1.47748237231808
Energy: 1.4388960868350467
Energy: 1.4409703026084184
Energy: 1.4713884516759677
Energy: 1.4197449508223532
Energy: 1.4638495385874142
Energy: 1.432471814191066
Energy: 1.4381514071226036
Energy: 1.4002611198705188
Energy: 1.5059223452531347
Energy: 1.41974495082263
Energy: 1.4638495385849213
Energy: 1.432471814190235
Energy: 1.4381514071237116
Energy: 1.3609360000295405
Energy: 1.4676571449740479
Energy: 1.425057555072442
Energy: 1.4366590948360287
Energy: 1.4583475340079421
Energy: 1.3404366703556636
Energy: 1.3609360000298176
Energy: 1.4676571449746016
Energy: 1.4250575550710571
Energy: 1.4366590948368598
Energy: 1.436735359261098
Energy: 1.3468260471816784
Energy: 1.3564959762592075
Energy: 1.3559326491837331
Energy: 1.345521961925231
Energy: 1.367936752183398
Energy: 1.4367353592613752
Energy: 1.3468260471805706
Energy: 1.3564959762589304
Energy: 1.3559326491840098
Energy: 1.3629664773267265
Energy: 1.4714874358956633
Energy: 1.5112644753096
Energy: 1.352839013403222
Energy: 1.3472794324250414
Energy: 1.3497229641746777
Energy: 1.3629664773258956
Energy: 1.471487435896217
Energy: 1.5112644753096
Energy: 1.3528390134026682
Energy: 1.4076472055863516
Energy: 1.4027175895462984
Energy: 1.437932354782039
Energy: 1.5279697940087578
Energy: 1.467000398530884
Energy: 1.459072935290926
Energy: 1.4076472055869056
Energy: 1.4027175895474058
Energy: 1.4379323547834237
Energy: 1.5279697940079269
Energy: 1.633435010420002
Energy: 1.4728744715038626
Energy: 1.439289868740692
Energy: 1.407625204990026
Energy: 1.4532758379117439
Energy: 1.5622452254206793
Energy: 1.6334350104327409
Energy: 1.4728744715082938
Energy: 1.4392898667044471
Energy: 1.4076252049908569
Energy: 1.4260779083213397
Energy: 1.4193446601638242
Energy: 1.4645613779272495
Energy: 1.5394785647575766
Energy: 1.4378031765389716
Energy: 1.440562206387924
Energy: 1.4260779083238322
Energy: 1.419344660164932
Energy: 1.4645613779283575
Energy: 1.5394785647550842
Energy: 1.362710297627483
Energy: 1.3620549210422115
Energy: 1.3449996749873243
Energy: 1.3542306501380612
Energy: 1.4066151204299653
Energy: 1.4151362179683171
Energy: 1.362710297627206
Energy: 1.3620549210422115
Energy: 1.34499967498677
Energy: 1.3542306501380612
Energy: 1.403527739950562
Energy: 1.4366831945786611
Energy: 1.346269137785403
Energy: 1.3561767652810914
Energy: 1.3518295923633985
Energy: 1.3456692897777958
Energy: 1.4035277399513926
Energy: 1.436683194575338
Energy: 1.3462691377845726
Energy: 1.3561767652813685
Energy: 1.3357896932107511
Energy: 1.3402365184276226
Energy: 1.4650707161289382
Energy: 1.4378901474450139
Energy: 1.5042509463200333
Energy: 1.3735769429723472
Energy: 1.3357896932099202
Energy: 1.3402365184270686
Energy: 1.4650707161281074
Energy: 1.437890147446399
Energy: 1.521638400104863
Energy: 1.5329950680529798
Energy: 1.3998315046738978
Energy: 1.4357715862332632
Energy: 1.4521111658028514
Energy: 1.4687346203891798
Energy: 1.5216384001029244
Energy: 1.5329950680510414
Energy: 1.3998315046747287
Energy: 1.4357715862352016
Energy: 1.5480888953286325
Energy: 1.4940878384272125
Energy: 1.4960076044387847
Energy: 1.4615413690348211
Energy: 1.4263551055787589
Energy: 1.5066943435401265
Energy: 1.54808889532974
Energy: 1.494087838424997
Energy: 1.4960076044368464
Energy: 1.4615413690359287
Energy: 1.4499682717774725
Energy: 1.5080458566450883
Energy: 1.3667884562110455
Energy: 1.4605036075880773
Energy: 1.5145135147647548
Energy: 1.4177995607851015
Energy: 1.4499682717777496
Energy: 1.5080458566445345
Energy: 1.3667884562093837
Energy: 1.460503607589185
Energy: 1.3979448377271197
Energy: 1.341775394369051
Energy: 1.3645114738982294
Energy: 1.3452252040842556
Energy: 1.3520427022841641
Energy: 1.3694264224325268
Energy: 1.3979448377262889
Energy: 1.341775394368497
Energy: 1.3645114738979525
Energy: 1.345225204083979
Energy: 1.3627344536691983
Energy: 1.4277856118045311
Energy: 1.5258242226670031
Energy: 1.3457014449089832
Energy: 1.366822343554564
Energy: 1.3538931397907823
Energy: 1.3627344536678134
Energy: 1.4277856118064696
Energy: 1.5258242226672798
Energy: 1.3457014449111986
Energy: 1.4097900597007962
Energy: 1.4117875014202566
Energy: 1.3416487940087156
Energy: 1.4377770062025053
Energy: 1.43760257499533
Energy: 1.4666912949078943
Energy: 1.409790059702181
Energy: 1.4117875014208103
Energy: 1.3416487940087156
Energy: 1.4377770062013975
Energy: 1.493013898260764
Energy: 1.5153249242836473
Energy: 1.5246463739925917
Energy: 1.3972498919362686
Energy: 1.4403568825620356
Energy: 1.4202561130487499
Energy: 1.493013898261041
Energy: 1.5153249242830935
Energy: 1.5246463739917608
Energy: 1.3972498919357146
Energy: 1.4344068509173555
Energy: 1.4219329962843228
Energy: 1.4947536983680887
Energy: 1.4692205572297818
Energy: 1.460833288792297
Energy: 1.5006866889108568
Energy: 1.4344068509217864
Energy: 1.4219329962854306
Energy: 1.4947536985743062
Energy: 1.4692205572336337
Energy: 1.4687977770596432
Energy: 1.4417953235435637
Energy: 1.4443483972515705
Energy: 1.4180581744920542
Energy: 1.5047891728233103
Energy: 1.4176150121696447
Energy: 1.4687977770577043
Energy: 1.4417953235443945
Energy: 1.4443483972507396
Energy: 1.4180581744920542
Energy: 1.5659580633405557
Energy: 1.4696411184327443
Energy: 1.3411333347393155
Energy: 1.4278338421932406
Energy: 1.345786011631989
Energy: 1.3536651662218606
Energy: 1.5659580633411097
Energy: 1.4696411184327443
Energy: 1.3411333347387617
Energy: 1.4278338421929637
Energy: 1.3577166262797447
Energy: 1.3459642874157476
Energy: 1.4188211829378614
Energy: 1.3408865713890248
Energy: 1.3445234774323036
Energy: 1.3746624047833746
Energy: 1.357716626280852
Energy: 1.345964287417132
Energy: 1.418821182940077
Energy: 1.340886571388748
Energy: 1.4976248837344777
Energy: 1.3794638571119828
Energy: 1.3930585802796833
Energy: 1.342156375701373
Energy: 1.437721518066967
Energy: 1.4408132018583801
Energy: 1.4976248837350317
Energy: 1.3794638562389
Energy: 1.3930585802796833
Energy: 1.3421563757016501
Energy: 1.4102190702848616
Energy: 1.4669807388290905
Energy: 1.5521776350369745
Energy: 1.5032697863079838
Energy: 1.392551188496547
Energy: 1.4336410458007163
Energy: 1.4102190702840305
Energy: 1.4669807388293674
Energy: 1.5521776350375287
Energy: 1.5032697863088147
Energy: 1.4493366228214484
Energy: 1.4603229204741575
Energy: 1.4151494991093014
Energy: 1.507382731574348
Energy: 1.5773019451828865
Energy: 1.4731782554578505
Energy: 1.4493366228220024
Energy: 1.4603229204791424
Energy: 1.4151494991101323
Energy: 1.5073827315663169
Energy: 1.423412959099876
Energy: 1.4366364105341785
Energy: 1.4383353114785422
Energy: 1.3406705230133824
Energy: 1.3930585802805142
Energy: 1.4862260033751882
Energy: 1.4234129590995992
Energy: 1.4366364105269782
Energy: 1.438335311478819
Energy: 1.3406705230133824
Energy: 1.3570607756960444
Energy: 1.3746624047836518
Energy: 1.3460422326042456
Energy: 1.3407535397927748
Energy: 1.4188211829375845
Energy: 1.3454827138841328
Energy: 1.3570607756957673
Energy: 1.3746624047844822
Energy: 1.3460422326026094
Energy: 1.340753539793052
Energy: 1.3815844172982075
Energy: 1.3537519389841013
Energy: 1.3455436600504256
Energy: 1.3765161363188227
Energy: 1.3412666690299584
Energy: 1.41123006678166
Energy: 1.3815844172982075
Energy: 1.3537519389838242
Energy: 1.3455436600484871
Energy: 1.3765161363185459
Energy: 1.468112263980264
Energy: 1.4853979589122879
Energy: 1.4358381764059107
Energy: 1.3718075117386974
Energy: 1.442796358401917
Energy: 1.4400976653390234
Energy: 1.4681122639805406
Energy: 1.4853979589122879
Energy: 1.4358381764072954
Energy: 1.3718075117403592

minimum gb energy = 1.3356737079110796 eV
minimum distance =  2.2100301783093 Angstroms
sigma value = 105


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

Energy: 1.532968062439459
Energy: 1.413369820175958
Energy: 1.4280849757183505
Energy: 1.4397881379484787
Energy: 1.363388939535714
Energy: 1.4828098802489367
Energy: 1.532968062439459
Energy: 1.413369820175958
Energy: 1.4280849758404812
Energy: 1.3957362599029197
Energy: 1.3613664384668323
Energy: 1.4292407617317988
Energy: 1.363127418312159
Energy: 1.471577763323423
Energy: 1.3360831692050064
Energy: 1.3800841740981578
Energy: 1.361366438467145
Energy: 1.4292407617324232
Energy: 1.3631274183118465
Energy: 1.471577763322798
Energy: 1.3283412940925543
Energy: 1.3243059826550772
Energy: 1.3590334672096063
Energy: 1.341358448681862
Energy: 1.3324965963103754
Energy: 1.3619002844241543
Energy: 1.3283412940925543
Energy: 1.3243059826550772
Energy: 1.3590334672092936
Energy: 1.341358448681862
Energy: 1.425770705965152
Energy: 1.5568266858931668
Energy: 1.3408627850971448
Energy: 1.3413846409284664
Energy: 1.552799824886582
Energy: 1.3242685680408788
Energy: 1.4257707059654643
Energy: 1.5568266858931668
Energy: 1.3408627850971448
Energy: 1.3413846409284664
Energy: 1.3662819650552724
Energy: 1.3401844627973107
Energy: 1.5365069789509616
Energy: 1.363660383451676
Energy: 1.3643271062681301
Energy: 1.348710811174269
Energy: 1.3662819650552724
Energy: 1.3401844627976232
Energy: 1.5365069789509616
Energy: 1.3636603834532384
Energy: 1.5501357719345978
Energy: 1.392974496624399
Energy: 1.4295378097686355
Energy: 1.36446787497898
Energy: 1.4747471812316277
Energy: 1.4542431759678887
Energy: 1.55013577193491
Energy: 1.3929744966247115
Energy: 1.4295378097683231
Energy: 1.364467874965858
Energy: 1.5899533503440852
Energy: 1.3817989394416457
Energy: 1.5457525717575646
Energy: 1.3341432710791838
Energy: 1.4988715938297004
Energy: 1.5255090298489133
Energy: 1.586881380227579
Energy: 1.3817989394416457
Energy: 1.5646656330648747
Energy: 1.334143271079496
Energy: 1.5551795943331166
Energy: 1.3208762105387089
Energy: 1.47725134076932
Energy: 1.337511654481193
Energy: 1.3821689072951526
Energy: 1.3244541112938777
Energy: 1.5551795943334292
Energy: 1.3208762105387089
Energy: 1.4772513407686951
Energy: 1.3375116544808803
Energy: 1.405401262546151
Energy: 1.3479911392325736
Energy: 1.3416043586157647
Energy: 1.4093748897113818
Energy: 1.3502884437002385
Energy: 1.3590902026376916
Energy: 1.4054012625464634
Energy: 1.3479911392322612
Energy: 1.3416043586160769
Energy: 1.4093748897113818
Energy: 1.3397799736654186
Energy: 1.379260723909708
Energy: 1.533015811890146
Energy: 1.4138843465434836
Energy: 1.3484771815214733
Energy: 1.3612965277859026
Energy: 1.339779973665106
Energy: 1.3792607239090835
Energy: 1.533015811890146
Energy: 1.413884346544421
Energy: 1.3314902661215502
Energy: 1.5591614087323689
Energy: 1.360840479423851
Energy: 1.5214763345910587
Energy: 1.4641007012360585
Energy: 1.434791378989555
Energy: 1.3314902661218626
Energy: 1.559161408731744
Energy: 1.3608404794241635
Energy: 1.5214763345913713
Energy: 1.3812653251001121
Energy: 1.5083853633716406
Energy: 1.3343158812935776
Energy: 1.4386314917626923
Energy: 1.4667180650701659
Energy: 1.5502951786722117
Energy: 1.3812653251004245
Energy: 1.5083853633710156
Energy: 1.3343158812938902
Energy: 1.4386314917617549
Energy: 1.502172533557904
Energy: 1.3510537632144042
Energy: 1.3380867194196628
Energy: 1.3612939072648724
Energy: 1.350775295725023
Energy: 1.4133133918704637
Energy: 1.502172533557904
Energy: 1.3510537632125297
Energy: 1.3380867194193504
Energy: 1.3612939072645602
Energy: 1.342714034543635
Energy: 1.3480016571854478
Energy: 1.4060077439189853
Energy: 1.3483182637877245
Energy: 1.3489047242387369
Energy: 1.4129514203676437
Energy: 1.34271403454301
Energy: 1.3480016571854478
Energy: 1.4060077439192975
Energy: 1.3483182637880369
Energy: 1.3597637929248279
Energy: 1.296020608729757
Energy: 1.5532870825052056
Energy: 1.3240087915851413
Energy: 1.3815395466181377
Energy: 1.3342989687854603
Energy: 1.359763792923578
Energy: 1.2960206087300692
Energy: 1.553287082505518
Energy: 1.3240087915851413
Energy: 1.4863567977653593
Energy: 1.3817934824144606
Energy: 1.4398234512256702
Energy: 1.4694870048419446
Energy: 1.4934217448359675
Energy: 1.3337931203569888
Energy: 1.4863567977650467
Energy: 1.3817934824144606
Energy: 1.4398234512259827
Energy: 1.469487004841632
Energy: 1.4809517648151425
Energy: 1.394302673681009
Energy: 1.4791828631785093
Energy: 1.4930381419172747
Energy: 1.4573247590543883
Energy: 1.3729524887258842
Energy: 1.4809517648151425
Energy: 1.394302673681009
Energy: 1.4791828631778843
Energy: 1.4930381419172747
Energy: 1.4299996470240133
Energy: 1.3538558920375865
Energy: 1.3670892430045072
Energy: 1.3477829160227872
Energy: 1.3603558620077145
Energy: 1.3639606687590025
Energy: 1.4299996470243257
Energy: 1.3538558920375865
Energy: 1.3670892430045072
Energy: 1.3477829160230996
Energy: 1.3417899850474797
Energy: 1.3502765649263624
Energy: 1.4243111129789796
Energy: 1.324047354295626
Energy: 1.415818410519632
Energy: 1.3409490562439386
Energy: 1.3417899850471675
Energy: 1.3502765649241752
Energy: 1.4243111129774173
Energy: 1.3240473542950013
Energy: 1.3483616151311537
Energy: 1.458525962532038
Energy: 1.3293549533146793
Energy: 1.4940224535674158
Energy: 1.333947308330159
Energy: 1.341770243239405
Energy: 1.3483616151308415
Energy: 1.4585259625323506
Energy: 1.3293549533146793
Energy: 1.4940224535671034
Energy: 1.3605980573859642
Energy: 1.4822566188539108
Energy: 1.344884062137923
Energy: 1.3750360881888575
Energy: 1.3381305832995953
Energy: 1.5193141013738554
Energy: 1.360598057385652
Energy: 1.4822566188542234
Energy: 1.3448840621382354
Energy: 1.3750360881891697
Energy: 1.4518371850605318
Energy: 1.4877431139085633
Energy: 1.5120186008141663
Energy: 1.4154205782342124
Energy: 1.4301675988326399
Energy: 1.3740051509272153
Energy: 1.4518371850605318
Energy: 1.4877431139082506
Energy: 1.5120186008141663
Energy: 1.4154205782342124
Energy: 1.3337601485547346
Energy: 1.3602423490078537
Energy: 1.3524691338073327
Energy: 1.4293862141801816
Energy: 1.450335773682656
Energy: 1.470668523095354
Energy: 1.3337601485553594
Energy: 1.360242349007541
Energy: 1.352469133807645
Energy: 1.4293862141795568
Energy: 1.3329212883891377
Energy: 1.3823278866446933
Energy: 1.329194779133415
Energy: 1.4489793056006766
Energy: 1.3611372477665071
Energy: 1.341213634900013
Energy: 1.3329212883888255
Energy: 1.3823278866440682
Energy: 1.329194779133415
Energy: 1.4489793056003644
Energy: 1.5527649157703804
Energy: 1.3258457872600824
Energy: 1.4321508987989278
Energy: 1.557359988122954
Energy: 1.341161464279691
Energy: 1.3413089382625702
Energy: 1.5527649157703804
Energy: 1.3258457872610196
Energy: 1.4321508987989278
Energy: 1.557359988122954
Energy: 1.36411526201739
Energy: 1.3781531273666072
Energy: 1.3678395455292267
Energy: 1.340521036412864
Energy: 1.5242971413487645
Energy: 1.4297682693178042
Energy: 1.3641152620167656
Energy: 1.3781531273656698
Energy: 1.3678395455295391
Energy: 1.3405210364131763
Energy: 1.4744314575959754
Energy: 1.502757648183356
Energy: 1.4291327375238279
Energy: 1.436889692437803
Energy: 1.430797787193251
Energy: 1.3646688518462569
Energy: 1.4744314575953503
Energy: 1.5027576481846057
Energy: 1.4291327375238279
Energy: 1.4368896924396772
Energy: 1.3762182713735323
Energy: 1.3435095345529324
Energy: 1.4291669906905728
Energy: 1.3588534996156758
Energy: 1.4390655549640554
Energy: 1.3328265323523998
Energy: 1.3762182713738444
Energy: 1.3435095345532446
Energy: 1.429166990691198
Energy: 1.3588534996163006
Energy: 1.3803402377733989
Energy: 1.3258563146772098
Energy: 1.552201270744219
Energy: 1.3205850817955167
Energy: 1.3404850480553974
Energy: 1.3365234066771448
Energy: 1.3803402377733989
Energy: 1.3258563146772098
Energy: 1.5522012707445312
Energy: 1.3205850817952043
Energy: 1.350316909109616
Energy: 1.383731105791174
Energy: 1.4983820414313014
Energy: 1.3418869893744365
Energy: 1.3412524559211447
Energy: 1.4035753794469428
Energy: 1.350316909109928
Energy: 1.383731105791174
Energy: 1.4983820414316138
Energy: 1.3418869893744365
Energy: 1.3478872728217253
Energy: 1.361540927902968
Energy: 1.3369058693078535
Energy: 1.3725403919866495
Energy: 1.5311322424721547
Energy: 1.4035023627153116
Energy: 1.3478872728211004
Energy: 1.3615409279026556
Energy: 1.3369058693066036
Energy: 1.3725403919794632
Energy: 1.4744103535834125
Energy: 1.4318556141639946
Energy: 1.342197950177438
Energy: 1.5279267299723487
Energy: 1.3668745865451009
Energy: 1.55114219102584
Energy: 1.4744103535824753
Energy: 1.431855614167744
Energy: 1.3421979501974328
Energy: 1.5279267299723487
Energy: 1.461823389962273
Energy: 1.483165680109633
Energy: 1.381493539406253
Energy: 1.5317586151655966
Energy: 1.3330899103557432
Energy: 1.3996246174991032
Energy: 1.4618233899607105
Energy: 1.6580647018762158
Energy: 1.381493539405628
Energy: 1.5317586151655966
Energy: 1.348305040363782
Energy: 1.508496207082551
Energy: 1.4890474740967778
Energy: 1.3501996412680215
Energy: 1.3354992118824833
Energy: 1.3607298156313747
Energy: 1.3483050403634698
Energy: 1.508496207082551
Energy: 1.4890474740970905
Energy: 1.3501996412683335
Energy: 1.3478958819076607
Energy: 1.4030454480557801
Energy: 1.3467249328290498
Energy: 1.3512985848833117
Energy: 1.3955957708016677
Energy: 1.3481372054752492
Energy: 1.3478958819073483
Energy: 1.4030454480554675
Energy: 1.3467249328290498
Energy: 1.3512985848833117
Energy: 1.3811207409515285
Energy: 1.3365073186119834
Energy: 1.502987195043022
Energy: 1.4160329284531892
Energy: 1.5289361444864893
Energy: 1.3238290813400928
Energy: 1.3811207409515285
Energy: 1.3365073186119834
Energy: 1.502987195043022
Energy: 1.4160329284541264
Energy: 1.3431152150012893
Energy: 1.3330691730059088
Energy: 1.3597193866842594
Energy: 1.3818785364683883
Energy: 1.5272342451929986
Energy: 1.4580932910707263
Energy: 1.3431152150009769
Energy: 1.333069173006505
Energy: 1.3597193866836346
Energy: 1.3818785364690132
Energy: 1.4574781728960848
Energy: 1.361865432237445
Energy: 1.4813873881123043
Energy: 1.3050249373295466
Energy: 1.4590850704858198
Energy: 1.3886759088940468
Energy: 1.4574781728960848
Energy: 1.3618654322371326
Energy: 1.4813873881123043
Energy: 1.3050249373295466
Energy: 1.3657177684929616
Energy: 1.4569968022688833
Energy: 1.4752943845596325
Energy: 1.3530494212618764
Energy: 1.3666019431010616
Energy: 1.3519821472983757
Energy: 1.365717768492649
Energy: 1.4569968022682582
Energy: 1.4752943845593203
Energy: 1.3530494212618764
Energy: 1.4147638884821474
Energy: 1.3417514025613269
Energy: 1.3416448244448904
Energy: 1.3505967232321259
Energy: 1.424373447815795
Energy: 1.3237496079485054
Energy: 1.4147638884815226
Energy: 1.3417514025613269
Energy: 1.341644824444578
Energy: 1.3505967232327507
Energy: 1.335466202499714
Energy: 1.3417670668771162
Energy: 1.3422058540331607
Energy: 1.4795058717827965
Energy: 1.3300847178890758
Energy: 1.5653391138711006
Energy: 1.3354662024994015
Energy: 1.3417670668774286
Energy: 1.3422058540334731
Energy: 1.4569350778097092
Energy: 1.3388579131763898
Energy: 1.5164214359413066
Energy: 1.3650029376552495
Energy: 1.4817178164267257
Energy: 1.3518776276210847
Energy: 1.3735020364071078
Energy: 1.3388579131767022
Energy: 1.5164214359416188
Energy: 1.3650029376552495
Energy: 1.4817178164264133
Energy: 1.4375324613272293
Energy: 1.3743720563453292
Energy: 1.4517606676109445
Energy: 1.4799464043918407
Energy: 1.4655351828516257
Energy: 1.423809783944971
Energy: 1.437532461322543
Energy: 1.3743720563447044
Energy: 1.4517606676118817
Energy: 1.479946404391528
Energy: 1.3632627216690338
Energy: 1.4706070019604631
Energy: 1.3344970412196975
Energy: 1.3617406163431305
Energy: 1.3599974703370272
Energy: 1.4296471118245835
Energy: 1.3632627200410878
Energy: 1.4706070019604631
Energy: 1.3344970412196975
Energy: 1.3617406163434431
Energy: 1.363269073481352
Energy: 1.3413789686274695
Energy: 1.3417872275064449
Energy: 1.4127877988398496
Energy: 1.3302704939180774
Energy: 1.5107612789221467
Energy: 1.363269073481352
Energy: 1.3413789686274695
Energy: 1.3417872275064449
Energy: 1.3826168116244115
Energy: 1.3418659000282724
Energy: 1.3425132434878857
Energy: 1.5526945434173414
Energy: 1.3269744266908348
Energy: 1.4288507049270236
Energy: 1.3542253592759725
Energy: 1.3418659000282724
Energy: 1.3425132434875733
Energy: 1.5526945434167165
Energy: 1.3269744266908348
Energy: 1.5379954197080128
Energy: 1.427915398144869
Energy: 1.3696407055632638
Energy: 1.3931324872578978
Energy: 1.3738938523548316
Energy: 1.3358653151668125
Energy: 1.5379954197077004
Energy: 1.4279153981451815
Energy: 1.3696407055635764
Energy: 1.3931324872575852
Energy: 1.4310724814021363
Energy: 1.4281291747107445
Energy: 1.4798037760243123
Energy: 1.469527764227547
Energy: 1.4294290539494985
Energy: 1.4354709732120365
Energy: 1.4310724814015114
Energy: 1.4281291747663567
Energy: 1.479803776024625
Energy: 1.4695277642281719
Energy: 1.4383782894488062
Energy: 1.3330914073924485
Energy: 1.3753296003149644
Energy: 1.3427259048500721
Energy: 1.4292322839932918
Energy: 1.36879866193444
Energy: 1.4383782894491184
Energy: 1.3330914073927604
Energy: 1.3753296003149644
Energy: 1.3427259048500721
Energy: 1.3420603613850117
Energy: 1.3364295733358267
Energy: 1.3712747819676214
Energy: 1.3271076632030143
Energy: 1.5751497507889451
Energy: 1.3205912794615184
Energy: 1.3420603613850117
Energy: 1.3364295733358267
Energy: 1.3712747819676214
Energy: 1.3271076632027017
Energy: 1.3412409888091885
Energy: 1.4291257747184714
Energy: 1.3490111399384748
Energy: 1.3836443616320608
Energy: 1.4067612843037165
Energy: 1.341704799999337
Energy: 1.341240988808876
Energy: 1.4291257747187835
Energy: 1.3490111399384748
Energy: 1.383644361632686
Energy: 1.437993417705441
Energy: 1.4207430236621397
Energy: 1.3489142829309517
Energy: 1.361832873313278
Energy: 1.3529123002877759
Energy: 1.4853339842347135
Energy: 1.4379934177045037
Energy: 1.4207430236621397
Energy: 1.3489142829309517
Energy: 1.3618328733135903

minimum gb energy = 1.296020608729757 eV
minimum distance =  2.23222896857617 Angstroms
sigma value = 165


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

Energy: 1.3820758186585713
Energy: 1.6163056774237419
Energy: 1.341505067254853
Energy: 1.4595998137334838
Energy: 1.3341344589419595
Energy: 1.6160567446286036
Energy: 1.3820758186628372
Energy: 1.6163056774226692
Energy: 1.341505067254853
Energy: 1.4181224006363395
Energy: 1.3378086293627447
Energy: 1.3407048949288365
Energy: 1.3516081533986202
Energy: 1.3870193068281549
Energy: 1.2549267321505204
Energy: 1.27413255992
Energy: 1.3378086293627447
Energy: 1.34070489494278
Energy: 1.351608153401838
Energy: 1.3870193068281549
Energy: 1.2774898396611474
Energy: 1.4652206766369575
Energy: 1.3687946545575562
Energy: 1.2740316818278352
Energy: 1.3495603939259193
Energy: 1.4050019389987425
Energy: 1.2774898396611474
Energy: 1.465220676635885
Energy: 1.3687946545564835
Energy: 1.2740316818278352
Energy: 1.3132354742710097
Energy: 1.3551182762299907
Energy: 1.4126579640810755
Energy: 1.27289835358457
Energy: 1.2738864748652166
Energy: 1.2549748538047691
Energy: 1.3132354742731551
Energy: 1.355118276228918
Energy: 1.4126579640832206
Energy: 1.272898353583497
Energy: 1.4648562895965687
Energy: 1.3661246611717575
Energy: 1.3033754269053093
Energy: 1.3753903431607806
Energy: 1.274103844200982
Energy: 1.349232045861992
Energy: 1.4648562895965687
Energy: 1.3661246611717575
Energy: 1.3033754269053093
Energy: 1.3753903431661434
Energy: 1.3403931072447162
Energy: 1.3368703147438228
Energy: 1.3242269268820164
Energy: 1.3678750645164155
Energy: 1.6140858290573177
Energy: 1.3432071855199004
Energy: 1.3403931072243371
Energy: 1.336870314745968
Energy: 1.3242269268723632
Energy: 1.3678750645142703
Energy: 1.3203131047850987
Energy: 1.2587444753074366
Energy: 1.2829673178417076
Energy: 1.2978704917620345
Energy: 1.3507667528325755
Energy: 1.3357187595018962
Energy: 1.3203131047850987
Energy: 1.258744475308509
Energy: 1.28296731784278
Energy: 1.2978704917620345
Energy: 1.2729849300310576
Energy: 1.3682834775401276
Energy: 1.357981927281133
Energy: 1.2726581744375343
Energy: 1.4409873123926606
Energy: 1.440667394370576
Energy: 1.2729849300321303
Energy: 1.368283477782407
Energy: 1.3579819272532465
Energy: 1.272658174438607
Energy: 1.2979493280733978
Energy: 1.2763307676652933
Energy: 1.2586347049642397
Energy: 1.31975805241161
Energy: 1.339037569006178
Energy: 1.3345943411658387
Energy: 1.2979493280733978
Energy: 1.2763307676652933
Energy: 1.2586347049642397
Energy: 1.3197580524105375
Energy: 1.3620209348027446
Energy: 1.3252019987078456
Energy: 1.3367480820361721
Energy: 1.339637095222286
Energy: 1.357853757273762
Energy: 1.6150082160892454
Energy: 1.3620209348016723
Energy: 1.3252019987003376
Energy: 1.3367480820361721
Energy: 1.339637095237302
Energy: 1.3773533215550164
Energy: 1.303831336597723
Energy: 1.3591404463823529
Energy: 1.4648313477581076
Energy: 1.3460942739088853
Energy: 1.2739556535581344
Energy: 1.3773533215528713
Energy: 1.3038313369493566
Energy: 1.3591404463823529
Energy: 1.4648313477559625
Energy: 1.2726626948283626
Energy: 1.4118832879743277
Energy: 1.3549612567850031
Energy: 1.3131748567160402
Energy: 1.2547296849400662
Energy: 1.2733434128586822
Energy: 1.2726626948283626
Energy: 1.4118832879754002
Energy: 1.3549612567850031
Energy: 1.3131748567171126
Energy: 1.2739747941341588
Energy: 1.3687946545597012
Energy: 1.4652420278099443
Energy: 1.277496978130725
Energy: 1.4050019389976698
Energy: 1.352569850105906
Energy: 1.2739747941309412
Energy: 1.3687946545597012
Energy: 1.4652420278099443
Energy: 1.277496978130725
Energy: 1.3863328983034495
Energy: 1.3529390624654105
Energy: 1.3418049932546878
Energy: 1.3379910942801878
Energy: 1.2744405432502508
Energy: 1.25465170136348
Energy: 1.386332898304522
Energy: 1.352939062464338
Energy: 1.3418049934219363
Energy: 1.3379910942801878
Energy: 1.4181224033273057
Energy: 1.334134458940887
Energy: 1.6160567446275311
Energy: 1.3820758186596438
Energy: 1.6163056774226692
Energy: 1.3415050672537805
Energy: 1.4181224031932829
Energy: 1.3341344589419595
Energy: 1.6160567446286036
Energy: 1.3820758186617645

minimum gb energy = 1.25465170136348 eV
minimum distance =  2.21528156642183 Angstroms
sigma value = 41


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

Energy: 1.5219181847103265
Energy: 1.2550129467785285
Energy: 1.2258624643910208
Energy: 1.1206937189953388
Energy: 1.2258998203431328
Energy: 1.3177216495512807
Energy: 1.5219181847045002
Energy: 1.2550129468026654
Energy: 1.225862464391437
Energy: 1.1761605134264232
Energy: 1.3686450333242288
Energy: 1.3098425149806618
Energy: 1.2264780183689452
Energy: 1.389915550347379
Energy: 1.2004637636076794
Energy: 1.2120465243226817
Energy: 1.3686450333184026
Energy: 1.3098425149773325
Energy: 1.2264780183631192
Energy: 1.389915550347379
Energy: 1.2137274293495555
Energy: 1.213022931877638
Energy: 1.2997553355932334
Energy: 1.210060797242467
Energy: 1.2092509166236813
Energy: 1.3316039423172497
Energy: 1.2137274293499718
Energy: 1.2130229318772219
Energy: 1.2997553355944815
Energy: 1.2100607972611939
Energy: 1.2122656361624002
Energy: 1.233666538786527
Energy: 1.212064003037789
Energy: 1.2010648683878025
Energy: 1.4321067952841937
Energy: 1.238116052720411
Energy: 1.2122656350538528
Energy: 1.233666538786527
Energy: 1.2120640030365404
Energy: 1.201064868386138
Energy: 1.413762862550161
Energy: 1.3296486529999554
Energy: 1.2624482433994195
Energy: 1.233264354663294
Energy: 1.309716769251535
Energy: 1.2329787132255825
Energy: 1.4137628625484961
Energy: 1.3296486530003715
Energy: 1.2624482434085749
Energy: 1.2332643546591326
Energy: 1.2532387629839634
Energy: 1.3109851287764671
Energy: 1.3095812743071902
Energy: 1.225413400666108
Energy: 1.3814504986960803
Energy: 1.2007866966751437
Energy: 1.2532387629889572
Energy: 1.3109851287772993
Energy: 1.3095812743271658
Energy: 1.2254134006656918
Energy: 1.3678610111277094
Energy: 1.2124287838755674
Energy: 1.2110391839728303
Energy: 1.3626177027722524
Energy: 1.2103824360868685
Energy: 1.20236860895089
Energy: 1.3678610111277094
Energy: 1.2124287838755674
Energy: 1.2110391839732466
Energy: 1.362617702765594
Energy: 1.2332630282220578
Energy: 1.2141101972214008
Energy: 1.2139840480052557
Energy: 1.2116845112033328
Energy: 1.333332324596104
Energy: 1.4287443123295005
Energy: 1.2332630282274677
Energy: 1.214110197218904
Energy: 1.2139840480056718
Energy: 1.2116845112029166
Energy: 1.228297615076711
Energy: 1.4492768448608155
Energy: 1.2379802633163852
Energy: 1.265968765495113
Energy: 1.2296051682218172
Energy: 1.2126229464149068
Energy: 1.2282976150771272
Energy: 1.44927684486248
Energy: 1.2379802629312193
Energy: 1.265968765495113
Energy: 1.1949875003207147
Energy: 1.194078729813105
Energy: 1.3108454787135717
Energy: 1.3588665868939642
Energy: 1.2306102710482523
Energy: 1.213731694859015
Energy: 1.1949875132742882
Energy: 1.194078729808149
Energy: 1.3108454787139876
Energy: 1.3588665868943808
Energy: 1.1988409207231425
Energy: 1.2653241513505031
Energy: 1.211290894806958
Energy: 1.212237605579111
Energy: 1.3591060270602604
Energy: 1.224641055814738
Energy: 1.1988409207256396
Energy: 1.2653241513521676
Energy: 1.2112908948077905
Energy: 1.2122376055795276
Energy: 1.3684884482233615
Energy: 1.2254975933462082
Energy: 1.2122633371722074
Energy: 1.2131523606190382
Energy: 1.2109528712286801
Energy: 1.1999444860790576
Energy: 1.3684884482246096
Energy: 1.2254975933453758
Energy: 1.212263337170543
Energy: 1.2131523606198706
Energy: 1.2126556581495802
Energy: 1.2262519061659045
Energy: 1.443053512749026
Energy: 1.3850242870688145
Energy: 1.328812365277187
Energy: 1.229156456563118
Energy: 1.2126556581470833
Energy: 1.2262519061671528
Energy: 1.44305351274861
Energy: 1.385024287069647
Energy: 1.2108708613772268
Energy: 1.1980536341913688
Energy: 1.3223731195327484
Energy: 1.3858091901045395
Energy: 1.162904764865919
Energy: 1.2299425352070423
Energy: 1.2108708613755623
Energy: 1.198053634658932
Energy: 1.3223731195331643
Energy: 1.3858091901053717
Energy: 1.320598793198409
Energy: 1.200243226366507
Energy: 1.215506035710555
Energy: 1.2123179799704922
Energy: 1.2119217095264632
Energy: 1.357808231620587
Energy: 1.320598793198409
Energy: 1.2002432263848175
Energy: 1.2155060357097223
Energy: 1.2123179799692436
Energy: 1.2005587013343304
Energy: 1.332074998932028
Energy: 1.3556925339099954
Energy: 1.2131838802721053
Energy: 1.212322756872481
Energy: 1.214964359585154
Energy: 1.200558701289008
Energy: 1.332074998931612
Energy: 1.3556925339099954
Energy: 1.2131838802725212
Energy: 1.2288633325931895
Energy: 1.2121635311464203
Energy: 1.227407027129682
Energy: 1.250654796642615
Energy: 1.3501279038752214
Energy: 1.191945620497554
Energy: 1.2288633325927731
Energy: 1.212163531151414
Energy: 1.2274070271284334
Energy: 1.2506547968647632
Energy: 1.228153881320622
Energy: 1.2975836933527396
Energy: 1.2292068375765222
Energy: 1.1703332600575127
Energy: 1.3478973682125892
Energy: 1.2775816967638707
Energy: 1.2281538813210382
Energy: 1.297583693288274
Energy: 1.229206837576106
Energy: 1.1703332600824439
Energy: 1.2127340148885242
Energy: 1.3297687293575573
Energy: 1.2215523605780678
Energy: 1.211274312093629
Energy: 1.2132091842551465
Energy: 1.2127036967169063
Energy: 1.2127340148881083
Energy: 1.3297687293583897
Energy: 1.2215523605751548
Energy: 1.2112743120940452
Energy: 1.2142564051181357
Energy: 1.2003274024009523
Energy: 1.366821080421056
Energy: 1.3557248116628295
Energy: 1.2126654382710402
Energy: 1.2120444827683354
Energy: 1.2142564051173035
Energy: 1.2003274024005357
Energy: 1.3668210804218885
Energy: 1.3557248115326501
Energy: 1.1763033847957338
Energy: 1.1966153573438145
Energy: 1.2116884652584956
Energy: 1.23162308340237
Energy: 1.2507067491577124
Energy: 1.3108124796463891
Energy: 1.1763033847982307
Energy: 1.1966153572868399
Energy: 1.2116884652580793
Energy: 1.2316230833982464
Energy: 1.4821462897054045
Energy: 1.2265235701302928
Energy: 1.2973833491323032
Energy: 1.229447554717565
Energy: 1.3411924333661935
Energy: 1.2386949348262417
Energy: 1.4821462897049886
Energy: 1.2265235701311252
Energy: 1.297383349131055
Energy: 1.229447554717565
Energy: 1.2803939732104612
Energy: 1.2256166560180959
Energy: 1.3323407955563729
Energy: 1.2362362495354131
Energy: 1.2043444607139566
Energy: 1.2143740346670222
Energy: 1.2803939732100453
Energy: 1.2256166560197608
Energy: 1.3323407955559567
Energy: 1.2362362495341648
Energy: 1.2106739084289604
Energy: 1.3268236437799052
Energy: 1.2055914023126855
Energy: 1.210953129994353
Energy: 1.3598874690909775
Energy: 1.2123880492100838
Energy: 1.2106739084293765
Energy: 1.3268236437794894
Energy: 1.2055914023126855
Energy: 1.210953129991856
Energy: 1.3859086406123764
Energy: 1.3849522257245308
Energy: 1.2020474619182957
Energy: 1.2130913835390804
Energy: 1.2288855662423759
Energy: 1.2117579287455373
Energy: 1.3859086406127925
Energy: 1.384952225655904
Energy: 1.2020474621262949
Energy: 1.2130913835349186
Energy: 1.372323156745964
Energy: 1.4787650290459982
Energy: 1.237005225974332
Energy: 1.295679081393841
Energy: 1.35455262268757
Energy: 1.3428990424072673
Energy: 1.37232305872337
Energy: 1.4787650290410044
Energy: 1.2370052259751645
Energy: 1.2956790813950896
Energy: 1.1624259603465685
Energy: 1.304984977079659
Energy: 1.233635615133462
Energy: 1.3880742935806054
Energy: 1.2009128208123179
Energy: 1.200624405165865
Energy: 1.1624259603465685
Energy: 1.3049849770771622
Energy: 1.2336356151330456
Energy: 1.3880742935810217
Energy: 1.2109479304917699
Energy: 1.2118721220709534
Energy: 1.2662564259974092
Energy: 1.2094515436841748
Energy: 1.2082178047601178
Energy: 1.3279935604266742
Energy: 1.2109479304930182
Energy: 1.2118721220709534
Energy: 1.2662564259953284
Energy: 1.2094515436841748
Energy: 1.3107578904080712
Energy: 1.3125091953677464
Energy: 1.2541842149516091
Energy: 1.1995743283116764
Energy: 1.3734834006970378
Energy: 1.225397529727799
Energy: 1.3107578903627106
Energy: 1.31250919536733
Energy: 1.2541842149553544
Energy: 1.1995743283145515
Energy: 1.23659253940851
Energy: 1.3257743493546659
Energy: 1.4836049316576154
Energy: 1.2367440080974004
Energy: 1.2986169898286801
Energy: 1.2360549786541244
Energy: 1.2365925394126713
Energy: 1.3257743493500878
Energy: 1.4836049316571989
Energy: 1.2367440080978163
Energy: 1.2096240030089682
Energy: 1.3382744525666834
Energy: 1.314988033625754
Energy: 1.224068976092096
Energy: 1.3889912942395015
Energy: 1.1999696945577412
Energy: 1.2096240030106329
Energy: 1.3382744525687642
Energy: 1.3149880336236734
Energy: 1.2240689760904315
Energy: 1.3698808276773722
Energy: 1.2128436878791418
Energy: 1.2248817194273283
Energy: 1.3698808276773722
Energy: 1.2130422990253436
Energy: 1.207988016788876
Energy: 1.3698808276765395
Energy: 1.2128436878791418
Energy: 1.2248817194273283
Energy: 1.3698808276794525
Energy: 1.225936620794194
Energy: 1.213371214903929
Energy: 1.3116274487853863
Energy: 1.2116367322935264
Energy: 1.199828760391338
Energy: 1.4508752284094144
Energy: 1.2259366208000202
Energy: 1.213371193599476
Energy: 1.3116274487858026
Energy: 1.211636732292694
Energy: 1.2339089734103328
Energy: 1.451675916405594
Energy: 1.3265605763649928
Energy: 1.2624767998732949
Energy: 1.2252477237214268
Energy: 1.3061872411588322
Energy: 1.2339089734099165
Energy: 1.451675916405594
Energy: 1.3265605763704027
Energy: 1.262476799874127
Energy: 1.2002740617361722
Energy: 1.254184214957019
Energy: 1.3397653270630194
Energy: 1.3169442591210718
Energy: 1.2248432108784035
Energy: 1.3735699533827743
Energy: 1.2002740617361722
Energy: 1.2541842149541058
Energy: 1.3397653270626035
Energy: 1.3169442617358174
Energy: 1.2105638009198212
Energy: 1.2662564259957445
Energy: 1.224794185978177
Energy: 1.2112339921062674
Energy: 1.327993560425842
Energy: 1.2123042020530725
Energy: 1.2105638009331003
Energy: 1.2662564259949123
Energy: 1.2247941859790092
Energy: 1.2112339921062674
Energy: 1.3830838394361749
Energy: 1.2350400207385661
Energy: 1.2118952870111264
Energy: 1.1830214396213103
Energy: 1.2110475712778652
Energy: 1.1989104331796774
Energy: 1.3830838394382556
Energy: 1.2350400207360694
Energy: 1.2118952882315426
Energy: 1.1830214396221428
Energy: 1.211828983008444
Energy: 1.2265125738133071
Energy: 1.2233291007648885
Energy: 1.4564873565053658
Energy: 1.2577877374126767
Energy: 1.3805382184398645
Energy: 1.2118289829967916
Energy: 1.2265125738103941
Energy: 1.2233291029029532
Energy: 1.4564873556289164
Energy: 1.2111342838061319
Energy: 1.2006381900677547
Energy: 1.3849522255082083
Energy: 1.3911182150675974
Energy: 1.3040839458409061
Energy: 1.2263287177656081
Energy: 1.2111342838040513
Energy: 1.200638190081904
Energy: 1.3849522255581466
Energy: 1.391118215068846

minimum gb energy = 1.1206937189953388 eV
minimum distance =  2.24509887889271 Angstroms
sigma value = 185


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

Energy: 1.5401373011402937
Energy: 1.245432252796442
Energy: 1.4556467122149062
Energy: 1.6159044441987742
Energy: 1.4611503071732093
Energy: 1.2461410506804487
Energy: 1.5401373011397999
Energy: 1.2454322527959483
Energy: 1.4556467122154002
Energy: 1.5663047652158104
Energy: 1.4939039699880836
Energy: 1.3628219551427248
Energy: 1.1843242042217443
Energy: 1.2458058139989459
Energy: 1.1944709622279228
Energy: 1.3001246303117475
Energy: 1.4939039699866017
Energy: 1.362821955144207
Energy: 1.1843242042217443
Energy: 1.24580581399944
Energy: 1.5232880568593774
Energy: 1.1947253147330048
Energy: 1.5028839054739558
Energy: 1.4562516899111726
Energy: 1.1989224956857563
Energy: 1.2618108555065681
Energy: 1.5232880568583893
Energy: 1.1947253147334986
Energy: 1.5028839054739558
Energy: 1.4562516899111726
Energy: 1.4156344610506153
Energy: 1.1966865483677749
Energy: 1.245486748081871
Energy: 1.1848927494192243
Energy: 1.1773981554811925
Energy: 1.1304315698086906
Energy: 1.4156344610511091
Energy: 1.1966865483677749
Energy: 1.2454867480823648
Energy: 1.1848927494197183
Energy: 1.5936406209426828
Energy: 1.1841503831034093
Energy: 1.2468652008480938
Energy: 1.4376656441734312
Energy: 1.475865560169649
Energy: 1.1305937567197253
Energy: 1.5936406209426828
Energy: 1.1841503831034093
Energy: 1.246865200848588
Energy: 1.4376656441739253
Energy: 1.2891040637281361
Energy: 1.3615998681352006
Energy: 1.2762736604123615
Energy: 1.195596730113534
Energy: 1.2194271554309133
Energy: 1.419079725498199
Energy: 1.2907236081830937
Energy: 1.3615998681356947
Energy: 1.3361194913094754
Energy: 1.195596730113534
Energy: 1.195364533514292
Energy: 1.2395064763040773
Energy: 1.4574522168627733
Energy: 1.287208995425253
Energy: 1.299925633026701
Energy: 1.2348743917826677
Energy: 1.195364533513798
Energy: 1.2761461247518535
Energy: 1.457452216862279
Energy: 1.198327327993742
Energy: 1.4369491067697802
Energy: 1.2454477110805529
Energy: 1.1842940049585626
Energy: 1.1856002655885751
Energy: 1.1300538890172744
Energy: 1.4684634658852553
Energy: 1.4369491067678042
Energy: 1.2454477110810467
Energy: 1.1842940049580688
Energy: 1.1856002657505142
Energy: 1.1850477253401601
Energy: 1.2452226536749844
Energy: 1.1955930354415152
Energy: 1.4889803408493427
Energy: 1.1303563566887647
Energy: 1.2319231407909035
Energy: 1.1850477253396663
Energy: 1.2452226536749844
Energy: 1.1955930354415152
Energy: 1.4889803408493427
Energy: 1.4566678545568434
Energy: 1.5028839054734617
Energy: 1.1945430270088675
Energy: 1.2609421901687785
Energy: 1.2858840250304489
Energy: 1.1958573234213141
Energy: 1.4566678545568434
Energy: 1.5028839054739558
Energy: 1.1945430270083732
Energy: 1.2609421901682845
Energy: 1.2456975931504546
Energy: 1.1840808685455473
Energy: 1.246189469120146
Energy: 1.4940161896123274
Energy: 1.3001246303082894
Energy: 1.194568744952669
Energy: 1.2456975931504546
Energy: 1.1840808685460416
Energy: 1.2461894691142184
Energy: 1.4940161896133155
Energy: 1.5831822826772635
Energy: 1.4611503071727152
Energy: 1.2310960144749672
Energy: 1.5401373011393056
Energy: 1.2454322527929844
Energy: 1.4556467122149062
Energy: 1.5663047652163045
Energy: 1.4611503071732093
Energy: 1.2310960145100407
Energy: 1.5401373011397999
Energy: 1.24580581399944
Energy: 1.1944709622279228
Energy: 1.3001246303102656
Energy: 1.4939039699856136
Energy: 1.3628219551496406
Energy: 1.1843242042222382
Energy: 1.2458058139989459
Energy: 1.1944709622274285
Energy: 1.3001246303107594
Energy: 1.4939039699870955
Energy: 1.4562516899106788
Energy: 1.1989224956867444
Energy: 1.2618108555100258
Energy: 1.5232880568583893
Energy: 1.1947253147330048
Energy: 1.5028839054739558
Energy: 1.4562516899106788
Energy: 1.1989224956872382
Energy: 1.26181085550805
Energy: 1.5232880568583893
Energy: 1.1848927494192243
Energy: 1.1773981555058923
Energy: 1.1304315698121488
Energy: 1.415634461048639
Energy: 1.1966865483682692
Energy: 1.245486748081871
Energy: 1.1848927494192243
Energy: 1.1773981554895905
Energy: 1.1304315698170888
Energy: 1.4156344610491332
Energy: 1.4376656441724434
Energy: 1.4758655601691553
Energy: 1.1305937545797549
Energy: 1.5936406209426828
Energy: 1.1841503831034093
Energy: 1.246865200849082
Energy: 1.4376656441729374
Energy: 1.4758655601706372
Energy: 1.130593756562232
Energy: 1.5936406209436709
Energy: 1.195596730113534
Energy: 1.2194271554472151
Energy: 1.419079725499681
Energy: 1.2891040637271483
Energy: 1.3615998681361885
Energy: 1.2781120063029503
Energy: 1.195596730113534
Energy: 1.219427155447709
Energy: 1.419079725498199
Energy: 1.2907236081845757
Energy: 1.198327327996212
Energy: 1.2999256330232434
Energy: 1.2348743916216711
Energy: 1.195364533513798
Energy: 1.2881119137270272
Energy: 1.457452216863267
Energy: 1.1983273279917661
Energy: 1.2999256330232434
Energy: 1.2348743917782217
Energy: 1.195364533514292
Energy: 1.185600266385024
Energy: 1.1300538887866705
Energy: 1.4684634658832791
Energy: 1.436949106771262
Energy: 1.245447711076107
Energy: 1.1842940049585626
Energy: 1.1856002660872815
Energy: 1.1300538891377636
Energy: 1.4684634658852553
Energy: 1.4369491067682982
Energy: 1.4889803408493427
Energy: 1.1303563566882706
Energy: 1.2319231407913978
Energy: 1.1850477253396663
Energy: 1.245222653675479
Energy: 1.195593035440527
Energy: 1.488980340850331
Energy: 1.1303563566902466
Energy: 1.2319231407909035
Energy: 1.1850477253401601
Energy: 1.2609421901687785
Energy: 1.285884025028473
Energy: 1.195857323421808
Energy: 1.4566678545568434
Energy: 1.5028839054719798
Energy: 1.1945430270083732
Energy: 1.2609421901682845
Energy: 1.285884025028967
Energy: 1.195857323421808
Energy: 1.4566678545573375
Energy: 1.4940161896138093
Energy: 1.3001246303082894
Energy: 1.194568744952669
Energy: 1.2456975931509489
Energy: 1.1840808685455473
Energy: 1.2461894691157003
Energy: 1.4940161896138093
Energy: 1.3001246303063136
Energy: 1.194568744952669
Energy: 1.2456975931504546
Energy: 1.5401373011397999
Energy: 1.2454322527989121
Energy: 1.4556467122158943
Energy: 1.5663047652163045
Energy: 1.4611503071727152
Energy: 1.1310573858177786
Energy: 1.5401373011397999
Energy: 1.2454322527984183
Energy: 1.4556467122154002
Energy: 1.5663047652163045
Energy: 1.4939039699890715
Energy: 1.3628219551466767
Energy: 1.1843242042222382
Energy: 1.245805813998452
Energy: 1.1944709622274285
Energy: 1.3001246303087837
Energy: 1.4939039699856136
Energy: 1.3628219551461827
Energy: 1.1843242042217443
Energy: 1.2458058139989459
Energy: 1.5232880568593774
Energy: 1.1947253147334986
Energy: 1.5028839054734617
Energy: 1.4562516899116666
Energy: 1.1989224956857563
Energy: 1.2618108555085439
Energy: 1.5232880568583893
Energy: 1.1947253147334986
Energy: 1.5028839054734617
Energy: 1.4562516899111726
Energy: 1.415634461048639
Energy: 1.196686548368763
Energy: 1.245486748080389
Energy: 1.1848927494192243
Energy: 1.1773981555517887
Energy: 1.1304315698279563
Energy: 1.4156344610491332
Energy: 1.196686548368763
Energy: 1.2454867480798948
Energy: 1.1848927494187302
Energy: 1.593640620942189
Energy: 1.184150383103903
Energy: 1.2468652008476
Energy: 1.4376656441724434
Energy: 1.475865560169649
Energy: 1.1305937539299318
Energy: 1.5936406209431768
Energy: 1.184150383103903
Energy: 1.246865200848588
Energy: 1.4376656441724434
Energy: 1.2907236081826
Energy: 1.3615998681366825
Energy: 1.2781120063034443
Energy: 1.195596730114028
Energy: 1.2194271554126355
Energy: 1.419079725498199
Energy: 1.2907236081840818
Energy: 1.3615998681356947
Energy: 1.2781120063024562
Energy: 1.195596730113534
Energy: 1.195364533514292
Energy: 1.2881119137699595
Energy: 1.4574522168627733
Energy: 1.198327327991272
Energy: 1.2999256330286773
Energy: 1.234874391580221
Energy: 1.195364533513798
Energy: 1.2881119137655137
Energy: 1.457452216862279
Energy: 1.198327327996212
Energy: 1.4369491067678042
Energy: 1.2454477110770952
Energy: 1.1842940049585626
Energy: 1.1856002658848352
Energy: 1.1300538890933043
Energy: 1.4684634658847613
Energy: 1.436949106770274
Energy: 1.245447711078577
Energy: 1.1842940049585626
Energy: 1.185600266135199
Energy: 1.1850477253396663
Energy: 1.245222653675479
Energy: 1.1955930354415152
Energy: 1.488980340848849
Energy: 1.1303563566892587
Energy: 1.2319231407918916
Energy: 1.1850477253401601
Energy: 1.245222653675479
Energy: 1.195593035440527
Energy: 1.488980340848849
Energy: 1.4566678545568434
Energy: 1.5028839054734617
Energy: 1.1945430270088675
Energy: 1.2609421901682845
Energy: 1.2858840250294612
Energy: 1.195857323421808
Energy: 1.4566678545568434
Energy: 1.5028839054739558
Energy: 1.1945430270083732
Energy: 1.2609421901682845
Energy: 1.2456975931504546
Energy: 1.1840808685460416
Energy: 1.2461894691137243
Energy: 1.4940161896128212
Energy: 1.3001246303068075
Energy: 1.194568744952669
Energy: 1.2456975931504546
Energy: 1.1840808685460416
Energy: 1.2461894691176763
Energy: 1.4940161896128212

minimum gb energy = 1.1300538887866705 eV
minimum distance =  2.18604935328002 Angstroms
sigma value = 33


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

Energy: 1.401605667186362
Energy: 1.456995515740177
Energy: 1.3978530824909834
Energy: 1.4335330050406012
Energy: 1.397380157692351
Energy: 1.454975861428917
Energy: 1.4016056671858195
Energy: 1.4569955157393635
Energy: 1.3978530824920679
Energy: 1.4031831637401109
Energy: 1.5117915261739214
Energy: 1.3830432350382267
Energy: 1.2153575293342482
Energy: 1.3142891036317483
Energy: 1.242536731653147
Energy: 1.2831010529944071
Energy: 1.5117915261741928
Energy: 1.3830432350387691
Energy: 1.2153575293334347
Energy: 1.3142891036320192
Energy: 1.3919524676164654
Energy: 1.2215785053225905
Energy: 1.444845702129493
Energy: 1.5422548973561496
Energy: 1.2467118031159536
Energy: 1.2851265885668313
Energy: 1.3919524676164654
Energy: 1.2215785053255737
Energy: 1.4448457021281373
Energy: 1.5422548973572343
Energy: 1.328382764978486
Energy: 1.2185858124534101
Energy: 1.3026521517030978
Energy: 1.3801440239735288
Energy: 1.4201165129799846
Energy: 1.4742404392178345
Energy: 1.3283827649795705
Energy: 1.2185858124528677
Energy: 1.302652151702013
Energy: 1.3801440239732576
Energy: 1.304818738542033
Energy: 1.2214074277820282
Energy: 1.34495227493567
Energy: 1.4742734009603824
Energy: 1.3829700999376218
Energy: 1.3769490595401033
Energy: 1.3048187385425756
Energy: 1.2214074277828417
Energy: 1.344952274937297
Energy: 1.4742734009609
Energy: 1.552286135159402
Energy: 1.2187805130566083
Energy: 1.3489386885214556
Energy: 1.2858113216908733
Energy: 1.2460773162949421
Energy: 1.5154277916344885
Energy: 1.552286135159402
Energy: 1.2187805130568792
Energy: 1.3489386885228116
Energy: 1.2858113216914155
Energy: 1.3835417854002403
Energy: 1.3153677734536635
Energy: 1.5115562704150711
Energy: 1.2936057994585588
Energy: 1.2436096522998203
Energy: 1.3142693722677001
Energy: 1.3835417854013252
Energy: 1.3153677734566467
Energy: 1.5115562704158847
Energy: 1.293605799458288
Energy: 1.397824005125264
Energy: 1.447682012545162
Energy: 1.3694457906866344
Energy: 1.4926000230849201
Energy: 1.2845645279423732
Energy: 1.3138265154180848
Energy: 1.3978240051249928
Energy: 1.447682012545433
Energy: 1.3694457906871766
Energy: 1.4926000230849201
Energy: 1.242403502865241
Energy: 1.2851138637778095
Energy: 1.5118210662109566
Energy: 1.4181816044330822
Energy: 1.2148856723829853
Energy: 1.3143518038778912
Energy: 1.2424035028644276
Energy: 1.2851138637780806
Energy: 1.5118210662109566
Energy: 1.4181816044306415
Energy: 1.2458796251954178
Energy: 1.2847906171921786
Energy: 1.3915089027920833
Energy: 1.2184283260639213
Energy: 1.4360857772750197
Energy: 1.5436386202828656
Energy: 1.2458796251946043
Energy: 1.2847906171916366
Energy: 1.3915089027909981
Energy: 1.2184283260644637
Energy: 1.4876575449050429
Energy: 1.3788119610648932
Energy: 1.4130044127656993
Energy: 1.2192018305349983
Energy: 1.3038277503449605
Energy: 1.3785806187066827
Energy: 1.4876575449050429
Energy: 1.3788119610648932
Energy: 1.4130044127648858
Energy: 1.2192018305347272
Energy: 1.3830227370027395
Energy: 1.3785877776692477
Energy: 1.303462005720506
Energy: 1.2183234530897822
Energy: 1.3316158047902216
Energy: 1.4758847819648508
Energy: 1.3830227370024686
Energy: 1.3785877776703077
Energy: 1.3034620057207773
Energy: 1.2183234530892397
Energy: 1.2473841398855574
Energy: 1.3873186825589412
Energy: 1.5508378455305343
Energy: 1.2188805032105057
Energy: 1.3154772966263426
Energy: 1.2860392146648485
Energy: 1.2473841398852863
Energy: 1.38731868256084
Energy: 1.5508378455310767
Energy: 1.2188805032105057
Energy: 1.2458998488501205
Energy: 1.3146431081114045
Energy: 1.3813857317252727
Energy: 1.3142898906818212
Energy: 1.5109095896015636
Energy: 1.2857951815273272
Energy: 1.245899848849849
Energy: 1.314643108110591
Energy: 1.3813857317252727
Energy: 1.314289890682906
Energy: 1.2452952587095225
Energy: 1.3139935490603551
Energy: 1.3974129093773289
Energy: 1.4467436339140347
Energy: 1.3703413934829196
Energy: 1.4967049556989278
Energy: 1.2452952587068105
Energy: 1.313993549057101
Energy: 1.3974129093770578
Energy: 1.4467436339124076
Energy: 1.2142548843103433
Energy: 1.3167335806903901
Energy: 1.2433355259812602
Energy: 1.2858767511157194
Energy: 1.3945121950416532
Energy: 1.4171303068996774
Energy: 1.2142548843100722
Energy: 1.3167335806912037
Energy: 1.2433355259804466
Energy: 1.2858767511162617
Energy: 1.2617559917620067
Energy: 1.475221070118015
Energy: 1.2466638203495537
Energy: 1.2859318417602374
Energy: 1.2757960016220362
Energy: 1.2183577361393525
Energy: 1.261755990741702
Energy: 1.4752210701172017
Energy: 1.2466638203509095
Energy: 1.2859318417607801
Energy: 1.3023164868085013
Energy: 1.3781365653288522
Energy: 1.4876805722200157
Energy: 1.3502448746284499
Energy: 1.4126493053680533
Energy: 1.2216802548261216
Energy: 1.3023164868087724
Energy: 1.3781365653285813
Energy: 1.487680572220558
Energy: 1.3502448746265514
Energy: 1.2393234536511297
Energy: 1.489140285743366
Energy: 1.3827273737676553
Energy: 1.3801360273012215
Energy: 1.3805194256956617
Energy: 1.2181504306812045
Energy: 1.2393234536514013
Energy: 1.489140285742281
Energy: 1.3827273737662995
Energy: 1.380136027301764
Energy: 1.3565082253578855
Energy: 1.2844356207847276
Energy: 1.2468863706357265
Energy: 1.3846847744477837
Energy: 1.4414454624333881
Energy: 1.219287376621775
Energy: 1.3565082253584277
Energy: 1.2844356207849985
Energy: 1.2468863706357265
Energy: 1.3846847744485973
Energy: 1.497115415608855
Energy: 1.2852438662549022
Energy: 1.2470699842811144
Energy: 1.3144885034523985
Energy: 1.3847356212739355
Energy: 1.3149088257260662
Energy: 1.4971154156077704
Energy: 1.2852438662543602
Energy: 1.2470699842811144
Energy: 1.314488503452941
Energy: 1.5272731450415309
Energy: 1.4920907642313785
Energy: 1.255862569073224
Energy: 1.3145509068017731
Energy: 1.3978017665878766
Energy: 1.4467152575279076
Energy: 1.527273145039361
Energy: 1.4920907642316497
Energy: 1.2558625690724103
Energy: 1.3145509068017731
Energy: 1.387708355020739
Energy: 1.4499862787397022
Energy: 1.215131055070296
Energy: 1.3009792917468734
Energy: 1.242540888082643
Energy: 1.287348173181707
Energy: 1.3877083550210103
Energy: 1.4499862787426852
Energy: 1.215131055071923
Energy: 1.3009792917463312
Energy: 1.248813820779165
Energy: 1.2179502271926959
Energy: 1.2702053843384857
Energy: 1.4749936849551821
Energy: 1.2467644140868221
Energy: 1.2849488705386423
Energy: 1.2488138207780803
Energy: 1.217950227192967
Energy: 1.2702053843647907
Energy: 1.4749936849554535
Energy: 1.525919317642486
Energy: 1.2220951709704266
Energy: 1.3024872718633524
Energy: 1.3779285808087591
Energy: 1.4881478766882457
Energy: 1.246898114434402
Energy: 1.525919317644113
Energy: 1.2220951709704266
Energy: 1.3024872718633524
Energy: 1.3779285808095727
Energy: 1.3802388459751704
Energy: 1.2183919425287602
Energy: 1.2409579389497725
Energy: 1.4888678037656935
Energy: 1.302121329110755
Energy: 1.3756953484218841
Energy: 1.380238845974628
Energy: 1.2183919425295737
Energy: 1.2409579389495016
Energy: 1.4888678037654226
Energy: 1.5519926848999774
Energy: 1.2220649972183608
Energy: 1.316099924541763
Energy: 1.2842649156118904
Energy: 1.2457897780812621
Energy: 1.3898232782090658
Energy: 1.5519926849002486
Energy: 1.2220649972183608
Energy: 1.3160999245423057
Energy: 1.2842649156116193
Energy: 1.2888456031988236
Energy: 1.3700101583203141
Energy: 1.496600490637934
Energy: 1.3561246871335013
Energy: 1.245207199988115
Energy: 1.3009689438711485
Energy: 1.2888456031993658
Energy: 1.3700101583230262
Energy: 1.4966004906392898
Energy: 1.3561246871337724
Energy: 1.397545511149243
Energy: 1.4469543524204629
Energy: 1.2894098012192023
Energy: 1.4841544428050408
Energy: 1.2156080303392451
Energy: 1.3150756535291577
Energy: 1.397545511149514
Energy: 1.446954352420734
Energy: 1.2894098012289652
Energy: 1.484154442805583
Energy: 1.2418409683096996
Energy: 1.2851454661284196
Energy: 1.3839761265804265
Energy: 1.418034846269415
Energy: 1.2148355018903152
Energy: 1.300531972490512
Energy: 1.2418409683096996
Energy: 1.2851454661286907
Energy: 1.38397612658124
Energy: 1.4180348462653474
Energy: 1.2459394024584989
Energy: 1.2848563802316788
Energy: 1.2369425648234005
Energy: 1.2189108028294806
Energy: 1.291556260955771
Energy: 1.4762384069268324
Energy: 1.2459394024579569
Energy: 1.2848563802319504
Energy: 1.2369425648234005
Energy: 1.2189108028286675
Energy: 1.489081766381198
Energy: 1.2554748768333783
Energy: 1.4295979141409312
Energy: 1.2220740637111216
Energy: 1.3033701456674853
Energy: 1.3782619479911713
Energy: 1.489081766380656
Energy: 1.2554748773996418
Energy: 1.4295979141398463
Energy: 1.222074063710308
Energy: 1.3026618115123034
Energy: 1.3775530967584542
Energy: 1.379031830549893
Energy: 1.2181389570170398
Energy: 1.2387877484117604
Energy: 1.488899586306054
Energy: 1.302661811502812
Energy: 1.3775530967589966
Energy: 1.379031830549622
Energy: 1.2181389570167684
Energy: 1.2433484682450193
Energy: 1.3893886521128416
Energy: 1.4609207340608792
Energy: 1.2228393380533276
Energy: 1.3164661521403092
Energy: 1.285105526117835
Energy: 1.2433484682444769
Energy: 1.3893886521122991
Energy: 1.4609207340616928
Energy: 1.2228393380527849
Energy: 1.2458863043417925
Energy: 1.3009709548030552
Energy: 1.2216075600613363
Energy: 1.4738918776818948
Energy: 1.4966489685840445
Energy: 1.355457508208796
Energy: 1.2458863043417925
Energy: 1.3009709548022417
Energy: 1.2216075600621499
Energy: 1.4738918776797252
Energy: 1.2143153155985287
Energy: 1.3148747254389748
Energy: 1.3978218448146897
Energy: 1.4904948891790786
Energy: 1.288146847372234
Energy: 1.4900133237961974
Energy: 1.2143153155941895
Energy: 1.3148747254397883
Energy: 1.3978218448138762
Energy: 1.49049488917718
Energy: 1.2152747090329818
Energy: 1.3010725480628889
Energy: 1.2714295210518682
Energy: 1.285416349337795
Energy: 1.3833998734927169
Energy: 1.4500002173756448
Energy: 1.2152747085304227
Energy: 1.3010725480623464
Energy: 1.271429521051597
Energy: 1.285416349337253
Energy: 1.3180402461034966
Energy: 1.476014238659957
Energy: 1.2462473196264778
Energy: 1.2850055943547103
Energy: 1.2371363088830398
Energy: 1.218062226434404
Energy: 1.3180402461032252
Energy: 1.4760142386604993
Energy: 1.2462473196272914
Energy: 1.2850055943541678
Energy: 1.3028194494398002
Energy: 1.3791344392970337
Energy: 1.4887792426357602
Energy: 1.2162718813583708
Energy: 1.4298337548767266
Energy: 1.2232896179531596
Energy: 1.3028194494392575
Energy: 1.3791344392973048
Energy: 1.488779242635489
Energy: 1.2162718813564726
Energy: 1.2387269036097976
Energy: 1.4893702240842055
Energy: 1.4551095576334965
Energy: 1.3746205778778686
Energy: 1.581344832983616
Energy: 1.2180152404310667
Energy: 1.2387269036106112
Energy: 1.4893702240842055
Energy: 1.4551095576337676
Energy: 1.3746205778775977
Energy: 1.3290315942230637
Energy: 1.2852764699292043
Energy: 1.2425292129374994
Energy: 1.2923447380515243
Energy: 1.4102124630916069
Energy: 1.2217493508584023
Energy: 1.329031594223335
Energy: 1.2852764699289332
Energy: 1.2425292129374994
Energy: 1.2923447380531516
Energy: 1.5001929471073963
Energy: 1.3524280422875652
Energy: 1.2462290013586554
Energy: 1.3147334962190464
Energy: 1.2205997884290496
Energy: 1.4874593806225427
Energy: 1.5001929471071251
Energy: 1.3524280422881076
Energy: 1.2462290013589266
Energy: 1.3147334962212158
Energy: 1.3237259171364524
Energy: 1.4940398507788717
Energy: 1.215491982703084
Energy: 1.3153640172082308
Energy: 1.5478390663823385
Energy: 1.5597194989364702
Energy: 1.3237259171378086
Energy: 1.4940398507780583
Energy: 1.2154919827022703
Energy: 1.3153640172074172
Energy: 1.3775276886622416
Energy: 1.456660704180292
Energy: 1.249678227058423
Energy: 1.3024841372876035
Energy: 1.269469353508418
Energy: 1.2850572599090773
Energy: 1.3775276886614278
Energy: 1.4566607041797495
Energy: 1.2496782270595082
Energy: 1.302484137288146
Energy: 1.237152914591155
Energy: 1.2181979600891781
Energy: 1.3038628427679457
Energy: 1.4742699148039995
Energy: 1.2589833234077394
Energy: 1.2849569928693645
Energy: 1.2371529145916973
Energy: 1.2181979600889068
Energy: 1.3038628427676746
Energy: 1.4742699148037284
Energy: 1.4302204660035998
Energy: 1.533278715211062
Energy: 1.3032498076278762
Energy: 1.3804372602896653
Energy: 1.4884288816201254
Energy: 1.2160378936081973
Energy: 1.4302204660035998
Energy: 1.5332787152116047
Energy: 1.3032498076278762
Energy: 1.3804372602902075
Energy: 1.581632604695598
Energy: 1.2181605149034973
Energy: 1.2396946422881239
Energy: 1.5059190205719473
Energy: 1.6175414172722273
Energy: 1.2160852371345465
Energy: 1.5816326046969542
Energy: 1.2181605149024126
Energy: 1.2396946422881239
Energy: 1.505919020571405
Energy: 1.3988241875819192
Energy: 1.4000191723719349
Energy: 1.3144905537020626
Energy: 1.2856284980778288
Energy: 1.2433638233760753
Energy: 1.2816921253017566
Energy: 1.3988241875824616
Energy: 1.4000191723722064
Energy: 1.3144905537017912
Energy: 1.2856284980786423
Energy: 1.2203360287700704
Energy: 1.4913244890380613
Energy: 1.4968502975297255
Energy: 1.4103329264571556
Energy: 1.246605388564534
Energy: 1.300936090170719
Energy: 1.2203360287700704
Energy: 1.4913244890372477
Energy: 1.4968502975297255
Energy: 1.410832640211882
Energy: 1.5007942675934522
Energy: 1.557056576550534
Energy: 1.2846937888846406
Energy: 1.5064122431889435
Energy: 1.2157692570080443
Energy: 1.314983967046158
Energy: 1.500794267593181
Energy: 1.5570565765497204
Energy: 1.284693788894132
Energy: 1.5064122431889435
Energy: 1.2694577761853332
Energy: 1.2850213615515276
Energy: 1.2329195790899004
Energy: 1.4137407122802645
Energy: 1.2454328804668868
Energy: 1.3035077913155557
Energy: 1.2694577761847912
Energy: 1.2850213615512562
Energy: 1.2329195790899004
Energy: 1.4458342455997761
Energy: 1.2605284156692493
Energy: 1.285474166086025
Energy: 1.237133594010695
Energy: 1.2182901320940238
Energy: 1.246901702656184
Energy: 1.4741930189069474
Energy: 1.2605284156757577
Energy: 1.2854741660857536
Energy: 1.2371335940098813
Energy: 1.2182901320934816
Energy: 1.4882781621525207
Energy: 1.216648646402117
Energy: 1.4300719147535992
Energy: 1.532983130631769
Energy: 1.30302047425043
Energy: 1.3769425536902702
Energy: 1.4882781621522494
Energy: 1.216648646396422
Energy: 1.430071914753328
Energy: 1.5329831306314976
Energy: 1.4515722453451971
Energy: 1.2163271598033851
Energy: 1.5944928077881224
Energy: 1.2184260554375457
Energy: 1.2378958161539155
Energy: 1.4912129392810183
Energy: 1.4515722453462818
Energy: 1.216327159784969
Energy: 1.5944928077900207
Energy: 1.2184260554383592
Energy: 1.242417191887138
Energy: 1.3048289033730722
Energy: 1.4000504537412954
Energy: 1.400873860199208
Energy: 1.3147536250790515
Energy: 1.2866289149779722
Energy: 1.242417191887409
Energy: 1.3048289033711742
Energy: 1.4000504537418375
Energy: 1.400873860199208
Energy: 1.4602837637083577
Energy: 1.300998051842218
Energy: 1.2205761399986255
Energy: 1.3380966629371838
Energy: 1.4973948895093085
Energy: 1.6417521446182446
Energy: 1.460283763707544
Energy: 1.3009980518419466
Energy: 1.2205761399988966
Energy: 1.3380966629461328
Energy: 1.2159261491011903
Energy: 1.301009886313915
Energy: 1.500254556172064
Energy: 1.4745091922553226
Energy: 1.28247932546458
Energy: 1.5099341286492929
Energy: 1.2159261491272
Energy: 1.3010098863144572
Energy: 1.500254556172064
Energy: 1.4745091922569498
Energy: 1.2456493908250421
Energy: 1.3034909470900795
Energy: 1.2707762152760786
Energy: 1.2855639797619347
Energy: 1.2329098436560242
Energy: 1.4141216064757958
Energy: 1.2456493908535164
Energy: 1.3034909470889948
Energy: 1.2707762152763498
Energy: 1.2855639797624772
Energy: 1.307922756836723
Energy: 1.323900926610589
Energy: 1.3509217464854129
Energy: 1.2849754092674377
Energy: 1.2373925950021176
Energy: 1.219559317755287
Energy: 1.3079227568844276
Energy: 1.3239009266035626
Energy: 1.3509217464843282
Energy: 1.284975409267709
Energy: 1.3027655102976683
Energy: 1.378422846200758
Energy: 1.4879694990569274
Energy: 1.3744163989861775
Energy: 1.4292306499490213
Energy: 1.545460483780371
Energy: 1.3027655102990243
Energy: 1.3784228462013002
Energy: 1.4879694990566563
Energy: 1.3744163989845504

minimum gb energy = 1.2142548843100722 eV
minimum distance =  2.19170899198042 Angstroms
sigma value = 219


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

Energy: 1.2086671288785975
Energy: 1.2345262468831466
Energy: 1.1982123664499214
Energy: 1.315361983177544
Energy: 1.1981471199216636
Energy: 1.2344759501003695
Energy: 1.208667128878414
Energy: 1.2345262468831466
Energy: 1.198212366450105
Energy: 1.3153619950656026
Energy: 1.1960477102011036
Energy: 1.2820478420225625
Energy: 1.1986297814443592
Energy: 1.219599697798108
Energy: 1.2356707161900673
Energy: 1.234725768804114
Energy: 1.1960477102007363
Energy: 1.2820478420241739
Energy: 1.1986297814445428
Energy: 1.2195996977986587
Energy: 1.4168275882349393
Energy: 1.1977637134692176
Energy: 1.208003749032167
Energy: 1.1979358444126404
Energy: 1.2346509720397292
Energy: 1.2990519432687093
Energy: 1.3122591154255157
Energy: 1.197763713469952
Energy: 1.2080037490352056
Energy: 1.1979358444131707
Energy: 1.198500350928965
Energy: 1.1987150055864189
Energy: 1.2389775547023663
Energy: 1.20753080384751
Energy: 1.2346825352834458
Energy: 1.1958071002358275
Energy: 1.1985003509287817
Energy: 1.1987150055867861
Energy: 1.2389775547027129
Energy: 1.2075308038473265
Energy: 1.1978032070777265
Energy: 1.224237950507651
Energy: 1.2369462553603858
Energy: 1.1953261828197586
Energy: 1.240596918653872
Energy: 1.2503344449326204
Energy: 1.1978032070780937
Energy: 1.2242379505079979
Energy: 1.2369460703682231
Energy: 1.1953261828199422
Energy: 1.3762918965886048
Energy: 1.2350236823044378
Energy: 1.2348801724440968
Energy: 1.3762918965893183
Energy: 1.1979728763832411
Energy: 1.1979206863755112
Energy: 1.3762918965889717
Energy: 1.2350236823042544
Energy: 1.2348801724442602
Energy: 1.3762918965896858
Energy: 1.1952929083652972
Energy: 1.2372855811230583
Energy: 1.2241589925551861
Energy: 1.197947464589962
Energy: 1.2503419774867486
Energy: 1.2405498953445353
Energy: 1.1952929083658275
Energy: 1.2372855809606937
Energy: 1.2241589925548395
Energy: 1.197947464589962
Energy: 1.2075223369646373
Energy: 1.238856188135061
Energy: 1.2199697557455405
Energy: 1.1983977912294739
Energy: 1.1957728889157493
Energy: 1.234676690443112
Energy: 1.2075223369651675
Energy: 1.2388561881354077
Energy: 1.2199697557460707
Energy: 1.1983977912294739
Energy: 1.1978772314913284
Energy: 1.2226512087130406
Energy: 1.1976796399692695
Energy: 1.3765283697685538
Energy: 1.299089308378365
Energy: 1.2346387917497461
Energy: 1.1978772314911448
Energy: 1.2530038725594541
Energy: 1.197679639967108
Energy: 1.3765283697687167

minimum gb energy = 1.1952929083652972 eV
minimum distance =  2.30915288588977 Angstroms
sigma value = 15


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

Energy: 1.5649362155242663
Energy: 1.455788198941081
Energy: 1.3530119272228414
Energy: 1.5515021980517325
Energy: 1.3580966952853406
Energy: 1.4596719509257405
Energy: 1.5649362155242663
Energy: 1.45578819894072
Energy: 1.3530119272221797
Energy: 1.5613075175099427
Energy: 1.3539825621071802
Energy: 1.5802771232707558
Energy: 1.364044666569835
Energy: 1.3549492929370888
Energy: 1.430386845457487
Energy: 1.4290918654290627
Energy: 1.3539825621121753
Energy: 1.5802771232720798
Energy: 1.3640446665704968
Energy: 1.3549492929344409
Energy: 1.448937971028339
Energy: 1.4332326866223506
Energy: 1.4773651553450082
Energy: 1.3761306489426834
Energy: 1.4363219613280303
Energy: 1.3593319546674119
Energy: 1.4489379710280381
Energy: 1.4332326866220497
Energy: 1.477365155345369
Energy: 1.3761306489433458
Energy: 1.3873674728997367
Energy: 1.4533484858471506
Energy: 1.3692164549406884
Energy: 1.4472783603500516
Energy: 1.3848320314097995
Energy: 1.4205892957377886
Energy: 1.3873674729056948
Energy: 1.4533484858458268
Energy: 1.3692164549459849
Energy: 1.4472783603606436
Energy: 1.4246707060039818
Energy: 1.4959756549932977
Energy: 1.4492892643599184
Energy: 1.4344199049048145
Energy: 1.5292199482282134
Energy: 1.367364157974657
Energy: 1.4246707060036807
Energy: 1.4959756549896266
Energy: 1.4492892643592565
Energy: 1.4344199049054767
Energy: 1.4426334563763135
Energy: 1.4196565004061743
Energy: 1.3429802966887554
Energy: 1.5299791960847198
Energy: 1.431307631430643
Energy: 1.4531569210156534
Energy: 1.4426334563759522
Energy: 1.4196565004068362
Energy: 1.3429802966887554
Energy: 1.5299791960850808
Energy: 1.3554456427937784
Energy: 1.4271308844259345
Energy: 1.3807617072289313
Energy: 1.3531137269468971
Energy: 1.4301479872970646
Energy: 1.4884639957394825
Energy: 1.3554456427941397
Energy: 1.4271308844288835
Energy: 1.3807617072292322
Energy: 1.353113726945874
Energy: 1.3570917503426312
Energy: 1.4858509313292598
Energy: 1.4264038932134275
Energy: 1.4178729694025656
Energy: 1.3512643297094535
Energy: 1.381325911903721
Energy: 1.3570917503432933
Energy: 1.485850931329621
Energy: 1.4264038932131267
Energy: 1.4178729694028664
Energy: 1.4858621129538112
Energy: 1.424226333539205
Energy: 1.4530750085187476
Energy: 1.3678060444667925
Energy: 1.446330559332772
Energy: 1.434003532689375
Energy: 1.4858621152119174
Energy: 1.4242263335389038
Energy: 1.4530750085187476
Energy: 1.3678060444667925
Energy: 1.5723826956034088
Energy: 1.5170257644204768
Energy: 1.3886776438952648
Energy: 1.3693289704756448
Energy: 1.3999955118288847
Energy: 1.4329726735227066
Energy: 1.5723826956034088
Energy: 1.517025764421139
Energy: 1.388677643882025
Energy: 1.3693289704769689
Energy: 1.447317615805177
Energy: 1.4360155586213013
Energy: 1.661969490290148
Energy: 1.3764553865130307
Energy: 1.4235871052907074
Energy: 1.4853274780810832
Energy: 1.4473176158048162
Energy: 1.4360155586206391
Energy: 1.661969490290509
Energy: 1.3764553865143547
Energy: 1.3405781181694647
Energy: 1.4471809610656206
Energy: 1.4339926565267145
Energy: 1.4437712094918753
Energy: 1.3384349115044467
Energy: 1.3526309562153385
Energy: 1.3405781181698255
Energy: 1.4471809610673054
Energy: 1.4339926565263534
Energy: 1.4437712094921762
Energy: 1.3374837587063089
Energy: 1.4134120214246626
Energy: 1.437038329415673
Energy: 1.4933679767809298
Energy: 1.3413642774372299
Energy: 1.35186870162969
Energy: 1.337483758710943
Energy: 1.4134120214256258
Energy: 1.437038329415673
Energy: 1.4933679767799668
Energy: 1.4285573720014146
Energy: 1.3701275071361205
Energy: 1.6519237708267938
Energy: 1.4253490059215193
Energy: 1.4486551040473588
Energy: 1.4848902897148897
Energy: 1.4285573720010534
Energy: 1.3701275071347967
Energy: 1.6519237708267938
Energy: 1.4253490059215193
Energy: 1.402224306213307
Energy: 1.3872540930712955
Energy: 1.4605573051081018
Energy: 1.5186723118521053
Energy: 1.5052283665810133
Energy: 1.4333014828824269
Energy: 1.4022243062136681
Energy: 1.3872540930712955
Energy: 1.4605573051081018
Energy: 1.5186723118474714
Energy: 1.4566986325980857
Energy: 1.372069909974694
Energy: 1.4584027795672065
Energy: 1.474183288923959
Energy: 1.452503127534736
Energy: 1.4669572897900236
Energy: 1.4566986325974238
Energy: 1.3720699099743328
Energy: 1.4584027795668457
Energy: 1.47418328892426
Energy: 1.3518533175455114
Energy: 1.3998925256299852
Energy: 1.4258749274600697
Energy: 1.4850043527945085
Energy: 1.3515595154086806
Energy: 1.3772397037832387
Energy: 1.3518533175458725
Energy: 1.3998925256306471
Energy: 1.4258749274597686
Energy: 1.4850043527948695
Energy: 1.4432315664144169
Energy: 1.4248382895892422
Energy: 1.4415668563171242
Energy: 1.3527448776731816
Energy: 1.3599041117654
Energy: 1.477267383322705
Energy: 1.4432315664147781
Energy: 1.4248382895815992
Energy: 1.4415668563181474
Energy: 1.3527448776777555
Energy: 1.4308554309753112
Energy: 1.4866518026948579
Energy: 1.3420707343500324
Energy: 1.4241763528597393
Energy: 1.3389030692637922
Energy: 1.4184789654566203
Energy: 1.4308554309749497
Energy: 1.4866518026931728
Energy: 1.3420707343500324
Energy: 1.4241763528597393
Energy: 1.5553737275683677
Energy: 1.4357346961164854
Energy: 1.4713657916503142
Energy: 1.5017909844045911
Energy: 1.4242908069105282
Energy: 1.3693524038055798
Energy: 1.5553737275677055
Energy: 1.4357346961168467
Energy: 1.4713657916499532
Energy: 1.5017909844056145
Energy: 1.3997544130463921
Energy: 1.5327816780225028
Energy: 1.5144128438855016
Energy: 1.447646604676464
Energy: 1.3863428932523922
Energy: 1.4210981019540332
Energy: 1.3997544130467536
Energy: 1.5327816780218406
Energy: 1.5144128438868256
Energy: 1.447646604676163
Energy: 1.4590039586607273
Energy: 1.4415997945294794
Energy: 1.4770524177004822
Energy: 1.4338736373318455
Energy: 1.4585802703506912
Energy: 1.3598724590554718
Energy: 1.4590039586607273
Energy: 1.4415997945298404
Energy: 1.4770524177007833
Energy: 1.4338736373325076
Energy: 1.4278117885480375
Energy: 1.3501682646040718
Energy: 1.3533240065472536
Energy: 1.5829935067370637
Energy: 1.4086078737190777
Energy: 1.4212391933315172
Energy: 1.4278117885480375
Energy: 1.3501682646044328
Energy: 1.3533240065485777
Energy: 1.5829935067413365
Energy: 1.3547070592654449
Energy: 1.353083117326571
Energy: 1.3592626349513501
Energy: 1.478596987843572
Energy: 1.5258540328474297
Energy: 1.4365134171746976
Energy: 1.3547070592631578
Energy: 1.3530831173255478
Energy: 1.3592626349556836
Energy: 1.4785969878376137
Energy: 1.3610793334607247
Energy: 1.3582039902521432
Energy: 1.4300465186487938
Energy: 1.4256726038564256
Energy: 1.3769521070169142
Energy: 1.5916937771327853
Energy: 1.3610793334597617
Energy: 1.35820399025118
Energy: 1.4300465186477707
Energy: 1.4256726038567868
Energy: 1.482497404918305
Energy: 1.3753097138572419
Energy: 1.4372170100156327
Energy: 1.3595466903505267
Energy: 1.447969630977283
Energy: 1.4333348201606129
Energy: 1.482497404918606
Energy: 1.375309713856941
Energy: 1.437217010015272
Energy: 1.3595466903498645
Energy: 1.5954497175625142
Energy: 1.4465203352290412
Energy: 1.3859411666435835
Energy: 1.422359236176063
Energy: 1.383253237837313
Energy: 1.4576447324445738
Energy: 1.5954497175611901
Energy: 1.4465203352290412
Energy: 1.3859411666452084
Energy: 1.422359236175401
Energy: 1.3979636035871372
Energy: 1.4333710223428693
Energy: 1.4536800818100157
Energy: 1.3643238607992278
Energy: 1.4397222698759062
Energy: 1.3819221043439691
Energy: 1.3979636035858132
Energy: 1.4333710223425682
Energy: 1.4536800818093536
Energy: 1.3643238607992278
Energy: 1.3468486675124183
Energy: 1.544424896581132
Energy: 1.4327483651012123
Energy: 1.465202536107225
Energy: 1.4468087212290512
Energy: 1.3545570336594361
Energy: 1.3468486675130804
Energy: 1.544424896581132
Energy: 1.432748365100851
Energy: 1.465202536106563
Energy: 1.3800294678176626
Energy: 1.3530259811374155
Energy: 1.495096725972164
Energy: 1.4887803086294857
Energy: 1.3543891823304954
Energy: 1.4278853857113067
Energy: 1.3800294678179634
Energy: 1.3530259811367533
Energy: 1.4950967259718029
Energy: 1.4887803086294857
Energy: 1.4266041535509528
Energy: 1.3689114700280758
Energy: 1.3507388000042473
Energy: 1.5141191431050136
Energy: 1.3578570988581893
Energy: 1.4844835685095066
Energy: 1.4266041535506522
Energy: 1.3689114700307239
Energy: 1.3507388000042473
Energy: 1.5141191431043517
Energy: 1.4627218699677518
Energy: 1.3630474046898422
Energy: 1.4524753197005653
Energy: 1.433678198653479
Energy: 1.4581623101326324
Energy: 1.4241707680419673
Energy: 1.462721869968414
Energy: 1.3630474046902035
Energy: 1.4524753197009264
Energy: 1.43367819865378
Energy: 1.3856596382039486
Energy: 1.370652053083742
Energy: 1.622655650633179
Energy: 1.4335616145409067
Energy: 1.572001141402033
Energy: 1.5185516731460929
Energy: 1.3856596376375114
Energy: 1.37065205308308
Energy: 1.6226556506288459
Energy: 1.4335616145405454
Energy: 1.705664816254923
Energy: 1.3808263143083386
Energy: 1.4236251419742545
Energy: 1.4835019752949796
Energy: 1.4407586066572784
Energy: 1.4355308506941933
Energy: 1.7056648162546222
Energy: 1.3808263143086394
Energy: 1.4236251419738932
Energy: 1.4835019752949796
Energy: 1.4554752269396942
Energy: 1.4141626088140886
Energy: 1.3387182822473656
Energy: 1.429968258225265
Energy: 1.3399752812543342
Energy: 1.5484434811870786
Energy: 1.4554752269374072
Energy: 1.4141626088061447
Energy: 1.3387182822473656
Energy: 1.429968258227251
Energy: 1.4532613383581015
Energy: 1.4871057310109377
Energy: 1.3433071120137259
Energy: 1.3525822834836478
Energy: 1.3385424319273058
Energy: 1.4130574967569385
Energy: 1.4532613383535276
Energy: 1.4871057310106368
Energy: 1.3433071120137259
Energy: 1.3525822834823238
Energy: 1.4796853848190088
Energy: 1.4285808481233622
Energy: 1.3837231004565143
Energy: 1.4811520498583153
Energy: 1.4301382771046642
Energy: 1.3703550448263122
Energy: 1.4796853848196707
Energy: 1.4285808481227003
Energy: 1.3837231004558523
Energy: 1.4811520498586161
Energy: 1.4635531977329956
Energy: 1.4568392695678785
Energy: 1.5043712589987928
Energy: 1.433985718620775
Energy: 1.3758042935545465
Energy: 1.3825739187278439
Energy: 1.463553197737991
Energy: 1.4568392695801557
Energy: 1.5043712589977698
Energy: 1.433985718620775
Energy: 1.4663487665641637
Energy: 1.4347066280493739
Energy: 1.4446254772298195
Energy: 1.4524100327999592
Energy: 1.4524162450600329
Energy: 1.3745527791276189
Energy: 1.4663487665664505
Energy: 1.4347066280493739
Energy: 1.4446254772278335
Energy: 1.452410032800621
Energy: 1.427176568713357
Energy: 1.481300113504777
Energy: 1.3512432838349242
Energy: 1.3730591580573597
Energy: 1.4631348510167679
Energy: 1.3983228447983806
Energy: 1.4271765687137183
Energy: 1.481300113504115
Energy: 1.3512432838372113
Energy: 1.3730591580563367
Energy: 1.3414784018127999
Energy: 1.3521752685121118
Energy: 1.3456555671534003
Energy: 1.4750955145236293
Energy: 1.440568053460963
Energy: 1.3975676451220913
Energy: 1.341478401812499
Energy: 1.352175268512774
Energy: 1.3456555671540622
Energy: 1.4750955145236293
Energy: 1.3405871121702413
Energy: 1.42689829639216
Energy: 1.339919018967394
Energy: 1.4187495079587493
Energy: 1.4308985576301205
Energy: 1.4608568937961617
Energy: 1.3405871121702413
Energy: 1.426898296391498
Energy: 1.3399190189664312
Energy: 1.4187495079580874
Energy: 1.47153529365799
Energy: 1.4821338742780086
Energy: 1.4237276822976501
Energy: 1.37313184588521
Energy: 1.6638800807322902
Energy: 1.4332257232142762
Energy: 1.4715352936576889
Energy: 1.4821338742773464
Energy: 1.4237276822966871
Energy: 1.37313184588521
Energy: 1.5046247923308387
Energy: 1.4347521631883018
Energy: 1.3816843635327622
Energy: 1.4208049991938476
Energy: 1.3995968432477806
Energy: 1.518942951958863
Energy: 1.5046247923315008
Energy: 1.4347521631876399
Energy: 1.3816843635327622
Energy: 1.4208049991938476
Energy: 1.4603766169655605
Energy: 1.4326600339701672
Energy: 1.4521571724687548
Energy: 1.3611282361743735
Energy: 1.4544890007014155
Energy: 1.4452529664468108
Energy: 1.4603766169658616
Energy: 1.4326600339701672
Energy: 1.4521571724697175
Energy: 1.3611282361746742
Energy: 1.355317307450656
Energy: 1.5834791386572082
Energy: 1.3501486726390306
Energy: 1.426773922534441
Energy: 1.4264443242985791
Energy: 1.3508614574322135
Energy: 1.355317307451679
Energy: 1.583479138656245
Energy: 1.3501486726399934
Energy: 1.426773922534441
Energy: 1.3650894189574814
Energy: 1.4793311418611461
Energy: 1.4934477644983863
Energy: 1.3523437122456101
Energy: 1.3522905249060102
Energy: 1.3528261566442426
Energy: 1.3650894189574814
Energy: 1.4793311418581374
Energy: 1.4934477645003723
Energy: 1.3523437122453092
Energy: 1.440292445375368
Energy: 1.4201104894068122
Energy: 1.3778066274001446
Energy: 1.503741324063219
Energy: 1.3593519172890955
Energy: 1.356669600851042
Energy: 1.440292445375368
Energy: 1.420110489407173
Energy: 1.3778066273994827
Energy: 1.503741324065205
Energy: 1.4383243261855276
Energy: 1.3604704874991047
Energy: 1.4487693808804953
Energy: 1.4331108469693585
Energy: 1.4100811984268087
Energy: 1.3778094434397923
Energy: 1.4383243261858285
Energy: 1.3604704874980815
Energy: 1.4487693808815187
Energy: 1.4331108469693585

minimum gb energy = 1.3374837587063089 eV
minimum distance =  2.21293612028601 Angstroms
sigma value = 293


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

Energy: 1.536767615841791
Energy: 1.4614364093512056
Energy: 1.3923847107540075
Energy: 1.60302594854511
Energy: 1.3931943186681621
Energy: 1.4609506669570171
Energy: 1.5367676158498986
Energy: 1.461436409348773
Energy: 1.39238471075117
Energy: 1.6030259485447047
Energy: 1.331624620443022
Energy: 1.5235670133321288
Energy: 1.3922783920672368
Energy: 1.3739405744691535
Energy: 1.4036531943968797
Energy: 1.4372597148456903
Energy: 1.3316246204422113
Energy: 1.5235670133329027
Energy: 1.3922783920688582
Energy: 1.3739405744691535
Energy: 1.4776126437715866
Energy: 1.4117337783524975
Energy: 1.4404092051141124
Energy: 1.395793151497277
Energy: 1.405299631172414
Energy: 1.3172437558310088
Energy: 1.4559612495084728
Energy: 1.4117337783512813
Energy: 1.440409205115734
Energy: 1.3957931515005202
Energy: 1.4162727642474147
Energy: 1.41441302028592
Energy: 1.5265756140756643
Energy: 1.4353960584524792
Energy: 1.396983279741206
Energy: 1.4067738836385943
Energy: 1.4162727642445772
Energy: 1.4144130202875416
Energy: 1.5265756140780966
Energy: 1.4353960584415704
Energy: 1.3568582093507504
Energy: 1.4955194187645904
Energy: 1.4319385304962433
Energy: 1.4060457964943862
Energy: 1.5958658731284057
Energy: 1.3303232730040815
Energy: 1.3568582093495343
Energy: 1.4955194187654013
Energy: 1.431938530495027
Energy: 1.406045796493981
Energy: 1.3639301613349315
Energy: 1.3817272204591105
Energy: 1.3754947610042627
Energy: 1.5407089033098338
Energy: 1.4039441980903211
Energy: 1.4313689414705777
Energy: 1.3639301613341206
Energy: 1.3817272204599211
Energy: 1.3754947610038573
Energy: 1.5407089033146986
Energy: 1.397677846138915
Energy: 1.3845498014700413
Energy: 1.4418277526223657
Energy: 1.4821336327490677
Energy: 1.4237395181499162
Energy: 1.4974759271919498
Energy: 1.3976778461385095
Energy: 1.3845498014696358
Energy: 1.441827752622771
Energy: 1.482133632750284
Energy: 1.4067679998786926
Energy: 1.4192500965832038
Energy: 1.4192428534984503
Energy: 1.406665707579797
Energy: 1.3617676116096042
Energy: 1.361263961509281
Energy: 1.4067679998790978
Energy: 1.4192500965832038
Energy: 1.4192428534988555
Energy: 1.406665707579797
Energy: 1.4819712871429893
Energy: 1.4416973410411675
Energy: 1.3844502524579467
Energy: 1.3976892084207242
Energy: 1.5006470691572917
Energy: 1.4242980769791151
Energy: 1.4819712871531239
Energy: 1.441697341041573
Energy: 1.3844502524591629
Energy: 1.3976892084207242
Energy: 1.540680300731827
Energy: 1.3757555677996158
Energy: 1.381654801768408
Energy: 1.3639831105877818
Energy: 1.4318131415273285
Energy: 1.4038569654319666
Energy: 1.5406803007322323
Energy: 1.3757555677963726
Energy: 1.3816548017675974
Energy: 1.363983110588998
Energy: 1.4062152379734878
Energy: 1.4311323299544418
Energy: 1.4955194187645904
Energy: 1.3561314800701663
Energy: 1.3303369750078715
Energy: 1.5958658731292164
Energy: 1.4062152379730826
Energy: 1.4311323299548473
Energy: 1.4955194187641851
Energy: 1.3561314800709772
Energy: 1.4559666106673557
Energy: 1.5264413470800977
Energy: 1.4157395570783076
Energy: 1.4159921280821106
Energy: 1.406203907472239
Energy: 1.396991086457544
Energy: 1.455966610666545
Energy: 1.5264413470796923
Energy: 1.4157395570811455
Energy: 1.415992133207665
Energy: 1.3988456299630216
Energy: 1.4404122012136524
Energy: 1.4122309900051926
Energy: 1.4560621078050635
Energy: 1.3172525837147409
Energy: 1.3747536797282567
Energy: 1.3988456299626164
Energy: 1.4404122012132472
Energy: 1.4122309900051926
Energy: 1.4560621078050635
Energy: 1.3739680994625134
Energy: 1.3923899089106253
Energy: 1.5240437822302104
Energy: 1.3318759477165178
Energy: 1.4375074317370347
Energy: 1.4038547491820892
Energy: 1.3739680994629189
Energy: 1.3923899089098144
Energy: 1.5240437822285888
Energy: 1.3318759477153015
Energy: 1.6220707649364468
Energy: 1.3931943186665405
Energy: 1.4609506669574226
Energy: 1.5367676158430073
Energy: 1.4614364093475567
Energy: 1.3923847107527914
Energy: 1.5358080933076552
Energy: 1.3931943186673514
Energy: 1.460950666956612
Energy: 1.536767615860402
Energy: 1.3739405744691535
Energy: 1.4036531943972852
Energy: 1.4372597148456903
Energy: 1.3316246204369409
Energy: 1.523567013331318
Energy: 1.3922783920696689
Energy: 1.373940574468748
Energy: 1.4036531943972852
Energy: 1.4372597148452848
Energy: 1.3316246204397788
Energy: 1.3957931514960609
Energy: 1.3946715312554956
Energy: 1.3172437558310088
Energy: 1.4776126437699648
Energy: 1.4117337783516868
Energy: 1.440409205115734
Energy: 1.3957931514976825
Energy: 1.405299631172414
Energy: 1.3172437558310088
Energy: 1.4559612495076621
Energy: 1.4353960584488306
Energy: 1.3969832797424224
Energy: 1.4067738836365675
Energy: 1.4162727642461985
Energy: 1.4144130202871363
Energy: 1.5265756140760698
Energy: 1.435396058439543
Energy: 1.396983279743233
Energy: 1.4067738836385943
Energy: 1.4162727642445772
Energy: 1.4060457964943862
Energy: 1.5958658731284057
Energy: 1.3303232730036763
Energy: 1.3568582093495343
Energy: 1.4955194187654013
Energy: 1.4319385304954324
Energy: 1.406045796493981
Energy: 1.5958658731292164
Energy: 1.3303232730044872
Energy: 1.3568582093499397
Energy: 1.5407089033134824
Energy: 1.4039441980903211
Energy: 1.4313689414693616
Energy: 1.363930161330472
Energy: 1.3817272204599211
Energy: 1.3754947610022357
Energy: 1.540708903312266
Energy: 1.403944198091132
Energy: 1.4313689414685509
Energy: 1.36393016133331
Energy: 1.4821336327486623
Energy: 1.4237395181491053
Energy: 1.4974759271919498
Energy: 1.3976778461385095
Energy: 1.3845498014712574
Energy: 1.441827752622771
Energy: 1.482133632755554
Energy: 1.4237395181491053
Energy: 1.4974759271927607
Energy: 1.397677846138915
Energy: 1.4066657075802027
Energy: 1.3617676116112258
Energy: 1.361263961509281
Energy: 1.4067679998786926
Energy: 1.4192500965832038
Energy: 1.4192428534984503
Energy: 1.4066657075802027
Energy: 1.3617676116096042
Energy: 1.3612639615088755
Energy: 1.406767999878287
Energy: 1.3976892084203185
Energy: 1.5006470691564808
Energy: 1.4242980769823583
Energy: 1.481971287145827
Energy: 1.441697341041573
Energy: 1.3844502524563251
Energy: 1.3976892084207242
Energy: 1.5006470691572917
Energy: 1.4242980769819529
Energy: 1.4819712871523132
Energy: 1.3639831105877818
Energy: 1.4318131415269233
Energy: 1.4038569654307504
Energy: 1.5406803007326375
Energy: 1.3757555677975886
Energy: 1.3816548017688135
Energy: 1.3639831105885927
Energy: 1.431813141527734
Energy: 1.4038569654307504
Energy: 1.5406803007326375
Energy: 1.356131480070572
Energy: 1.330336975009493
Energy: 1.5958658731292164
Energy: 1.4062152379738933
Energy: 1.4311323299544418
Energy: 1.4955194187645904
Energy: 1.3561314800701663
Energy: 1.330336975008277
Energy: 1.5958658731292164
Energy: 1.406215237975515
Energy: 1.4159921319320348
Energy: 1.4062039074730497
Energy: 1.3969910864547064
Energy: 1.4559666106657343
Energy: 1.5264413470792868
Energy: 1.4157395570799292
Energy: 1.4159921302504201
Energy: 1.4062039074726445
Energy: 1.3969910864587602
Energy: 1.4559666106653288
Energy: 1.4560621078050635
Energy: 1.317252583715146
Energy: 1.3747536797234288
Energy: 1.3988456299622107
Energy: 1.4404122012144633
Energy: 1.4122309900039762
Energy: 1.4560621078050635
Energy: 1.3172525837147409
Energy: 1.3747536797266349
Energy: 1.3988456299630216
Energy: 1.331875947717734
Energy: 1.4375074317370347
Energy: 1.4038547491824949
Energy: 1.373968099463324
Energy: 1.3923899089106253
Energy: 1.5240437822289943
Energy: 1.3318759477161124
Energy: 1.4375074317374401
Energy: 1.4038547491820892
Energy: 1.3739680994629189
Energy: 1.5367676158401693
Energy: 1.4614364093479624
Energy: 1.3923847107519807
Energy: 1.600595889232016
Energy: 1.3931943186685676
Energy: 1.4609506669541794
Energy: 1.536767615848277
Energy: 1.4614364093386383
Energy: 1.3923847107527914
Energy: 1.528352742414772
Energy: 1.3316246204547786
Energy: 1.5235670133329027
Energy: 1.3922783920708852
Energy: 1.373940574468748
Energy: 1.4036531943972852
Energy: 1.4372597148460957
Energy: 1.3316246204527513
Energy: 1.5235670133349297
Energy: 1.3922783920700743
Energy: 1.3739405744691535
Energy: 1.4776126437691541
Energy: 1.4117337783512813
Energy: 1.4404092051153286
Energy: 1.3957931515025472
Energy: 1.4052996311740356
Energy: 1.3172437558310088
Energy: 1.4559612495080676
Energy: 1.4117337783524975
Energy: 1.4404092051149233
Energy: 1.3957931515009256
Energy: 1.4162727642449826
Energy: 1.4144130202867309
Energy: 1.5265756140780966
Energy: 1.4353960584018415
Energy: 1.3969832797424224
Energy: 1.4067738836373782
Energy: 1.4162727642445772
Energy: 1.4144130202863257
Energy: 1.5265756140793127
Energy: 1.4353960584363
Energy: 1.3568582093495343
Energy: 1.49551941876378
Energy: 1.4319385304954324
Energy: 1.4060457964935753
Energy: 1.595865873128811
Energy: 1.3303232730032708
Energy: 1.3568582093499397
Energy: 1.4955194187641851
Energy: 1.4319385304954324
Energy: 1.40604579649317
Energy: 1.3639301613345258
Energy: 1.381727220459516
Energy: 1.3754947610018304
Energy: 1.5407089033090229
Energy: 1.4039441980903211
Energy: 1.431368941469767
Energy: 1.36393016133331
Energy: 1.381727220459516
Energy: 1.375494761003452
Energy: 1.5407089033098338
Energy: 1.397677846138915
Energy: 1.3845498014704467
Energy: 1.441827752622771
Energy: 1.4821336327515
Energy: 1.4237395181503214
Energy: 1.497475927192355
Energy: 1.3976778461385095
Energy: 1.384549801472879
Energy: 1.441827752622771
Energy: 1.482133632755554
Energy: 1.406767999878287
Energy: 1.4192500965832038
Energy: 1.419242853499261
Energy: 1.4066657075793918
Energy: 1.361767611608388
Energy: 1.361263961509281
Energy: 1.406767999878287
Energy: 1.419250096582393
Energy: 1.4192428534988555
Energy: 1.4066657075793918
Energy: 1.4819712871429893
Energy: 1.441697341041573
Energy: 1.3844502524583522
Energy: 1.3976892084203185
Energy: 1.5006470691572917
Energy: 1.4242980769815476
Energy: 1.4819712871397461
Energy: 1.4416973410411675
Energy: 1.3844502524563251
Energy: 1.3976892084207242
Energy: 1.540680300731827
Energy: 1.375755567798805
Energy: 1.3816548017659758
Energy: 1.3639831105881872
Energy: 1.431813141525707
Energy: 1.4038569654315611
Energy: 1.5406803007326375
Energy: 1.375755567800021
Energy: 1.3816548017688135
Energy: 1.3639831105885927
Energy: 1.4062152379730826
Energy: 1.4311323299548473
Energy: 1.4955194187649956
Energy: 1.3561314800709772
Energy: 1.330336975009493
Energy: 1.5958658731296218
Energy: 1.4062152379734878
Energy: 1.4311323299544418
Energy: 1.4955194187654013
Energy: 1.3561314800701663
Energy: 1.4559666106661395
Energy: 1.5264413470784761
Energy: 1.415739557078713
Energy: 1.4159921230541825
Energy: 1.406203907471428
Energy: 1.396991086457544
Energy: 1.4559666106661395
Energy: 1.5264413470800977
Energy: 1.4157395570791185
Energy: 1.4159921300713094

minimum gb energy = 1.3172437558310088 eV
minimum distance =  2.21025184519141 Angstroms
sigma value = 293


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

Energy: 1.1392464737049528
Energy: 1.4052086871752767
Energy: 1.1698256150952873
Energy: 1.4348645358889922
Energy: 1.1698357089316425
Energy: 1.4041247255961429
Energy: 1.1392464737049528
Energy: 1.4052086871708804
Energy: 1.1698256150952873
Energy: 1.4579133825456474
Energy: 1.2459789323746027
Energy: 1.7348877226014852
Energy: 1.1698951693901567
Energy: 1.555504497023312
Energy: 1.5872929112687413
Energy: 1.1708928587348173
Energy: 1.2459789323826622
Energy: 1.4966104472105952
Energy: 1.1698951693879585
Energy: 1.5649328079696934
Energy: 1.2141375613897665
Energy: 1.1362292594270913
Energy: 1.5284772666392419
Energy: 1.1360594707307126
Energy: 1.2916207214539406
Energy: 1.172602185195037
Energy: 1.2141375613875685
Energy: 1.1362292594263583
Energy: 1.5284772666407074
Energy: 1.1360594707329106
Energy: 1.528626646726655
Energy: 1.1362106491386301
Energy: 1.214136211833518
Energy: 1.1726138376329858
Energy: 1.291668252951197
Energy: 1.1361140461655836
Energy: 1.528626646726655
Energy: 1.1362106491393629
Energy: 1.214136211836449
Energy: 1.1726138376329858
Energy: 1.1698761385012164
Energy: 1.798651212028431
Energy: 1.2460607378642952
Energy: 1.1709074557116996
Energy: 1.5873977980255594
Energy: 1.5113350519404773
Energy: 1.1698761385019492
Energy: 1.8226575812367234
Energy: 1.2460607378628297
Energy: 1.1709074557124322
Energy: 1.1698357089323754
Energy: 1.2676964951021137
Energy: 1.1392464737049528
Energy: 1.4052086871686822
Energy: 1.1698256150945543
Energy: 1.535458850490987
Energy: 1.16983570893091
Energy: 1.4124176779043216
Energy: 1.1392464737049528
Energy: 1.4052086871730785
Energy: 1.5872929112680088
Energy: 1.170892858733352
Energy: 1.2459789323826622
Energy: 1.6255702016223508
Energy: 1.169895169389424
Energy: 1.4707787011393163
Energy: 1.5872929112687413
Energy: 1.1708928587326193
Energy: 1.2459789323819297
Energy: 1.4966104472120607
Energy: 1.2916207214583366
Energy: 1.17260218519577
Energy: 1.2141375613890337
Energy: 1.1362292594270913
Energy: 1.5284772666399749
Energy: 1.1360594707321778
Energy: 1.291620721454673
Energy: 1.172602185195037
Energy: 1.2141375613890337
Energy: 1.1362292594270913
Energy: 1.2916682529504642
Energy: 1.1361140461626529
Energy: 1.528626646726655
Energy: 1.1362106491378974
Energy: 1.2141362118327852
Energy: 1.1726138376329858
Energy: 1.2916682529504642
Energy: 1.1361140461626529
Energy: 1.528626646726655
Energy: 1.1362106491386301
Energy: 1.5873977980255594
Energy: 1.5652343876958101
Energy: 1.16987613850488
Energy: 1.8226575812396542
Energy: 1.2460607378657607
Energy: 1.1709074557109667
Energy: 1.5873977980255594
Energy: 1.590655625227894
Energy: 1.1698761385041472
Energy: 1.8226575812359906
Energy: 1.1698256150952873
Energy: 1.503872884717483
Energy: 1.1698357089301772
Energy: 1.2676964950999157
Energy: 1.1392464737049528
Energy: 1.4052086871664842
Energy: 1.1698256150967528
Energy: 1.4579133825434492
Energy: 1.1698357089316425
Energy: 1.348787614607832
Energy: 1.169895169386493
Energy: 1.3270528232793304
Energy: 1.5872929112687413
Energy: 1.1708928587362826
Energy: 1.2459789323760682
Energy: 1.4966104472135262
Energy: 1.169895169386493
Energy: 1.4236276357112345
Energy: 1.587292911269474
Energy: 1.1708928587362826
Energy: 1.5284772666399749
Energy: 1.1360594707329106
Energy: 1.2916207214568713
Energy: 1.172602185195037
Energy: 1.2141375613897665
Energy: 1.1362292594270913
Energy: 1.5284772666385094
Energy: 1.1360594707351088
Energy: 1.291620721454673
Energy: 1.172602185195037
Energy: 1.2141362118342507
Energy: 1.1726138376329858
Energy: 1.2916682529504642
Energy: 1.1361140461626529
Energy: 1.528626646726655
Energy: 1.1362106491386301
Energy: 1.2141362118305872
Energy: 1.1726138376329858
Energy: 1.291668252951197
Energy: 1.1361140461626529
Energy: 1.2460607378606317
Energy: 1.1709074557087686
Energy: 1.5873977980262919
Energy: 1.5652343876943446
Energy: 1.1698761385034147
Energy: 1.822657581237456
Energy: 1.2460607378628297
Energy: 1.1709074557087686
Energy: 1.5873977980262919
Energy: 1.565234387693612
Energy: 1.1392464737049528
Energy: 1.4052086871679497
Energy: 1.1698256150960198
Energy: 1.4579133825434492
Energy: 1.16983570893091
Energy: 1.214254038987546
Energy: 1.1392464737049528
Energy: 1.4052086871716132
Energy: 1.1698256150952873
Energy: 1.4579133825449146
Energy: 1.2459789323760682
Energy: 1.4966104472127935
Energy: 1.169895169389424
Energy: 1.2816250573207097
Energy: 1.5872929112687413
Energy: 1.1708928587326193
Energy: 1.2459789323731374
Energy: 1.496610447211328
Energy: 1.169895169389424
Energy: 1.2816250573185117
Energy: 1.2141375613897665
Energy: 1.1362292594263583
Energy: 1.5284772666392419
Energy: 1.1360594707358413
Energy: 1.2916207214576036
Energy: 1.172602185195037
Energy: 1.2141375613890337
Energy: 1.1362292594256258
Energy: 1.5284772666385094
Energy: 1.1360594707358413
Energy: 1.5286266467259222
Energy: 1.1362106491393629
Energy: 1.2141362118327852
Energy: 1.1726138376322535
Energy: 1.2916682529504642
Energy: 1.1361140461633854
Energy: 1.528626646726655
Energy: 1.1362106491393629
Energy: 1.214136211835716
Energy: 1.1726138376329858
Energy: 1.1698761385012164
Energy: 1.8226575812411197
Energy: 1.2460607378635622
Energy: 1.1709074557109667
Energy: 1.5873977980255594
Energy: 1.565234387691414
Energy: 1.1698761385034147
Energy: 1.8226575812381889
Energy: 1.2460607378642952
Energy: 1.1709074557080361
Energy: 1.16983570893091
Energy: 1.2142540389868133
Energy: 1.1392464737049528
Energy: 1.4052086871738114
Energy: 1.1698256150952873
Energy: 1.4579133825463801
Energy: 1.1698357089316425
Energy: 1.2142540389882786
Energy: 1.1392464737049528
Energy: 1.4052086871716132
Energy: 1.587292911269474
Energy: 1.170892858737748
Energy: 1.2459789323811972
Energy: 1.4966104472120607
Energy: 1.1698951693879585
Energy: 1.2816250573185117
Energy: 1.5872929112687413
Energy: 1.1708928587348173
Energy: 1.2459789323746027
Energy: 1.496610447211328

minimum gb energy = 1.1360594707307126 eV
minimum distance =  2.27001972297334 Angstroms
sigma value = 15


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

Energy: 1.581268830357897
Energy: 1.3505621235931533
Energy: 1.4000869004002812
Energy: 1.3518567747485215
Energy: 1.399721818543786
Energy: 1.3553204103758056
Energy: 1.5812688303572326
Energy: 1.3505621237863654
Energy: 1.4000869004006133
Energy: 1.3725518874810632
Energy: 1.4167234084161247
Energy: 1.4492926405953086
Energy: 1.3991084136694332
Energy: 1.3779915506407079
Energy: 1.3921236442225369
Energy: 1.342656765948284
Energy: 1.4167234084131357
Energy: 1.4492926406192224
Energy: 1.3991084136687688
Energy: 1.3779915506440292
Energy: 1.4462471703581166
Energy: 1.3880804317838737
Energy: 1.4722132517078717
Energy: 1.389069782388004
Energy: 1.4454618109491637
Energy: 1.422337821890441
Energy: 1.4462471703577846
Energy: 1.3880804317838737
Energy: 1.4722132517082038
Energy: 1.389069782388004
Energy: 1.4852354263203484
Energy: 1.354184727191853
Energy: 1.391776112253702
Energy: 1.345313945856245
Energy: 1.4206831046878212
Energy: 1.3431062180595355
Energy: 1.4852354263193523
Energy: 1.3541847271921852
Energy: 1.391776112251377
Energy: 1.3453139458565773
Energy: 1.400307463307495
Energy: 1.4697206239189369
Energy: 1.3405933773402268
Energy: 1.4107679207441106
Energy: 1.3324658057646885
Energy: 1.3447518285326467
Energy: 1.4003074633084913
Energy: 1.4697206239182723
Energy: 1.340593377340559
Energy: 1.4107679207464354
Energy: 1.400877033890066
Energy: 1.4568318565755511
Energy: 1.4142998423884439
Energy: 1.3739042055139499
Energy: 1.3520410315652966
Energy: 1.4884596218562058
Energy: 1.40087703388907
Energy: 1.4568318565755511
Energy: 1.4142998423920972
Energy: 1.373904205514614
Energy: 1.483787792793469
Energy: 1.2990945366593623
Energy: 1.3042513547903123
Energy: 1.3995603071572482
Energy: 1.3939680097308378
Energy: 1.4030088512021517
Energy: 1.4837877927941334
Energy: 1.2990945366606912
Energy: 1.3042513547903123
Energy: 1.3995603071579121
Energy: 1.3548664170607316
Energy: 1.533570527169949
Energy: 1.4041705226912915
Energy: 1.3633881919014208
Energy: 1.3328378588764251
Energy: 1.4007310198682774
Energy: 1.3548664170756777
Energy: 1.5335705271716096
Energy: 1.4041705226916235
Energy: 1.363388191896439
Energy: 1.360635945525672
Energy: 1.4673190382305228
Energy: 1.478960774973496
Energy: 1.3887271433811033
Energy: 1.346508058199185
Energy: 1.3452697541052212
Energy: 1.3606359455250079
Energy: 1.4673190382311871
Energy: 1.4789607749724996
Energy: 1.3887271433817676
Energy: 1.364381120449486
Energy: 1.4089722646318872
Energy: 1.35336104598504
Energy: 1.5030884636245105
Energy: 1.3938494579221559
Energy: 1.379880440163895
Energy: 1.364381120449486
Energy: 1.4089722646328837
Energy: 1.3533610459817187
Energy: 1.5030884636251747
Energy: 1.3464272714706496
Energy: 1.4059095735172409
Energy: 1.3026753029328546
Energy: 1.487535916220461
Energy: 1.335315946129999
Energy: 1.3832747449683012
Energy: 1.3464272714709817
Energy: 1.4059095735165767
Energy: 1.30267530293684
Energy: 1.4875359162188004
Energy: 1.3854786423634613
Energy: 1.454299530890802
Energy: 1.4851704499196592
Energy: 1.3447493571450464
Energy: 1.3929486620536156
Energy: 1.3341374816420313
Energy: 1.3854786423631291
Energy: 1.4542995308901376
Energy: 1.4851704500023308
Energy: 1.3447493571470392
Energy: 1.425566195518361
Energy: 1.368085532669331
Energy: 1.5240723703534693
Energy: 1.4547388912978436
Energy: 1.3752754232862863
Energy: 1.3275020427263848
Energy: 1.425566195520686
Energy: 1.3680855326699954
Energy: 1.5240723703538015
Energy: 1.4547388912981758
Energy: 1.339271170484918
Energy: 1.4838753152497675
Energy: 1.3567328752248116
Energy: 1.4130953101084647
Energy: 1.3843505035773012
Energy: 1.3865392154138911
Energy: 1.3392711704842537
Energy: 1.483875315249103
Energy: 1.356732875223483
Energy: 1.4130953101084647
Energy: 1.387109971322662
Energy: 1.5348640854649074
Energy: 1.459223922414618
Energy: 1.4114432896680356
Energy: 1.4110847498546029
Energy: 1.3259634742664044
Energy: 1.387109971322662
Energy: 1.534864085464243
Energy: 1.4592239224112966
Energy: 1.411443289667039
Energy: 1.3302311898334713
Energy: 1.3955332731964993
Energy: 1.4793698150681778
Energy: 1.4821480648437801
Energy: 1.3684937015670662
Energy: 1.394172080029918
Energy: 1.3302311898341352
Energy: 1.3955332731951708
Energy: 1.4793698150695063
Energy: 1.4821480648431158
Energy: 1.4544432505795932
Energy: 1.3648320806403216
Energy: 1.3703559928650397
Energy: 1.3652423808713234
Energy: 1.5108185068611493
Energy: 1.3924650079393306
Energy: 1.454443250578597
Energy: 1.364832080641318
Energy: 1.3703559928610543
Energy: 1.3652423850799285
Energy: 1.382398499683152
Energy: 1.3842812668297706
Energy: 1.433453505254561
Energy: 1.3067504122840887
Energy: 1.5345360381904605
Energy: 1.407480478787544
Energy: 1.3823984996841483
Energy: 1.3842812668291062
Energy: 1.4334535052542288
Energy: 1.306750412282428
Energy: 1.3175390126314432
Energy: 1.3927086830502404
Energy: 1.4116033256689542
Energy: 1.4897626556452215
Energy: 1.3581764626135395
Energy: 1.5099737071367163
Energy: 1.3175390126301147
Energy: 1.3927086830519013
Energy: 1.4116033256712792
Energy: 1.4897626556462178
Energy: 1.3458986150106482
Energy: 1.422032838165605
Energy: 1.3777408894240397
Energy: 1.5102128841675067
Energy: 1.4120230982226358
Energy: 1.3546258509556783
Energy: 1.3458986150109804
Energy: 1.4220328381669334
Energy: 1.3777408894240397
Energy: 1.510212884165846
Energy: 1.3914544774157864
Energy: 1.3298656642512763
Energy: 1.4014199593449588
Energy: 1.3502579344046686
Energy: 1.4789942067960713
Energy: 1.3024932603313166
Energy: 1.3914544774161184
Energy: 1.3298656642519406
Energy: 1.4014199593486123
Energy: 1.35025793439869
Energy: 1.4234853235146199
Energy: 1.39374375302156
Energy: 1.5554054473377081
Energy: 1.4038020740627788
Energy: 1.4488256363039698
Energy: 1.412739456833197
Energy: 1.423485323524916
Energy: 1.3937437530205636
Energy: 1.5554054473370438
Energy: 1.403802074063443
Energy: 1.4199659512601943
Energy: 1.3613496684640831
Energy: 1.3846254218522016
Energy: 1.4178556840000152
Energy: 1.4021437028779589
Energy: 1.3719497929212894
Energy: 1.4199659512601943
Energy: 1.3613496684640831
Energy: 1.3846254218525338
Energy: 1.4178556840000152
Energy: 1.3925562697585125
Energy: 1.4140077928768888
Energy: 1.333363738341587
Energy: 1.35412057583458
Energy: 1.532804967848955
Energy: 1.4464742029147375
Energy: 1.3925562697588447
Energy: 1.4140077928762245
Energy: 1.3333637383409227
Energy: 1.354120575836573
Energy: 1.392581221294273
Energy: 1.4025820215138296
Energy: 1.3256452214029055
Energy: 1.3862518376229813
Energy: 1.3176331914240331
Energy: 1.472592298191336
Energy: 1.392581221294273
Energy: 1.4025820215148261
Energy: 1.3256452214029055
Energy: 1.386251837621985
Energy: 1.4525241956213217
Energy: 1.3505751886951887
Energy: 1.3832015639457806
Energy: 1.3703382244800701
Energy: 1.4592918757215962
Energy: 1.3538553109832443
Energy: 1.4525241956213217
Energy: 1.350575188696517
Energy: 1.383201563946445
Energy: 1.3703382244813986
Energy: 1.3895583540583474
Energy: 1.3440244262242538
Energy: 1.401238081705859
Energy: 1.37926930173131
Energy: 1.4818545894008344
Energy: 1.3535843187466383
Energy: 1.3895583540580154
Energy: 1.3440244262229253
Energy: 1.4012380817048622
Energy: 1.3792693017319742
Energy: 1.3146272993597716
Energy: 1.4343580530758395
Energy: 1.334632021517395
Energy: 1.3473455765929534
Energy: 1.3961395055523413
Energy: 1.4807337079889442
Energy: 1.314627299360436
Energy: 1.4343580530758395
Energy: 1.3346320215177272
Energy: 1.3473455765929534
Energy: 1.4851247074208873
Energy: 1.372916530710858
Energy: 1.3960559222457347
Energy: 1.5754496859437233
Energy: 1.3976632835757907
Energy: 1.446125830920443
Energy: 1.4851247074218836
Energy: 1.3729165307158397
Energy: 1.3960559222447382
Energy: 1.5754496859417304
Energy: 1.2993188566043337
Energy: 1.4859798814331313
Energy: 1.390814425630854
Energy: 1.3831335637093445
Energy: 1.4844220931128502
Energy: 1.3985549571562839
Energy: 1.2993188566036693
Energy: 1.4859798814331313
Energy: 1.3908144256321826
Energy: 1.3831335637086801
Energy: 1.3503777073169667
Energy: 1.3941195836470344
Energy: 1.3877731210776691
Energy: 1.3848540442275294
Energy: 1.370317458813317
Energy: 1.4958900649656253
Energy: 1.3705886811819865
Energy: 1.3941195836470344
Energy: 1.387773121072687
Energy: 1.384854044226533
Energy: 1.484711089483499
Energy: 1.3940685535254442
Energy: 1.3747965388242944
Energy: 1.3219501568103103
Energy: 1.4105348062846688
Energy: 1.3840925651470555
Energy: 1.4847110894679187
Energy: 1.3940685535257764
Energy: 1.374796538821305
Energy: 1.3219501568103103
Energy: 1.3051949412414858
Energy: 1.4482126197701202
Energy: 1.3847045979368844
Energy: 1.3950972807503081
Energy: 1.3764232849980136
Energy: 1.420955750268057
Energy: 1.3051949412451396
Energy: 1.4482126197684595
Energy: 1.3847045979368844
Energy: 1.3950972807513045
Energy: 1.308996563273781
Energy: 1.4586666471349754
Energy: 1.3745639097428353
Energy: 1.3931687124322174
Energy: 1.3464598951578723
Energy: 1.3795864339284676
Energy: 1.3089965632767704
Energy: 1.4586666471353076
Energy: 1.3745639097428353
Energy: 1.3931687124335461
Energy: 1.449379308854122
Energy: 1.3131018238557361
Energy: 1.402243062131291
Energy: 1.3125040518335092
Energy: 1.3867413041661025
Energy: 1.3940237754796192
Energy: 1.496128880369904
Energy: 1.3131018238557361
Energy: 1.402243062133616
Energy: 1.3125040518338413
Energy: 1.4464492710446384
Energy: 1.4761710841186586
Energy: 1.370904416255586
Energy: 1.3370286053874867
Energy: 1.4047477156916799
Energy: 1.3942021696482712
Energy: 1.4464492710420116
Energy: 1.4761710841286226
Energy: 1.3709044162599036
Energy: 1.3370286053861582
Energy: 1.365255036295889
Energy: 1.3989052585501756
Energy: 1.4729239171538318
Energy: 1.4013297874696173
Energy: 1.3944524131344915
Energy: 1.4841574728098612
Energy: 1.365255036295557
Energy: 1.3989052585528325
Energy: 1.4729239171538318
Energy: 1.4013297874692852
Energy: 1.467699914481888
Energy: 1.4046124690118376
Energy: 1.4546166930541888
Energy: 1.563596542074303
Energy: 1.3973815745280076
Energy: 1.3738152427334258
Energy: 1.4676999144782348
Energy: 1.4046124690118376
Energy: 1.4546166930541888
Energy: 1.5635965420723101
Energy: 1.3720339876090457
Energy: 1.4742045644256077
Energy: 1.368758221279847
Energy: 1.3478174097317037
Energy: 1.337567193124294
Energy: 1.4082021235855564
Energy: 1.3720339876060568
Energy: 1.4742045644259398
Energy: 1.3687582212788505
Energy: 1.3478174097313715
Energy: 1.3892621448173947
Energy: 1.3528538361701405
Energy: 1.4974334309111257
Energy: 1.3925117520766888
Energy: 1.4012388660151345
Energy: 1.3396178409836255
Energy: 1.3892621448183915
Energy: 1.3528538361691438
Energy: 1.4974334309101291
Energy: 1.3925117520766888
Energy: 1.3964211107117235
Energy: 1.3022846648715383
Energy: 1.50823172471837
Energy: 1.364291808519168
Energy: 1.3925294380376723
Energy: 1.3449723976336678
Energy: 1.3964211107097309
Energy: 1.3022846648695454
Energy: 1.508231724708406
Energy: 1.3642918085204963
Energy: 1.363129520396131
Energy: 1.5398343979684372
Energy: 1.3003811631318851
Energy: 1.3263616959389588
Energy: 1.327076640687377
Energy: 1.3913881964149997
Energy: 1.3631295203944702
Energy: 1.5398343979694338
Energy: 1.3003811631285636
Energy: 1.3263616959382944
Energy: 1.3885401965749167
Energy: 1.5180924863713665
Energy: 1.3535217905785064
Energy: 1.389268939640545
Energy: 1.3341618401924
Energy: 1.4245267550108935
Energy: 1.3885401965742523
Energy: 1.5180924863707022
Energy: 1.3535217904237917
Energy: 1.389268939637888
Energy: 1.4212043511641568
Energy: 1.3721247586163328
Energy: 1.4726206382351847
Energy: 1.4446165742294481
Energy: 1.3778919612003888
Energy: 1.3341829533359526
Energy: 1.4212043511634924
Energy: 1.3721247586166647
Energy: 1.4726206382348528
Energy: 1.4446165742294481
Energy: 1.3658532445657023
Energy: 1.4253931603482495
Energy: 1.4111856702383483
Energy: 1.455212770493286
Energy: 1.3910705207660288
Energy: 1.3841998101428288
Energy: 1.3658532445471028
Energy: 1.4253931603492458
Energy: 1.4111856702386805
Energy: 1.455212770494947
Energy: 1.384336431636591
Energy: 1.3775976075015983
Energy: 1.407946102117866
Energy: 1.3543079865852838
Energy: 1.4823866128307754
Energy: 1.3272381174658254
Energy: 1.3843364316375875
Energy: 1.3775976075019305
Energy: 1.4079461021158732
Energy: 1.3543079865846197
Energy: 1.343051624065097
Energy: 1.3703603798933282
Energy: 1.4648114938585886
Energy: 1.5642929844595415
Energy: 1.3785731044977998
Energy: 1.4677243429223683
Energy: 1.343051624065429
Energy: 1.3703603798900066
Energy: 1.4648114938579244
Energy: 1.5642929844592093
Energy: 1.3128418532171424
Energy: 1.3442862925701122
Energy: 1.3482990028683965
Energy: 1.527488269662357
Energy: 1.4298826219744225
Energy: 1.3956020844908057
Energy: 1.3128418532174746
Energy: 1.344286292571773
Energy: 1.348299002869393
Energy: 1.527488269664984
Energy: 1.3929498695127582
Energy: 1.3657026407957018
Energy: 1.480269288261464
Energy: 1.3053582281923448
Energy: 1.3979063969774792
Energy: 1.3118477330713205
Energy: 1.3929498695130904
Energy: 1.3657026407953696
Energy: 1.480269288262128
Energy: 1.3053582281916805

minimum gb energy = 1.2990945366593623 eV
minimum distance =  2.25092353156795 Angstroms
sigma value = 437


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

Energy: 1.4109136769404445
Energy: 1.4887864057090883
Energy: 1.3952134011404969
Energy: 1.5965492434739548
Energy: 1.3947759421442782
Energy: 1.488423616505221
Energy: 1.4109136769392345
Energy: 1.4887864057006182
Energy: 1.395213401139287
Energy: 1.5965492434715347
Energy: 1.419598841189603
Energy: 1.7552068064517918
Energy: 1.3498791894379965
Energy: 1.3602195614350816
Energy: 1.5435302411770135
Energy: 1.3555498306055298
Energy: 1.419598841189603
Energy: 1.7552068064530022
Energy: 1.3498791894379965
Energy: 1.3602195614362915
Energy: 1.364460263177299
Energy: 1.3546520118667107
Energy: 1.325242865644136
Energy: 1.3602366672435033
Energy: 1.3515363334875974
Energy: 1.3773944412429693
Energy: 1.364460263173669
Energy: 1.3546520118679206
Energy: 1.3252429571299023
Energy: 1.3602366672435033
Energy: 1.712551206678016
Energy: 1.3480631007624038
Energy: 1.3685193068241157
Energy: 1.3217618854172652
Energy: 1.3713878929195285
Energy: 1.3406241684723095
Energy: 1.7125512066792261
Energy: 1.3480631007611936
Energy: 1.3685193068241157
Energy: 1.3217618854172652
Energy: 1.3491218770140574
Energy: 1.442287201083758
Energy: 1.3773649701363995
Energy: 1.436404339532009
Energy: 1.2996242395863975
Energy: 1.3527388517721326
Energy: 1.3491218770140574
Energy: 1.3795841734224086
Energy: 1.3773649701351895
Energy: 1.4364043395307986
Energy: 1.345254979462489
Energy: 1.4593839456176465
Energy: 1.3608066988762524
Energy: 1.3398151312612145
Energy: 1.334064038377316
Energy: 1.4631320851316152
Energy: 1.345254979462489
Energy: 1.4593839456200663
Energy: 1.3608066988750422
Energy: 1.3398151312612145
Energy: 1.658376154434359
Energy: 1.361240450255425
Energy: 1.420260188143141
Energy: 1.3197697918202649
Energy: 1.350868720663976
Energy: 1.3555148852437902
Energy: 1.6583761544331488
Energy: 1.361240450255425
Energy: 1.4202601881419306
Energy: 1.3197697918202649
Energy: 1.3633060179048486
Energy: 1.3613933541811134
Energy: 1.3502046327205584
Energy: 1.321617802702769
Energy: 1.5015643959546292
Energy: 1.3479479281533087
Energy: 1.3633060179024288
Energy: 1.3613933541907937
Energy: 1.3502046327217685
Energy: 1.321617802702769
Energy: 1.3237559275308288
Energy: 1.4340184897064137
Energy: 1.6952871336116577
Energy: 1.5970085054454963
Energy: 1.3947097669006527
Energy: 1.6414852890020042
Energy: 1.3237559275296187
Energy: 1.4340184897064137
Energy: 1.6952871336116577
Energy: 1.5970085054479162
Energy: 1.498985659186584
Energy: 1.3499577579808306
Energy: 1.3393195443251231
Energy: 1.4403958906477141
Energy: 1.3502448589585518
Energy: 1.5627148809221116
Energy: 1.498985659186584
Energy: 1.3499577579796755
Energy: 1.3393195443287533
Energy: 1.4403958906501342
Energy: 1.586770828215169
Energy: 1.3379201702155032
Energy: 1.35152062475565
Energy: 1.3607050681819177
Energy: 1.429267392549239
Energy: 1.3490448380932416
Energy: 1.586770828215169
Energy: 1.3379201702155032
Energy: 1.35152062475565
Energy: 1.3607050681819177
Energy: 1.323658121722113
Energy: 1.3614548006599185
Energy: 1.5769017634700575
Energy: 1.327177124296555
Energy: 1.5812671499750774
Energy: 1.3595470269247283
Energy: 1.323658121722113
Energy: 1.3614548006599185
Energy: 1.5769017634712674
Energy: 1.327177124296555
Energy: 1.586878243840324
Energy: 1.3488957697619628
Energy: 1.429267392550449
Energy: 1.3606522763410527
Energy: 1.351617919379717
Energy: 1.3392371796863376
Energy: 1.586878243842744
Energy: 1.3488957697559125
Energy: 1.429267392550449
Energy: 1.3606522763410527
Energy: 1.5174648813994491
Energy: 1.5646078302290205
Energy: 1.350273273176901
Energy: 1.444253291451909
Energy: 1.3565089251352616
Energy: 1.349941911515845
Energy: 1.5174648813994491
Energy: 1.5646078302302304
Energy: 1.350273273176901
Energy: 1.4442532914543293

minimum gb energy = 1.2996242395863975 eV
minimum distance =  2.23718524881429 Angstroms
sigma value = 33