Model name: model_name=MEAM_LAMMPS_LeeBaskesKim_2001_Fe__MO_196726067688_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.863657340407371
cohesive_energy=4.290337440834254
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.013216091199631139
Energy: 0.013771405071511197
Energy: 0.013509740317964257
Energy: 0.013771405071511197
Energy: 0.013216091199631139
Energy: 0.013771405071511197
Energy: 0.013771405071511197
Energy: 2.7245951640221286
Energy: 0.013771405071511197
Energy: 2.7245951640216566
Energy: 0.013771405071511197
Energy: 2.7245951640211565
Energy: 0.013509740317464495
Energy: 0.013771405071511197
Energy: 0.013216091199631139
Energy: 0.013771405071511197
Energy: 0.013509740317964257
Energy: 0.013771405071511197
Energy: 0.013771405071511197
Energy: 2.7245951640221286
Energy: 0.013771405071511197
Energy: 2.7245951640221286
Energy: 0.013771405071511197
Energy: 2.7245951640216566
Energy: 0.013216091199631139
Energy: 0.013771405071511197
Energy: 0.013509740317964257
Energy: 0.013771405071511197
Energy: 0.013216091199631139
Energy: 0.013771405071511197
Energy: 0.013771405071511197
Energy: 2.7245951640216566
Energy: 0.013771405071511197
Energy: 2.7245951640216566
Energy: 0.013771405071511197
Energy: 2.7245951640216566

minimum gb energy = 0.013216091199631139 eV
minimum distance =  2.3798366638097 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.3492760856815078
Energy: 1.2980437691189655
Energy: 1.260740947744258
Energy: 1.2980437691189655
Energy: 1.3492760856827106
Energy: 1.2980437691189655
Energy: 1.355665716500672
Energy: 1.2700064442445285
Energy: 1.3610316041216326
Energy: 1.2700064443407124
Energy: 1.355665716500672
Energy: 1.270006444258964
Energy: 1.2301610245723629
Energy: 1.275183900109285
Energy: 1.355260180419133
Energy: 1.275183900109285
Energy: 1.2301610245723629
Energy: 1.275183900109285
Energy: 1.3954368953958916
Energy: 1.2459226434098727
Energy: 1.2763671169709017
Energy: 1.2459226434110755
Energy: 1.3954368953958916
Energy: 1.2459226434110755
Energy: 1.3587274661932947
Energy: 1.2954266795789378
Energy: 1.2930458325630307
Energy: 1.2954266795789378
Energy: 1.3587274661932947
Energy: 1.295426679580141
Energy: 1.3610282910058766
Energy: 1.2766939272887134
Energy: 1.2563600788272784
Energy: 1.2766939272887134
Energy: 1.3610282910094855
Energy: 1.2766939272887134
Energy: 1.3763791233803198
Energy: 1.2756565738499948
Energy: 1.2686355573746604
Energy: 1.2756565738499948
Energy: 1.3763791233803198
Energy: 1.2756565738499948
Energy: 1.3709038362240065
Energy: 1.2969984124552032
Energy: 1.2166185932447477
Energy: 1.2969984124552032
Energy: 1.3709038362240065
Energy: 1.2969984124552032
Energy: 1.372675797911709
Energy: 1.2473620589710004
Energy: 1.3323130104048504
Energy: 1.2473620589710004
Energy: 1.372675797911709
Energy: 1.2473620589710004
Energy: 1.3480832835450294
Energy: 1.273111651619215
Energy: 1.2611741995329195
Energy: 1.273111651620418
Energy: 1.3480832835450294
Energy: 1.273111651620418
Energy: 1.3483715135181187
Energy: 1.2603031918723082
Energy: 1.3482275499039857
Energy: 1.260303191893962
Energy: 1.3483715135181187
Energy: 1.2603031918686993
Energy: 1.2259286200198811
Energy: 1.2963414708571375
Energy: 1.2365000289790444
Energy: 1.2963414708571375
Energy: 1.225928620021084
Energy: 1.2963414708571375
Energy: 1.3573471176368697
Energy: 1.2603031921392613
Energy: 1.334870727992195
Energy: 1.2603031921079837
Energy: 1.3573471176476963
Energy: 1.2603031921224197
Energy: 1.26184546758435
Energy: 1.2727169308040185
Energy: 1.3475175053819572
Energy: 1.2727169308028157
Energy: 1.261845467585553
Energy: 1.2727169308040185
Energy: 1.273070400405853
Energy: 1.2474264627914078
Energy: 1.3830955794580917
Energy: 1.2474264627902047
Energy: 1.273070400415477
Energy: 1.2474264627914078
Energy: 1.2323958879833734
Energy: 1.2967966072899713
Energy: 1.37283723414934
Energy: 1.2967966072899713
Energy: 1.232395887026235
Energy: 1.2967966072899713
Energy: 1.2655492766577832
Energy: 1.2790803247972
Energy: 1.3623471874037298
Energy: 1.2790803247972
Energy: 1.2655492766613923
Energy: 1.2790803247972
Energy: 1.2570849483254882
Energy: 1.2766545957476907
Energy: 1.3832205618911027
Energy: 1.2766545957476907
Energy: 1.2570849483254882
Energy: 1.2766545957476907
Energy: 1.29082341264021
Energy: 1.2997821590352927
Energy: 1.3695356657033095
Energy: 1.2997821590352927
Energy: 1.290823412639007
Energy: 1.2997821590352927
Energy: 1.2728109259948792
Energy: 1.245646302734203
Energy: 1.3918750760035732
Energy: 1.2456463027354063
Energy: 1.2728109259972853
Energy: 1.2456463027354063
Energy: 1.3536955744386738
Energy: 1.275277482061999
Energy: 1.2301373525046067
Energy: 1.275277482061999
Energy: 1.3536955744398766
Energy: 1.275277482061999
Energy: 1.3538500234979844
Energy: 1.283022231444341
Energy: 1.359574529765392
Energy: 1.2830230216624026
Energy: 1.3538500226130252
Energy: 1.2830218393804742
Energy: 1.260740947744258
Energy: 1.2980437691189655
Energy: 1.3492760856827106
Energy: 1.2980437691189655
Energy: 1.2607409477430551
Energy: 1.2980437691189655

minimum gb energy = 1.2166185932447477 eV
minimum distance =  2.28373321378291 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.8221949408698515
Energy: 1.3612873723256604
Energy: 1.3350707766924497
Energy: 1.3612873723256604
Energy: 1.8221949408691671
Energy: 1.3612873723256604
Energy: 1.367152916964151
Energy: 1.3322215626974374
Energy: 1.4556498000354379
Energy: 1.3322215626981215
Energy: 1.3671529169648355
Energy: 1.3322215626974374
Energy: 1.2811461806100188
Energy: 1.3726075386522734
Energy: 1.4677335267323264
Energy: 1.3726075386522734
Energy: 1.2811461806093345
Energy: 1.3726075386529575
Energy: 1.377317220079214
Energy: 1.3172549531133475
Energy: 1.494625872275341
Energy: 1.3172549531133475
Energy: 1.377317220079214
Energy: 1.3172549531133475
Energy: 1.3738853012164676
Energy: 1.3456693939640347
Energy: 1.411201691523296
Energy: 1.3456693939640347
Energy: 1.3738853012171521
Energy: 1.345669393964719
Energy: 1.3671546512668706
Energy: 1.3464521398027973
Energy: 1.3068638182276922
Energy: 1.3464521398034817
Energy: 1.3671546510521084
Energy: 1.3464521398034817
Energy: 1.3724874872299087
Energy: 1.3384264456840385
Energy: 1.398004765425783
Energy: 1.3384264456389088
Energy: 1.372487487239488
Energy: 1.3384264456847226
Energy: 1.3176831036505758
Energy: 1.349459911367648
Energy: 1.6588488638144885
Energy: 1.3494599113669636
Energy: 1.3176831036505758
Energy: 1.3494599113669636
Energy: 1.3906176454215968
Energy: 1.3173239791593028
Energy: 1.4463982780433593
Energy: 1.3173239791586182
Energy: 1.3906176454229653
Energy: 1.3173239791586182
Energy: 1.3352533550337595
Energy: 1.3634979667539748
Energy: 1.3475416494774628
Energy: 1.3634979667539748
Energy: 1.3352533550337595
Energy: 1.3634979667539748
Energy: 1.3559040338342767
Energy: 1.3308773474610989
Energy: 1.4940706292983366
Energy: 1.3308773474597304
Energy: 1.355904033834961
Energy: 1.3308773474604145
Energy: 1.4715468509804854
Energy: 1.3443306398394164
Energy: 1.3310957568180375
Energy: 1.3443306398394164
Energy: 1.4715468509804854
Energy: 1.3443306398394164
Energy: 1.5283262961930875
Energy: 1.327695350132878
Energy: 1.379845033550778
Energy: 1.327695350130141
Energy: 1.5283262961876445
Energy: 1.327695350129457
Energy: 1.396769840591915
Energy: 1.3728737140424243
Energy: 1.7292745941184107
Energy: 1.3728737140431084
Energy: 1.3967698405932834
Energy: 1.3728737140431084
Energy: 1.4893724213160908
Energy: 1.3393354072649486
Energy: 1.4325413209491764
Energy: 1.3393354072649486
Energy: 1.4893724213160908
Energy: 1.3393354072649486
Energy: 1.4812339954355234
Energy: 1.3407497801089023
Energy: 1.3241566309185326
Energy: 1.3407497801089023
Energy: 1.4812339954293652
Energy: 1.3407497801095867
Energy: 1.5043245610595928
Energy: 1.3393899671911929
Energy: 1.3460897197685522
Energy: 1.3393899671911929
Energy: 1.5043245610602773
Energy: 1.3393899671911929
Energy: 1.4875686729932973
Energy: 1.3351008274776004
Energy: 1.5087693530119948
Energy: 1.3351008274789686
Energy: 1.4875686729932973
Energy: 1.3351008274789686
Energy: 1.2943029645273596
Energy: 1.346469231410274
Energy: 1.6696285927108958
Energy: 1.346469231410274
Energy: 1.2943029645266755
Energy: 1.346469231410274
Energy: 1.3818879031208577
Energy: 1.3174403454042005
Energy: 1.4893303152695314
Energy: 1.3174403454042005
Energy: 1.3818879031215416
Energy: 1.3174403454042005
Energy: 1.4680690016240034
Energy: 1.369673765075242
Energy: 1.320917106481411
Energy: 1.3696737650745578
Energy: 1.468069001623319
Energy: 1.369673765075242
Energy: 1.3536515458721285
Energy: 1.3343891665016079
Energy: 1.4858783681696563
Energy: 1.3343891665022924
Energy: 1.3536515458714444
Energy: 1.3343891665036607
Energy: 1.341399864768733
Energy: 1.346484804787678
Energy: 1.421704657644348
Energy: 1.3464848047883624
Energy: 1.341399864768733
Energy: 1.3464848047883624
Energy: 1.5800437996690413
Energy: 1.3329069261863473
Energy: 1.4720113037958509
Energy: 1.3329069261863473
Energy: 1.5800437996690413
Energy: 1.3329069261870317
Energy: 1.3800648223356111
Energy: 1.3398137009622055
Energy: 1.4690323776815515
Energy: 1.3398137009622055
Energy: 1.3800648223362952
Energy: 1.3398137009628899
Energy: 1.4236816635120892
Energy: 1.3617386581065976
Energy: 1.3779262289579517
Energy: 1.361738657095022
Energy: 1.4236816634484846
Energy: 1.3617386481790754
Energy: 1.3914222609814475
Energy: 1.3649829049765185
Energy: 1.3593705276436148
Energy: 1.364982904980624
Energy: 1.3914223309317428
Energy: 1.3649829049765185
Energy: 1.372675279678211
Energy: 1.3398830392394094
Energy: 1.4763732434746573
Energy: 1.3398830392394094
Energy: 1.3726752796754738
Energy: 1.3398830392394094
Energy: 1.5777900663453959
Energy: 1.3327252883665912
Energy: 1.470772229007828
Energy: 1.3327252883665912
Energy: 1.5777900663460802
Energy: 1.3327252883665912
Energy: 1.3342256670445558
Energy: 1.3447763266683603
Energy: 1.4840038417861328
Energy: 1.3447763266683603
Energy: 1.3342256670445558
Energy: 1.3447763266669919
Energy: 1.371436950711004
Energy: 1.334389166504345
Energy: 1.486626467565337
Energy: 1.3343891665050294
Energy: 1.3714369507096358
Energy: 1.3343891665063978
Energy: 1.4676467347526094
Energy: 1.3619548658375242
Energy: 1.3205466423827397
Energy: 1.3619548658375242
Energy: 1.4676467347526094
Energy: 1.3619548658375242
Energy: 1.382210615774662
Energy: 1.3174456612208623
Energy: 1.5300753891964656
Energy: 1.3174456612208623
Energy: 1.382210615773978
Energy: 1.3174456612208623
Energy: 1.2942356533558674
Energy: 1.3456514196805767
Energy: 1.6003016210917913
Energy: 1.345651419681261
Energy: 1.2942356533565516
Energy: 1.3456514196819451
Energy: 1.5081574010626033
Energy: 1.3325946923188587
Energy: 1.4891408128862673
Energy: 1.3325946923181744
Energy: 1.5081574010626033
Energy: 1.3325946923181744
Energy: 1.5047860930921801
Energy: 1.343970398762707
Energy: 1.3475770185735347
Energy: 1.343970398762707
Energy: 1.5047860930928647
Energy: 1.343970398762707
Energy: 1.4766195994014581
Energy: 1.3439804835078735
Energy: 1.3617369946640439
Energy: 1.3439804835065046
Energy: 1.4766195994028264
Energy: 1.3439804835078735
Energy: 1.4752068220533496
Energy: 1.3419356856441251
Energy: 1.4720021750179841
Energy: 1.3419356856448093
Energy: 1.475206822054718
Energy: 1.3419356856448093
Energy: 1.3967684760973538
Energy: 1.3682581191704966
Energy: 1.3854552218854426
Energy: 1.3682581191698122
Energy: 1.3967684760973538
Energy: 1.3682581191698122
Energy: 1.565457507564975
Energy: 1.3284519137480446
Energy: 1.3813589784093796
Energy: 1.3284519137473605
Energy: 1.565457507564975
Energy: 1.3284519137480446
Energy: 1.4715432978908352
Energy: 1.3466877279246467
Energy: 1.3660644161004345
Energy: 1.3466877279246467
Energy: 1.4715432978901506
Energy: 1.3466877279246467

minimum gb energy = 1.2811461806093345 eV
minimum distance =  2.25766463279178 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.5758556932119794
Energy: 1.386176301882522
Energy: 1.428094794174523
Energy: 1.386176301882522
Energy: 1.5758556932119794
Energy: 1.386176301882522
Energy: 1.4178688522790124
Energy: 1.6156766149898714
Energy: 1.7365493684859057
Energy: 1.6156766149898714
Energy: 1.417868852277427
Energy: 1.6156766149898714
Energy: 1.290418104655767
Energy: 1.386130273436369
Energy: 1.4611903084699287
Energy: 1.386130273436369
Energy: 1.290418104655767
Energy: 1.386130273436369
Energy: 1.3699619503415386
Energy: 1.3334881448501912
Energy: 1.7351544827469365
Energy: 1.3334881448501912
Energy: 1.3699619503415386
Energy: 1.3334881448501912
Energy: 1.3167070006082011
Energy: 1.3570775656534453
Energy: 1.4473843933679755
Energy: 1.3570775656534453
Energy: 1.3167070006066155
Energy: 1.3570775656534453
Energy: 1.5899745660660738
Energy: 1.3334554413062059
Energy: 1.6553353445194188
Energy: 1.3334554413062059
Energy: 1.5899745660676592
Energy: 1.3334554413062059
Energy: 1.6026633096098262
Energy: 1.335987884289551
Energy: 1.5228964905298306
Energy: 1.3359878842911364
Energy: 1.6026633096098262
Energy: 1.335987884289551
Energy: 1.3251269568183628
Energy: 1.3366988831938926
Energy: 1.299981333689373
Energy: 1.3366988831954778
Energy: 1.3251269568167774
Energy: 1.3366988831938926
Energy: 1.7801445573180605
Energy: 1.3588516299159685
Energy: 1.330577630366506
Energy: 1.3588516299159685
Energy: 1.7801445573180605
Energy: 1.3588516299143834
Energy: 1.3200178261231164
Energy: 1.3860621674689975
Energy: 1.289376962752516
Energy: 1.3860621674705829
Energy: 1.3200178261231164
Energy: 1.3860621674705829
Energy: 1.777876070896395
Energy: 1.3350107855689368
Energy: 1.7399390613133616
Energy: 1.3350107855705222
Energy: 1.777876070896395
Energy: 1.3350107855705222
Energy: 1.5757425785774712
Energy: 1.3864191862448338
Energy: 1.7241503920614734
Energy: 1.3864191862464192
Energy: 1.5757425785790566
Energy: 1.3864191862464192
Energy: 1.5076628099245437
Energy: 1.3346257048471546
Energy: 1.6928991412287884
Energy: 1.3346257048471546
Energy: 1.5076628099261289
Energy: 1.3346257048471546
Energy: 1.2902872806705639
Energy: 1.386606701183525
Energy: 1.6361799577516325
Energy: 1.386606701183525
Energy: 1.2902872806705639
Energy: 1.386606701183525
Energy: 1.3134054941320608
Energy: 1.383402391256693
Energy: 1.6519593285753376
Energy: 1.383402391041186
Energy: 1.3134054941320608
Energy: 1.383402391112493
Energy: 1.3303311136972475
Energy: 1.3369669534340833
Energy: 1.6254880105876879
Energy: 1.3369669534340833
Energy: 1.3303311136972475
Energy: 1.3369669534340833
Energy: 1.590246511197282
Energy: 1.3849282161474716
Energy: 1.7102810462381428
Energy: 1.384928216149057
Energy: 1.590246511197282
Energy: 1.3849282161474716
Energy: 1.660242517342151
Energy: 1.3360806698909327
Energy: 1.6882559230475582
Energy: 1.3360806698893473
Energy: 1.6602425173437363
Energy: 1.3360806698893473

minimum gb energy = 1.289376962752516 eV
minimum distance =  2.25158249141699 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.7183301819669752
Energy: 1.4384508958340676
Energy: 1.3736802664185448
Energy: 1.4384508958340676
Energy: 1.7183301819669752
Energy: 1.4384508958340676
Energy: 1.3378975553929469
Energy: 1.5440706464859684
Energy: 1.4804927835105375
Energy: 1.5440706464850282
Energy: 1.3378975553938872
Energy: 1.5440706464859684
Energy: 1.3128755352375323
Energy: 1.4452448654934007
Energy: 1.5072562499930102
Energy: 1.4452448654934007
Energy: 1.3128755352375323
Energy: 1.4452448654934007
Energy: 1.4139721914810341
Energy: 1.4065096121293528
Energy: 1.64394930424423
Energy: 1.4065096121293528
Energy: 1.4139721914810341
Energy: 1.4065096121293528
Energy: 1.380249100663632
Energy: 1.4374922437588504
Energy: 1.6557433354507334
Energy: 1.4374922437597912
Energy: 1.380249100663632
Energy: 1.4374922437597912
Energy: 1.5923259829071539
Energy: 1.4598923963679862
Energy: 1.384887345491932
Energy: 1.4598923963679862
Energy: 1.5923259829080942
Energy: 1.4598923963679862
Energy: 1.5930392132953455
Energy: 1.406619986014923
Energy: 1.4316467047603285
Energy: 1.406619986014923
Energy: 1.5930392132944051
Energy: 1.406619986014923
Energy: 1.5115508722699584
Energy: 1.4466630479161822
Energy: 1.3128337273137434
Energy: 1.4466630479152418
Energy: 1.5115508722699584
Energy: 1.4466630479171225
Energy: 1.5018759356476359
Energy: 1.5482941388583207
Energy: 1.3417678566494042
Energy: 1.5482941388583207
Energy: 1.5018759356532783
Energy: 1.5482941388583207
Energy: 1.3736802664194852
Energy: 1.4384508958340676
Energy: 1.7183301819669752
Energy: 1.4384508958340676
Energy: 1.3736802664185448
Energy: 1.4384508958340676
Energy: 1.4804927846056524
Energy: 1.5440706464850282
Energy: 1.3378975553920063
Energy: 1.5440706464850282
Energy: 1.4804927845097726
Energy: 1.5440706464850282
Energy: 1.5072562499930102
Energy: 1.4452448654934007
Energy: 1.3128755352375323
Energy: 1.4452448654934007
Energy: 1.507256249993951
Energy: 1.4452448654934007
Energy: 1.6439493042432893
Energy: 1.4065096121284124
Energy: 1.3529608563639404
Energy: 1.4065096121284124
Energy: 1.64394930424423
Energy: 1.4065096121284124
Energy: 1.712226041552535
Energy: 1.4374922437597912
Energy: 1.380249100664572
Energy: 1.4374922437597912
Energy: 1.712226041552535
Energy: 1.4374922437597912
Energy: 1.384887345491932
Energy: 1.4598923963679862
Energy: 1.5923259829090344
Energy: 1.4598923963679862
Energy: 1.384887345491932
Energy: 1.4598923963679862
Energy: 1.4316467047603285
Energy: 1.406619986014923
Energy: 1.5930392133235365
Energy: 1.406619986014923
Energy: 1.4316467047603285
Energy: 1.406619986014923
Energy: 1.3128337273137434
Energy: 1.4466630479161822
Energy: 1.5115508722699584
Energy: 1.4466630479161822
Energy: 1.3128337273137434
Energy: 1.4466630479152418
Energy: 1.3417678566484854
Energy: 1.5482941388583207
Energy: 1.5018759356598397
Energy: 1.5482941388583207
Energy: 1.3417678566484854
Energy: 1.548294138859261
Energy: 1.7183301819669752
Energy: 1.4384508958340676
Energy: 1.411456639833925
Energy: 1.4384508958340676
Energy: 1.7183301819669752
Energy: 1.4384508958340676
Energy: 1.3378975553920063
Energy: 1.5440706464850282
Energy: 1.48049278460001
Energy: 1.5440706464840879
Energy: 1.3378975553920063
Energy: 1.5440706464850282
Energy: 1.3128755352375323
Energy: 1.4452448654934007
Energy: 1.5072562499930102
Energy: 1.4452448654934007
Energy: 1.3128755352375323
Energy: 1.4452448654934007
Energy: 1.352960856364881
Energy: 1.4065096121284124
Energy: 1.6439493042432893
Energy: 1.4065096121284124
Energy: 1.3529608563639404
Energy: 1.4065096121284124
Energy: 1.380249100664572
Energy: 1.4374922437597912
Energy: 1.712226041552535
Energy: 1.4374922437597912
Energy: 1.380249100664572
Energy: 1.4374922437597912
Energy: 1.592325982909975
Energy: 1.4598923963679862
Energy: 1.384887345491932
Energy: 1.4598923963679862
Energy: 1.592325982909975
Energy: 1.4598923963679862
Energy: 1.5930392133094304
Energy: 1.406619986014923
Energy: 1.4316467047603285
Energy: 1.406619986014923
Energy: 1.5930392133113114
Energy: 1.406619986014923
Energy: 1.5115508722699584
Energy: 1.4466630479161822
Energy: 1.3128337273137434
Energy: 1.4466630479161822
Energy: 1.511550872269018
Energy: 1.4466630479161822
Energy: 1.5018759356354106
Energy: 1.5482941388583207
Energy: 1.3417678566484854
Energy: 1.5482941388583207
Energy: 1.50187593563447
Energy: 1.548294138859261
Energy: 1.4613036698409336
Energy: 1.4384508958340676
Energy: 1.7183301819669752
Energy: 1.4384508958340676
Energy: 1.4613036698409336
Energy: 1.4384508958340676
Energy: 1.4804927857045074
Energy: 1.5440706464840879
Energy: 1.3378975553920063
Energy: 1.5440706464850282
Energy: 1.480492785676295
Energy: 1.5440706464850282
Energy: 1.5072562499930102
Energy: 1.4452448654934007
Energy: 1.3128755352375323
Energy: 1.4452448654934007
Energy: 1.5072562499930102
Energy: 1.4452448654934007

minimum gb energy = 1.3128337273137434 eV
minimum distance =  2.23840133882618 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.2078437841375609
Energy: 1.3543226920024942
Energy: 1.2869742067530745
Energy: 1.3543226920027298
Energy: 1.2078437841373253
Energy: 1.3543226920029654
Energy: 1.2000186194663711
Energy: 1.360701556965866
Energy: 1.31226594325413
Energy: 1.3607015569672531
Energy: 1.200018619465926
Energy: 1.360701556964714
Energy: 1.2319823898594437
Energy: 1.509630646767319
Energy: 1.2873496752466296
Energy: 1.5096306467629477
Energy: 1.2319823898594437
Energy: 1.5096306467330276
Energy: 1.204851792280478
Energy: 1.352569812750405
Energy: 1.2956106168683548
Energy: 1.3525698127501695
Energy: 1.2048517922814201
Energy: 1.3525698127501695
Energy: 1.2871861319954003
Energy: 1.35468740651831
Energy: 1.3201560064309645
Energy: 1.3546874065178653
Energy: 1.2871861319954003
Energy: 1.3546874065180745
Energy: 1.2861880448029541
Energy: 1.4025338171907833
Energy: 1.3096857115128486
Energy: 1.402533816359336
Energy: 1.286188044803399
Energy: 1.402533817372213
Energy: 1.307357432255684
Energy: 1.4263803142363778
Energy: 1.2861229005373838
Energy: 1.426380314236849
Energy: 1.3073574322559196
Energy: 1.4263803142370848
Energy: 1.2046764455649048
Energy: 1.3484106207618036
Energy: 1.2982098164912632
Energy: 1.3484106207618036
Energy: 1.2046764455649048
Energy: 1.3484106207620128
Energy: 1.2870661525868747
Energy: 1.3539291315837492
Energy: 1.2725218284035078
Energy: 1.3539291315839848
Energy: 1.28706615258711
Energy: 1.3539291315837492
Energy: 1.28252853881322
Energy: 1.5917662614871821
Energy: 1.2764004639247517
Energy: 1.5917662614867112
Energy: 1.2825285388129843
Energy: 1.591766261487863
Energy: 1.2920064160150524
Energy: 1.3538951471060168
Energy: 1.3030791246611486
Energy: 1.3538951471060168
Energy: 1.2920064160143716
Energy: 1.3538951471062524
Energy: 1.3038683984398716
Energy: 1.3484510601000979
Energy: 1.2047064731247235
Energy: 1.3484510601003334
Energy: 1.3038683984412587
Energy: 1.3484510601005428

minimum gb energy = 1.200018619465926 eV
minimum distance =  2.25921647162751 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.7517766713237222
Energy: 1.6052867806209392
Energy: 1.4140883831743727
Energy: 1.605286780620292
Energy: 1.7517766713243694
Energy: 1.605286780620292
Energy: 1.4297768134318818
Energy: 1.5014169548714125
Energy: 1.3850229970165504
Energy: 1.5014169548720597
Energy: 1.4297768134318818
Energy: 1.5014169548733542
Energy: 1.3710710125045458
Energy: 1.5510644405882221
Energy: 1.4050214130311007
Energy: 1.551064440586928
Energy: 1.3710710125038985
Energy: 1.5510644405862806
Energy: 1.329159621888621
Energy: 1.4861398645638502
Energy: 1.3592531649114776
Energy: 1.4861398645638502
Energy: 1.3291596218892685
Energy: 1.4861398645638502
Energy: 1.30039186866627
Energy: 1.5190967636058346
Energy: 1.4072275718573954
Energy: 1.5190967636051873
Energy: 1.30039186866627
Energy: 1.5190967636051873
Energy: 1.2948364778903705
Energy: 1.4882957381874253
Energy: 1.3907580382709337
Energy: 1.4882957381861308
Energy: 1.2948364778903705
Energy: 1.4882957381854836
Energy: 1.5092615973092351
Energy: 1.5008433951080047
Energy: 1.3879087995354717
Energy: 1.5008433951067104
Energy: 1.5092615973092351
Energy: 1.5008433951073574
Energy: 1.5417769301590067
Energy: 1.486710167038218
Energy: 1.4521413576143762
Energy: 1.486710167038218
Energy: 1.5417769301596538
Energy: 1.486710167038218
Energy: 1.4393928215373837
Energy: 1.5463711141217211
Energy: 1.3958818746928785
Energy: 1.546371114121074
Energy: 1.439392821538031
Energy: 1.5463711141217211
Energy: 1.5442041688104
Energy: 1.531177914132434
Energy: 1.3629033699503907
Energy: 1.5311779141298452
Energy: 1.544204168811047
Energy: 1.5311779141304924
Energy: 1.4395342782525455
Energy: 1.5137591888829245
Energy: 1.3994881686321166
Energy: 1.5137591888829245
Energy: 1.4395342782525455
Energy: 1.5137591888822772
Energy: 1.3738546407241305
Energy: 1.5243133451205642
Energy: 1.359368267573424
Energy: 1.5243133451205642
Energy: 1.3738546407241305
Energy: 1.5243133451205642
Energy: 1.3070356710182547
Energy: 1.436790151284806
Energy: 1.2796487162038106
Energy: 1.436790151284806
Energy: 1.3070356710182547
Energy: 1.4367901512854533
Energy: 1.5257735597389155
Energy: 1.5693836827809666
Energy: 1.4060817675147457
Energy: 1.5693836827809666
Energy: 1.5257735597563908
Energy: 1.5693836827803491
Energy: 1.373634278497653
Energy: 1.4974902301929938
Energy: 1.3803502594428665
Energy: 1.4974902301949355
Energy: 1.3736342784983002
Energy: 1.4974902301916992
Energy: 1.3825070647220763
Energy: 1.464939430628315
Energy: 1.3587747802708727
Energy: 1.4649394306289625
Energy: 1.3825070647220763
Energy: 1.4649394306289625
Energy: 1.5175619553434052
Energy: 1.5270421479905727
Energy: 1.3785821659775546
Energy: 1.5270421479899254
Energy: 1.517561955342758
Energy: 1.5270421479905727
Energy: 1.3419335827692758
Energy: 1.438417247834714
Energy: 1.378353456372306
Energy: 1.4384172478178858
Energy: 1.3419335827686285
Energy: 1.4384172478353612
Energy: 1.5118961217364302
Energy: 1.5586693709385755
Energy: 1.2981746214181014
Energy: 1.55866937093987
Energy: 1.5118961217364302
Energy: 1.5586693709385755
Energy: 1.330213761443255
Energy: 1.5194722615348375
Energy: 1.33264119435783
Energy: 1.5194722615354848
Energy: 1.3302137614439022
Energy: 1.5194722615354848
Energy: 1.2965456165749643
Energy: 1.5592550033534174
Energy: 1.5127062511676472
Energy: 1.5592550033540646
Energy: 1.29654561657367
Energy: 1.5592550033540646
Energy: 1.3768471508545486
Energy: 1.4332618464308993
Energy: 1.3449187151989335
Energy: 1.433261846429605
Energy: 1.3768471508545486
Energy: 1.4332618464250741
Energy: 1.3731642699837898
Energy: 1.5105784022925697
Energy: 1.5211842434192888
Energy: 1.5105784022919226
Energy: 1.3731642699837898
Energy: 1.5105784022925697
Energy: 1.358600722999815
Energy: 1.4650091039165178
Energy: 1.387473436474192
Energy: 1.4650091039165178
Energy: 1.358600723000462
Energy: 1.4650091039165178
Energy: 1.3949485792233356
Energy: 1.5154777361064655
Energy: 1.3909955877832891
Energy: 1.5154777361064655
Energy: 1.3949485792233356
Energy: 1.5154777361064655
Energy: 1.4179806080893123
Energy: 1.5514225487474953
Energy: 1.5432189533736786
Energy: 1.551422548745554
Energy: 1.4179806080880177
Energy: 1.5514225487468483
Energy: 1.35298144249276
Energy: 1.4360898056987672
Energy: 1.3356894870755494
Energy: 1.4360898056981197
Energy: 1.3529814424649584
Energy: 1.4360898056994145
Energy: 1.3626757811430337
Energy: 1.4866713057072578
Energy: 1.3733103265269178
Energy: 1.486671305705963
Energy: 1.3626757811423864
Energy: 1.486671305705963
Energy: 1.3964657458420857
Energy: 1.5128906111424116
Energy: 1.5276303742858268
Energy: 1.5128906111424116
Energy: 1.3964657458420857
Energy: 1.5128906111417644
Energy: 1.3647937898600147
Energy: 1.5263432997513664
Energy: 1.5549654463858131
Energy: 1.526343299750719
Energy: 1.364793789860662
Energy: 1.5263432997513664
Energy: 1.4084677391845928
Energy: 1.5463711141204266
Energy: 1.440940628579373
Energy: 1.546371114121074
Energy: 1.4084677391845928
Energy: 1.546371114121074
Energy: 1.4546021738703747
Energy: 1.4865535484948968
Energy: 1.541757265340067
Energy: 1.4865535484948968
Energy: 1.4546021738697272
Energy: 1.4865535484948968
Energy: 1.3916745584194552
Energy: 1.5042891755390622
Energy: 1.5131753421534841
Energy: 1.5042891755390622
Energy: 1.391674558418808
Energy: 1.5042891755390622
Energy: 1.3819176661999124
Energy: 1.467636386701936
Energy: 1.286895047267679
Energy: 1.4676363866999942
Energy: 1.3819176661973234
Energy: 1.467636386699347
Energy: 1.3765826709023326
Energy: 1.4845783230164584
Energy: 1.3001803578309485
Energy: 1.4845783230164584
Energy: 1.3765826708770903
Energy: 1.4845783230184
Energy: 1.3477229472872096
Energy: 1.5180579200974482
Energy: 1.3234508003481547
Energy: 1.5180579200974482
Energy: 1.347722947291093
Energy: 1.5180579200980955
Energy: 1.406968072006094
Energy: 1.5509290928111623
Energy: 1.3711639344129796
Energy: 1.5509290928111623
Energy: 1.406968072006094
Energy: 1.5509290928111623
Energy: 1.3876515677574388
Energy: 1.4610200494608179
Energy: 1.4393651964017466
Energy: 1.4610200494601708
Energy: 1.3876515677574388
Energy: 1.4610200494601708
Energy: 1.4384837133362707
Energy: 1.605286780620292
Energy: 1.7517766713237222
Energy: 1.605286780620292
Energy: 1.438483713340154
Energy: 1.605286780619645
Energy: 1.385022997017845
Energy: 1.469136239615243
Energy: 1.429776813430587
Energy: 1.469136239615243
Energy: 1.385022997017845
Energy: 1.469136239615243
Energy: 1.405021413031748
Energy: 1.5510644405888694
Energy: 1.3710710125038985
Energy: 1.5510644405875753
Energy: 1.4050214130311007
Energy: 1.5510644405875753
Energy: 1.3592526807600904
Energy: 1.4861398645638502
Energy: 1.3291596218879738
Energy: 1.4861398645644974
Energy: 1.359252680708311
Energy: 1.4861398645644974
Energy: 1.4072275718664566
Energy: 1.5190967636045403
Energy: 1.3003918686656228
Energy: 1.5190967636058346
Energy: 1.4072275718664566
Energy: 1.5190967636058346

minimum gb energy = 1.2796487162038106 eV
minimum distance =  2.23852984668604 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 1.4789290656678535
Energy: 1.4368796954498517
Energy: 1.4064533185631423
Energy: 1.4368796954498517
Energy: 1.4789290656678535
Energy: 1.4368796954498517
Energy: 1.1483166546696497
Energy: 1.4393989503890254
Energy: 1.2507966215445963
Energy: 1.4393989503890254
Energy: 1.1483166546696497
Energy: 1.4393989503890254
Energy: 1.146338817153088
Energy: 1.399435299707392
Energy: 1.27207759788295
Energy: 1.399435299707392
Energy: 1.146338817153088
Energy: 1.399435299707392
Energy: 1.175594482174762
Energy: 1.4026056585818851
Energy: 1.2818796040544838
Energy: 1.4026056585818851
Energy: 1.175594482174762
Energy: 1.4026056585818851
Energy: 1.1762096606389114
Energy: 1.4376080889953953
Energy: 1.2306570500436338
Energy: 1.4376080889953953
Energy: 1.1762096606389114
Energy: 1.4376080889953953
Energy: 1.1761027558296702
Energy: 1.3993746832208462
Energy: 1.2246163556628862
Energy: 1.3993746832208462
Energy: 1.1761027558281967
Energy: 1.3993746832208462
Energy: 1.233482490685531
Energy: 1.399547684658533
Energy: 1.220433143806732
Energy: 1.399547684658533
Energy: 1.2334824906899513
Energy: 1.399547684658533
Energy: 1.1760360739934326
Energy: 1.4373080416799395
Energy: 1.2841616861240344
Energy: 1.4373080416799395
Energy: 1.1760360739934326
Energy: 1.4373080416799395
Energy: 1.1755821648142406
Energy: 1.3953290562057437
Energy: 1.2536563896500843
Energy: 1.3953290562057437
Energy: 1.175582164815714
Energy: 1.3953290562042704
Energy: 1.1625967771882642
Energy: 1.3995344256581517
Energy: 1.2687922111556134
Energy: 1.3995344256581517
Energy: 1.1625967771882642
Energy: 1.3995344256581517
Energy: 1.176529793056314
Energy: 1.4393989503890254
Energy: 1.29847911684825
Energy: 1.4393989503890254
Energy: 1.1765297924348286
Energy: 1.4393989503890254
Energy: 1.4789290656678535
Energy: 1.4368796954498517
Energy: 1.3130227226810711
Energy: 1.4368796954498517
Energy: 1.4789290656678535
Energy: 1.4368796954498517
Energy: 1.1483166546416899
Energy: 1.4393989503890254
Energy: 1.25079662154165
Energy: 1.4393989503890254
Energy: 1.148316654638743
Energy: 1.4393989503890254
Energy: 1.146338817153088
Energy: 1.399435299707392
Energy: 1.27207759788295
Energy: 1.399435299707392
Energy: 1.146338817153088
Energy: 1.399435299707392
Energy: 1.175594482174762
Energy: 1.4026056585818851
Energy: 1.2487800289738324
Energy: 1.4026056585818851
Energy: 1.175594482174762
Energy: 1.4026056585818851
Energy: 1.1762096606389114
Energy: 1.4376080889953953
Energy: 1.2306570501246346
Energy: 1.4376080889953953
Energy: 1.1762096606389114
Energy: 1.4376080889953953
Energy: 1.17610275582525
Energy: 1.3993746832208462
Energy: 1.2246163554567178
Energy: 1.3993746832208462
Energy: 1.17610275582525
Energy: 1.3993746832208462
Energy: 1.2334824907709518
Energy: 1.399547684658533
Energy: 1.220433143806732
Energy: 1.399547684658533
Energy: 1.2334824907665318
Energy: 1.399547684658533
Energy: 1.1760360739934326
Energy: 1.437308041681413
Energy: 1.2576351291624417
Energy: 1.4373080416799395
Energy: 1.1760360739934326
Energy: 1.437308041681413

minimum gb energy = 1.146338817153088 eV
minimum distance =  2.22893786941151 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.2719639015549637
Energy: 1.3858160026432895
Energy: 1.2484230122666136
Energy: 1.3858160026432895
Energy: 1.2719639015549637
Energy: 1.3858160026432895
Energy: 1.4635825578224713
Energy: 1.320411315602958
Energy: 1.1174178108114832
Energy: 1.320411315602958
Energy: 1.4635825578224713
Energy: 1.3204113156040374
Energy: 1.2541840624500467
Energy: 1.2994982729306153
Energy: 1.1629882638520648
Energy: 1.2994982729306153
Energy: 1.2541840624500467
Energy: 1.2994982729306153
Energy: 1.2915253341959114
Energy: 1.311219114305562
Energy: 1.0930681541014078
Energy: 1.3112191143066414
Energy: 1.29152533419807
Energy: 1.3112191143034035
Energy: 1.081547644723116
Energy: 1.4009183840277808
Energy: 1.1438081641815159
Energy: 1.4009183840267017
Energy: 1.0815476447241952
Energy: 1.4009183840267017
Energy: 1.0901333740086603
Energy: 1.362263901681508
Energy: 1.0923454862904378
Energy: 1.362263901682587
Energy: 1.0901333740086603
Energy: 1.362263901681508
Energy: 1.086726369150203
Energy: 1.2995654824194507
Energy: 1.1107402376005167
Energy: 1.2995654824194507
Energy: 1.086726369150203
Energy: 1.2995654824183718
Energy: 1.495312255187165
Energy: 1.413764409473807
Energy: 1.0985364189893738
Energy: 1.413764409473807
Energy: 1.495312255187165
Energy: 1.4137644094727277
Energy: 1.4964811404241516
Energy: 1.432331264639393
Energy: 1.4221231041603075
Energy: 1.4323312646404722
Energy: 1.4964811404241516
Energy: 1.4323312646404722
Energy: 1.0904511813298903
Energy: 1.299152419603467
Energy: 1.1215036935744147
Energy: 1.299152419603467
Energy: 1.0904511813298903
Energy: 1.2991524196045463
Energy: 1.0867168525783413
Energy: 1.3992708654371038
Energy: 1.0888041212908754
Energy: 1.3992708654371038
Energy: 1.0867168525794202
Energy: 1.3992708654371038
Energy: 1.0820315552774524
Energy: 1.3906567260428104
Energy: 1.0962770251661864
Energy: 1.3906567260438896
Energy: 1.0820315552774524
Energy: 1.3906567260438896
Energy: 1.4941270572710965
Energy: 1.3020659097180565
Energy: 1.2124058607606993
Energy: 1.3020659097180565
Energy: 1.4941270572700174
Energy: 1.3020659097180565
Energy: 1.2641687872071083
Energy: 1.2991770410410142
Energy: 1.118769386013222
Energy: 1.2991770410399353
Energy: 1.2641687872071083
Energy: 1.2991770410399353
Energy: 1.4668235124212226
Energy: 1.367223932584082
Energy: 1.1260081058579847
Energy: 1.367223932585161
Energy: 1.4668235124212226
Energy: 1.367223932584082
Energy: 1.260518609471746
Energy: 1.3923201864831665
Energy: 1.2611404210358257
Energy: 1.3923201864831665
Energy: 1.2605186094706666
Energy: 1.3923201864831665
Energy: 1.461453855878237
Energy: 1.3209708635277098
Energy: 1.1095983376741285
Energy: 1.3209708635277098
Energy: 1.461453855877158
Energy: 1.3209708635277098
Energy: 1.2692416198432928
Energy: 1.299230361186502
Energy: 1.1448873855180406
Energy: 1.2992303611854228
Energy: 1.2692416198432928
Energy: 1.299230361186502
Energy: 1.2651696078480656
Energy: 1.2948657942763573
Energy: 1.0884151257266754
Energy: 1.2948657942752784
Energy: 1.2651696078469863
Energy: 1.2948657942763573
Energy: 1.0806553474735892
Energy: 1.4023611629468293
Energy: 1.1025115017890252
Energy: 1.4023611629479085
Energy: 1.0806553474735892
Energy: 1.4023611629468293
Energy: 1.1643021899245627
Energy: 1.3599229747910824
Energy: 1.0832746055679698
Energy: 1.3599229747910824
Energy: 1.1643021899925068
Energy: 1.3599229747910824
Energy: 1.093081727609418
Energy: 1.3709443264749344
Energy: 1.0834802334881843
Energy: 1.3709443264749344
Energy: 1.0930817276083384
Energy: 1.3709443264749344
Energy: 1.4537494331298713
Energy: 1.3861858916496177
Energy: 1.1516375918863622
Energy: 1.3861858916485383
Energy: 1.453749433128792
Energy: 1.3861858916485383
Energy: 1.0756924185400831
Energy: 1.4153767944586653
Energy: 1.4608924528796838
Energy: 1.4153767944586653
Energy: 1.0756924185400831
Energy: 1.4153767944586653
Energy: 1.0980964556430435
Energy: 1.2997744118506351
Energy: 1.0847303934209689
Energy: 1.2997744118506351
Energy: 1.0980964556430435
Energy: 1.2997744118506351
Energy: 1.092217345723533
Energy: 1.3993549668863705
Energy: 1.0833751150419637
Energy: 1.3993549668863705
Energy: 1.092217345723533
Energy: 1.3993549668863705

minimum gb energy = 1.0756924185400831 eV
minimum distance =  2.25478609336959 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.70108663107453
Energy: 1.3208377121079364
Energy: 1.131048467405634
Energy: 1.3208377121096377
Energy: 1.70108663107453
Energy: 1.320837712108787
Energy: 1.7478424562837462
Energy: 1.211627143563392
Energy: 1.0226370293356561
Energy: 1.2116271435642427
Energy: 1.7478424562845967
Energy: 1.2116271435642427
Energy: 1.1115275163251233
Energy: 1.265336419552279
Energy: 1.0815519439369985
Energy: 1.265336419552279
Energy: 1.1115275163242728
Energy: 1.265336419552279
Energy: 1.5072626578255637
Energy: 1.1902968290186389
Energy: 0.9892111124382732
Energy: 1.1902968290186389
Energy: 1.507262657826414
Energy: 1.1902968290194893
Energy: 1.1125513548954988
Energy: 1.1767058507408343
Energy: 1.0772254593280106
Energy: 1.1767058507408343
Energy: 1.1125513548946484
Energy: 1.1767058507408343
Energy: 1.3253513881307177
Energy: 1.2528640990861348
Energy: 0.982513490936418
Energy: 1.2528640990861348
Energy: 1.3253513881307177
Energy: 1.2528640990861348
Energy: 0.985715333106851
Energy: 1.2869182847182339
Energy: 0.9890659927005317
Energy: 1.2869182847182339
Energy: 0.985715333106851
Energy: 1.2869182847182339
Energy: 1.3046174272318367
Energy: 1.3153979287537583
Energy: 1.033065630224894
Energy: 1.315397928754609
Energy: 1.3046174272318367
Energy: 1.3153979287537583
Energy: 1.0105899545388486
Energy: 1.176731032930273
Energy: 1.1477971734007288
Energy: 1.1767310329328247
Energy: 1.0105899545379982
Energy: 1.1767310329268703
Energy: 1.3383999664957669
Energy: 1.2923782505357244
Energy: 1.4257014202305218
Energy: 1.2923782505357244
Energy: 1.3383999664957669
Energy: 1.2923782505357244
Energy: 1.3388394828228005
Energy: 1.2867511299062329
Energy: 1.3888953552919605
Energy: 1.2867511299062329
Energy: 1.3388394828219496
Energy: 1.2867511299062329
Energy: 1.0195727610006589
Energy: 1.3177132749261253
Energy: 0.9923714930653554
Energy: 1.3177132749261253
Energy: 1.0195727610006589
Energy: 1.3177132749278269
Energy: 1.0151210323322146
Energy: 1.284124270919227
Energy: 1.184537726634346
Energy: 1.284124270919227
Energy: 1.0151210323330655
Energy: 1.284124270919227
Energy: 0.9908173030924127
Energy: 1.2903788504345082
Energy: 1.0197508001694358
Energy: 1.2903788504345082
Energy: 0.9908173030932631
Energy: 1.2903788504345082
Energy: 1.3307991031245252
Energy: 1.2653349340287507
Energy: 0.985019583701136
Energy: 1.2653349340287507
Energy: 1.3307991031245252
Energy: 1.2653349340287507
Energy: 1.034374336843112
Energy: 1.332869274134422
Energy: 0.9867637387370805
Energy: 1.3328692741352723
Energy: 1.0343743368405987
Energy: 1.3328692741361228
Energy: 1.3097436325558305
Energy: 1.2894118602609779
Energy: 1.0316083154932718
Energy: 1.2894118602609779
Energy: 1.309743632557532
Energy: 1.2894118602601272
Energy: 1.078226801286937
Energy: 1.2743110296505356
Energy: 1.0398326291835192
Energy: 1.2743110296505356
Energy: 1.0782268012877874
Energy: 1.2743110296513862
Energy: 1.7499360808494289
Energy: 1.2163342226248848
Energy: 0.996957597600017
Energy: 1.2163342226248848
Energy: 1.7499360809608238
Energy: 1.2163342226240343
Energy: 1.5028961748550005
Energy: 1.309096442149524
Energy: 1.1509179722881202
Energy: 1.3090964421512254
Energy: 1.5028961748541496
Energy: 1.3090964421503746
Energy: 1.7473761876806382
Energy: 1.2097777406190942
Energy: 1.0422714523654577
Energy: 1.2097777406190942
Energy: 1.7473761876806382
Energy: 1.2097777406190942
Energy: 1.064390414761623
Energy: 1.2736195562701773
Energy: 1.0741212554248085
Energy: 1.273619556271028
Energy: 1.064390414761623
Energy: 1.2736195562701773
Energy: 1.343519871202769
Energy: 1.1935276555559635
Energy: 0.9862796059765254
Energy: 1.1935276555559635
Energy: 1.3435198712002168
Energy: 1.1935276555559635
Energy: 1.0251563409104956
Energy: 1.2184413654484554
Energy: 1.0346005524902004
Energy: 1.2184413654484554
Energy: 1.0251563408909308
Energy: 1.2184413654484554
Energy: 1.166647687996212
Energy: 1.2503530706151276
Energy: 1.0373144844263695
Energy: 1.2503530706151276
Energy: 1.166647687996212
Energy: 1.2503530706142771
Energy: 0.9910224305815153
Energy: 1.2319010832426114
Energy: 0.988594728325182
Energy: 1.2319010832426114
Energy: 0.9910224305823659
Energy: 1.2319010832426114
Energy: 1.0971567686665529
Energy: 1.270948843734624
Energy: 1.0340066294853383
Energy: 1.270948843734624
Energy: 1.097232600790701
Energy: 1.270948843734624
Energy: 1.0182594245938756
Energy: 1.2261980684054588
Energy: 1.3414153215583444
Energy: 1.2261980684054588
Energy: 1.0182594245947263
Energy: 1.2261980684054588
Energy: 1.308086993701347
Energy: 1.276765346431451
Energy: 1.3168051182091918
Energy: 1.276765346431451
Energy: 1.3080869937004964
Energy: 1.276765346431451
Energy: 0.9908173231075531
Energy: 1.2637118938942289
Energy: 1.2994375351372214
Energy: 1.2637118938933785
Energy: 0.9908173231084036
Energy: 1.2637118938899758
Energy: 1.021824312141446
Energy: 1.2708416923776402
Energy: 1.0328398919685413
Energy: 1.2708416923776402
Energy: 1.021824312141446
Energy: 1.2708416923776402
Energy: 1.0159351646410466
Energy: 1.2936865568009466
Energy: 1.2962281269362457
Energy: 1.2936865568009466
Energy: 1.0159351646410466
Energy: 1.2936865568009466
Energy: 0.9854484849399318
Energy: 1.2742086119106435
Energy: 1.0494029426973113
Energy: 1.2742086119106435
Energy: 0.9854484849399318
Energy: 1.2742086119106435

minimum gb energy = 0.982513490936418 eV
minimum distance =  2.2496077095521 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.3756976067679516
Energy: 1.1723434915569886
Energy: 1.0090056463848371
Energy: 1.1723434915581825
Energy: 1.3756976067679516
Energy: 1.1723434915575854
Energy: 1.8782986894863871
Energy: 1.0566807847919815
Energy: 0.8979065580918097
Energy: 1.0566807847913844
Energy: 1.878298689485193
Energy: 1.0566807847913844
Energy: 1.3624726840635586
Energy: 1.1434338525224872
Energy: 0.964706750566092
Energy: 1.1434338525206966
Energy: 1.3624726840635586
Energy: 1.1434338525218903
Energy: 1.7505843787285087
Energy: 1.0262845715036335
Energy: 0.8795941906336558
Energy: 1.0262845715048274
Energy: 1.7505843787285087
Energy: 1.0262845715030364
Energy: 0.9594016502819838
Energy: 1.1323552212216315
Energy: 0.9493815474797913
Energy: 1.1323552212228256
Energy: 0.9594016502819838
Energy: 1.1323552212228256
Energy: 1.5484772429969538
Energy: 1.08862222357163
Energy: 0.8953031424931326
Energy: 1.0886222235728238
Energy: 1.5484772429969538
Energy: 1.0886222235734209
Energy: 0.9502240116620532
Energy: 1.0984175826979523
Energy: 0.8783637287356624
Energy: 1.0984175826991462
Energy: 0.9502240116620532
Energy: 1.0984175826967584
Energy: 1.248582993476999
Energy: 1.1129003074058097
Energy: 0.8902762284468958
Energy: 1.1129003074040187
Energy: 1.2485829934674473
Energy: 1.1129003074117796
Energy: 0.8726874195996724
Energy: 1.1334740648539596
Energy: 1.0085425217104036
Energy: 1.1334740648539596
Energy: 0.8726874195996724
Energy: 1.1334740648539596
Energy: 1.1130795994260256
Energy: 1.1217633606846364
Energy: 1.2156495453687597
Energy: 1.1217633606852333
Energy: 1.1130795994260256
Energy: 1.1217633606840391
Energy: 0.8727760786245486
Energy: 1.1050401511437153
Energy: 1.2426865806014895
Energy: 1.1050401511431185
Energy: 0.8727760786245486
Energy: 1.1050401511431185
Energy: 1.405609343292506
Energy: 1.1362440406751415
Energy: 1.1936956398220009
Energy: 1.1362440406763352
Energy: 1.405609343292506
Energy: 1.1362440406745444
Energy: 1.1044669208764697
Energy: 1.1328133965174547
Energy: 1.3025439940330243
Energy: 1.1328133965180516
Energy: 1.1044669208764697
Energy: 1.1328133965174547
Energy: 1.0968542064520792
Energy: 1.1458839773753398
Energy: 1.5107015361422391
Energy: 1.1458839773765337
Energy: 1.0968542064526763
Energy: 1.1458839773771308
Energy: 1.1167742229557556
Energy: 1.1053543871362757
Energy: 1.4066832774450324
Energy: 1.1053543871356786
Energy: 1.1167742229557556
Energy: 1.1053543871350815
Energy: 1.1085859114055137
Energy: 1.1303611163646314
Energy: 1.1529696943446677
Energy: 1.1303611163646314
Energy: 1.1085859114055137
Energy: 1.1303611163622438
Energy: 1.1084260388775449
Energy: 1.129359064217294
Energy: 1.279598377660479
Energy: 1.129359064217294
Energy: 1.1084260388775449
Energy: 1.129359064217294
Energy: 0.8778632959487281
Energy: 1.1427909275850365
Energy: 1.1015204399929086
Energy: 1.1427909275856336
Energy: 0.8778632959487281
Energy: 1.1427909275856336
Energy: 1.1178147491255617
Energy: 1.130271186311226
Energy: 1.154371468401815
Energy: 1.130271186311226
Energy: 1.1178147491255617
Energy: 1.130271186311226
Energy: 0.8772726973807455
Energy: 1.135931034753263
Energy: 0.8999055245439963
Energy: 1.1359310347586358
Energy: 0.8772726973825364
Energy: 1.135931034752069
Energy: 1.1068410511849578
Energy: 1.1167452209606004
Energy: 0.9901829997086309
Energy: 1.1167452209606004
Energy: 1.1068410511831668
Energy: 1.1167452209617945
Energy: 0.9163365120386993
Energy: 1.1437336937515556
Energy: 0.8953287208436772
Energy: 1.1437336937509588
Energy: 0.9163365120398933
Energy: 1.1437336937509588
Energy: 1.4139422728425775
Energy: 1.119557473740522
Energy: 0.8771059883029666
Energy: 1.1195574737399248
Energy: 1.4139422728413833
Energy: 1.119557473740522
Energy: 0.9579286447007769
Energy: 1.1358037829316652
Energy: 0.884621828211139
Energy: 1.1358037829316652
Energy: 0.9579286447001799
Energy: 1.1358037829322623
Energy: 1.542191238122549
Energy: 1.1340111753091482
Energy: 0.9854576523751578
Energy: 1.1340111753085511
Energy: 1.5421912381231462
Energy: 1.1340111753091482
Energy: 1.2297011577600891
Energy: 1.1314197998906521
Energy: 0.8999102271746439
Energy: 1.1314197998894584
Energy: 1.2297011577582984
Energy: 1.1314197998894584
Energy: 1.8807041298897291
Energy: 1.0841575596892703
Energy: 0.8748136461174092
Energy: 1.0841575596898674
Energy: 1.8807041298891325
Energy: 1.0841575596904642
Energy: 1.2488903884978144
Energy: 1.1390345251804253
Energy: 1.1039459756642256
Energy: 1.1390345251804253
Energy: 1.2488903888320184
Energy: 1.1390345251804253
Energy: 1.5762261711105314
Energy: 1.1007040111615285
Energy: 0.9954083071001091
Energy: 1.1007040111633193
Energy: 1.5762261711111283
Energy: 1.1007040111603346
Energy: 1.2278836204925552
Energy: 1.1491588333206009
Energy: 1.0998115860280377
Energy: 1.1491588333200036
Energy: 1.2278836204913612
Energy: 1.1491588333200036
Energy: 1.5732614587240277
Energy: 1.0364037517262785
Energy: 0.8779633397664027
Energy: 1.0364037517274722
Energy: 1.573261458724625
Energy: 1.0364037517268754
Energy: 0.9091159048221418
Energy: 1.1146128421188572
Energy: 1.0012321734960952
Energy: 1.1146128421188572
Energy: 0.9091159043776037
Energy: 1.1146128421188572
Energy: 1.254074614783095
Energy: 1.0960864917815476
Energy: 0.8768586302480618
Energy: 1.0960864917827413
Energy: 1.254074614783095
Energy: 1.0960864917827413
Energy: 0.9064187302567785
Energy: 1.0983665052058214
Energy: 1.276737203576985
Energy: 1.0983665052046274
Energy: 0.9064187302591664
Energy: 1.0983665052046274
Energy: 1.27597868978066
Energy: 1.0982106002455867
Energy: 0.9067953217161937
Energy: 1.0982106002455867
Energy: 1.27597868978066
Energy: 1.0982106002455867
Energy: 0.8767916592172739
Energy: 1.0962624962843992
Energy: 1.2577334179525639
Energy: 1.096262496284996
Energy: 0.8767916592172739
Energy: 1.096262496284996
Energy: 0.9973760480182768
Energy: 1.1146053567520462
Energy: 0.913275842463605
Energy: 1.1146053567508523
Energy: 0.9973760480152919
Energy: 1.1146053567508523
Energy: 0.8780890945738917
Energy: 1.03778314907821
Energy: 1.5839419963888706
Energy: 1.0377831490788068
Energy: 0.8780890945738917
Energy: 1.0377831490788068
Energy: 1.099811586029232
Energy: 1.1324971431158857
Energy: 1.225645357705997
Energy: 1.132497143116483
Energy: 1.0998115860304258
Energy: 1.1324971431158857
Energy: 1.1070797873882336
Energy: 1.1163823363383156
Energy: 1.5657640941849977
Energy: 1.1163823363389125
Energy: 1.1070797873870397
Energy: 1.1163823363395098
Energy: 1.1208838269532033
Energy: 1.138564563916075
Energy: 1.2563327987611301
Energy: 1.138564563916075
Energy: 1.1208838269543975
Energy: 1.1385645639166724
Energy: 0.87620249239533
Energy: 1.0751729311251261
Energy: 1.878109162702245
Energy: 1.0751729311245293
Energy: 0.876202492395927
Energy: 1.075172931130499
Energy: 0.9003343937912942
Energy: 1.1304383411861807
Energy: 1.242593189340363
Energy: 1.1304383411861807
Energy: 0.9003343937918912
Energy: 1.1304383411867776
Energy: 1.1058670434146771
Energy: 1.1339693236549837
Energy: 1.5540279376468038
Energy: 1.1339693236555808
Energy: 1.1058670434152738
Energy: 1.1339693236555808
Energy: 0.8770651401419652
Energy: 1.1356883032018013
Energy: 0.9165280395675081
Energy: 1.1356883032018013
Energy: 0.8770651401413682
Energy: 1.135688303200607
Energy: 0.8771359846255848
Energy: 1.119557473740522
Energy: 1.4327352611134991
Energy: 1.1195574737399248
Energy: 0.8771359846243907
Energy: 1.1195574737399248
Energy: 0.9039243544444935
Energy: 1.1437379407855988
Energy: 0.9088066844827276
Energy: 1.143737940785002
Energy: 0.9039243544450903
Energy: 1.1437379407855988

minimum gb energy = 0.8726874195996724 eV
minimum distance =  2.28359367358578 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.2574380340280965
Energy: 0.25782101858867124
Energy: 0.3491716784634523
Energy: 0.25782101858867124
Energy: 0.2574380340280965
Energy: 0.25782101858867124
Energy: 0.2683895644071286
Energy: 0.8083841037224493
Energy: 0.6369463026835596
Energy: 0.8083841037224493
Energy: 0.2683895644075366
Energy: 0.8083841037224493
Energy: 0.2574380340280965
Energy: 0.25782101858826323
Energy: 0.3491716784638603
Energy: 0.25782101858867124
Energy: 0.2574380340280965
Energy: 0.25782101858867124
Energy: 0.2683895644075366
Energy: 0.8083841037228574
Energy: 0.6369451700372638
Energy: 0.8083841037224493
Energy: 0.2683895644075366
Energy: 0.8083841037228574
Energy: 0.2574380340280965
Energy: 0.25782101858826323
Energy: 0.3491716784638603
Energy: 0.25782101858867124
Energy: 0.2574380340280965
Energy: 0.25782101858867124
Energy: 0.2683895644071286
Energy: 0.8083841037224493
Energy: 0.6369456262354486
Energy: 0.8083841037228574
Energy: 0.2683895644075366
Energy: 0.8083841037228574
Energy: 0.2574380340280965
Energy: 0.25782101858785517
Energy: 0.3491716784634523
Energy: 0.25782101858867124
Energy: 0.2574380340280965
Energy: 0.25782101858867124

minimum gb energy = 0.2574380340280965 eV
minimum distance =  2.43380178306059 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.5280338473086876
Energy: 1.1703791191857205
Energy: 1.0943609061676587
Energy: 1.1703791191846342
Energy: 1.5280338473076016
Energy: 1.1703791191846342
Energy: 1.8866960684703014
Energy: 0.862548753287779
Energy: 0.8598778443195527
Energy: 0.8625487532942944
Energy: 1.8866960684713872
Energy: 0.8625487532910366
Energy: 1.3735524775201253
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Energy: 1.4287899184013788
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Energy: 0.8621528274970615
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Energy: 1.4544570107325163
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Energy: 1.487522814348348
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Energy: 0.8588137473529985
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Energy: 1.4498527838188848
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Energy: 1.1550839003429756
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Energy: 0.9264368623754315
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Energy: 1.1401948544080824
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Energy: 1.125710480227409
Energy: 1.157275538696231
Energy: 1.125350219551206
Energy: 1.190774921349879
Energy: 1.1253502195501202
Energy: 1.157275538696231
Energy: 1.1253502195495773
Energy: 0.913906159630873
Energy: 1.0675667273420768
Energy: 1.4874763632364487
Energy: 1.0675667273409908
Energy: 0.9139061596314159
Energy: 1.0675667273409908
Energy: 0.9091529556138063
Energy: 1.140381085747578
Energy: 1.19164395648649
Energy: 1.1403810859814905
Energy: 0.9091529556148921
Energy: 1.1403810857193446
Energy: 0.8587876540370047
Energy: 1.0712168241943025
Energy: 1.3904444779576692
Energy: 1.0712168241932165
Energy: 0.8587876540359187
Energy: 1.0712168241937596
Energy: 0.9105794785999197
Energy: 1.1398051767793163
Energy: 1.4898669024070534
Energy: 1.1398051767782302
Energy: 0.9105794785999197
Energy: 1.1398051767782302
Energy: 0.8493247614930773
Energy: 1.01950085966597
Energy: 1.7191630419814192
Energy: 1.0195008595687824
Energy: 0.8493247614930773
Energy: 1.0195008591910866
Energy: 0.8584299231185928
Energy: 1.1535170786123914
Energy: 1.4014346390252512
Energy: 1.1535170786097262
Energy: 0.8584299231185928
Energy: 1.153517078610812
Energy: 0.8617846189963156
Energy: 0.918074939728718
Energy: 1.5212036273922591
Energy: 0.9180749397352335
Energy: 0.8617846189968588
Energy: 0.9180749397292611
Energy: 0.9197095625196989
Energy: 1.138121952741445
Energy: 1.4489001773181494
Energy: 1.1381219527409017
Energy: 0.9197095625202419
Energy: 1.1381219527425306
Energy: 0.8556914968611771
Energy: 0.9100908488062547
Energy: 1.5839864314819025
Energy: 0.9100908488051687
Energy: 0.8556914968606343
Energy: 0.9100908488062547
Energy: 0.9113418111560326
Energy: 1.1281208445996929
Energy: 1.1849607312355164
Energy: 1.128120844596978
Energy: 0.9113418111587474
Energy: 1.1281208445986068
Energy: 0.9442956224477057
Energy: 1.070811565091901
Energy: 1.3152466646729082
Energy: 1.070811565090272
Energy: 0.9442956224477057
Energy: 1.070811565089186
Energy: 1.1575926669055212
Energy: 1.1296413506888583
Energy: 1.1616568971573542
Energy: 1.129641350700803
Energy: 1.1575926665380922
Energy: 1.1296413506915732

minimum gb energy = 0.846107026655874 eV
minimum distance =  2.28361613446546 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.4928094893685968
Energy: 1.3085322627308156
Energy: 1.12221022367406
Energy: 1.3085322627315605
Energy: 1.492809489369342
Energy: 1.3085322627308156
Energy: 1.6540780950548484
Energy: 0.9762608026432419
Energy: 0.9890352892205407
Energy: 0.9762608026447323
Energy: 1.6540780957438457
Energy: 0.9762608026439871
Energy: 1.4055431723376504
Energy: 1.2822057531534135
Energy: 1.1076327250257878
Energy: 1.2822057531534135
Energy: 1.4055431723383953
Energy: 1.2822057531541589
Energy: 1.4773799459066494
Energy: 0.9423357039496619
Energy: 0.9549106018653375
Energy: 0.9423357039660561
Energy: 1.477379945901433
Energy: 0.9423357039414649
Energy: 1.0281430273171892
Energy: 1.2180882515272025
Energy: 0.9441818249989452
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Energy: 1.2180882515272025
Energy: 1.1043161539127755
Energy: 1.210570354366696
Energy: 0.970559005639987
Energy: 1.210570354366696
Energy: 1.1043161539120305
Energy: 1.2105703543681863
Energy: 0.9649824406762513
Energy: 1.2036633567257766
Energy: 1.102994730980583
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Energy: 0.9504858000522342
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Energy: 0.9542231876054974
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Energy: 1.2996933414082683
Energy: 0.9394750506504156
Energy: 1.288715293349918
Energy: 1.272964589816586
Energy: 1.288715293349918
Energy: 0.9394750506504156
Energy: 1.2887152933491728
Energy: 0.9448371668038649
Energy: 1.271939702856428
Energy: 1.2900228333292074
Energy: 1.271939702857173
Energy: 0.9448371668038649
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Energy: 0.9441571280411464
Energy: 1.2703525955348847
Energy: 1.2676220588464937
Energy: 1.2703525955348847
Energy: 0.9441571280411464
Energy: 1.2703525955348847
Energy: 0.9414540622410387
Energy: 1.2842908926002257
Energy: 1.020222048420944
Energy: 1.2842908925979901
Energy: 0.9414540622410387
Energy: 1.2842908925987353
Energy: 0.9397492861041281
Energy: 1.2161422857509467
Energy: 1.0904033286097812
Energy: 1.216142285751692
Energy: 0.9397492861041281
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Energy: 1.2793115259131225
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Energy: 0.9446127610342834
Energy: 1.2786556521441286
Energy: 1.2793115259138679
Energy: 1.2786556521448738
Energy: 1.3059100657554625
Energy: 1.278541206937082
Energy: 0.9520469512640721
Energy: 1.2785412069229234
Energy: 1.3059100657554625
Energy: 1.278541206944534
Energy: 1.2981592623203198
Energy: 1.2718395813840597
Energy: 1.1106255317527611
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Energy: 1.29815926232181
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Energy: 1.4734052870945022
Energy: 1.2653684844813997
Energy: 0.9460594182507828
Energy: 1.2653684844806545
Energy: 1.4734052870959924
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Energy: 1.7012623187876286
Energy: 1.2527341672272163
Energy: 0.9460100457069364
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Energy: 1.7012623187876286
Energy: 1.2527341672152934
Energy: 1.3022790172320877
Energy: 1.267399509854961
Energy: 1.3158544845412665
Energy: 1.2673995098534705
Energy: 1.3022790172320877
Energy: 1.2673995098542157
Energy: 1.3027133380949971
Energy: 1.2813047092331602
Energy: 0.9520041012877442
Energy: 1.2813047092301795
Energy: 1.3027133380942522
Energy: 1.2813047092339054
Energy: 1.2784962719654278
Energy: 1.2709143808737071
Energy: 0.9447391696961999
Energy: 1.2709143808737071
Energy: 1.278496271966173
Energy: 1.270914380872962
Energy: 1.2798165658403173
Energy: 1.2644077323160914
Energy: 0.9708648518547077
Energy: 1.2644077323160914
Energy: 1.279816565838827
Energy: 1.2644077323168366
Energy: 0.9413573044212545
Energy: 1.213692973955255
Energy: 1.2569456838397963
Energy: 1.2136929739574907
Energy: 0.9413573044212545
Energy: 1.2136929739545097
Energy: 0.9432434200341709
Energy: 1.2772864228964103
Energy: 1.0200720074819531
Energy: 1.27728642289492
Energy: 0.9432434200341709
Energy: 1.277286422895665
Energy: 0.9441484313418237
Energy: 1.2703525955341395
Energy: 1.2514111256398786
Energy: 1.2703525955341395
Energy: 0.9441484313418237
Energy: 1.2703525955341395
Energy: 0.9445775379669115
Energy: 1.2712458595882252
Energy: 1.300466405385683
Energy: 1.2712458595889702
Energy: 0.9445775379676565
Energy: 1.2712458595889702
Energy: 0.9393854674878265
Energy: 1.288251297040654
Energy: 1.45521476317016
Energy: 1.288251297040654
Energy: 0.9393854674878265
Energy: 1.288251297040654
Energy: 0.954425779297426
Energy: 1.2954081861622655
Energy: 1.3482074899992065
Energy: 1.29540818616152
Energy: 0.954425779297426
Energy: 1.29540818616152
Energy: 0.9441224631126977
Energy: 1.0776049065051114
Energy: 1.5176197372413138
Energy: 1.077604906450001
Energy: 0.9441224631126977
Energy: 1.0776049065125637
Energy: 0.986218191314213
Energy: 1.267924211171734
Energy: 1.2922353603111223
Energy: 1.2679242111724796
Energy: 0.986218191314213
Energy: 1.267924211171734
Energy: 0.9397643984805086
Energy: 1.0742824316459318
Energy: 1.485271404015633
Energy: 1.0742824316362445
Energy: 0.9397643984812538
Energy: 1.074282431642206
Energy: 0.9505627888068862
Energy: 1.2147544615414758
Energy: 1.0061471557040633
Energy: 1.2147544615414758
Energy: 0.950562788806141
Energy: 1.2147544615444565
Energy: 0.9649103713651842
Energy: 1.2255436103000101
Energy: 1.1036380210547487
Energy: 1.2255436103000101
Energy: 0.9649103713651842
Energy: 1.225543610299265

minimum gb energy = 0.9393854674878265 eV
minimum distance =  2.199615855489 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.5925488415878464
Energy: 1.4381331003102105
Energy: 1.1866155363243307
Energy: 1.4381331003111257
Energy: 1.5925488415878464
Energy: 1.4381331003111257
Energy: 1.4067917241513943
Energy: 1.057171556152346
Energy: 1.0540682686462324
Energy: 1.0571715561496
Energy: 1.4067917241513943
Energy: 1.0571715561514305
Energy: 1.1036966885861121
Energy: 1.336355907990799
Energy: 1.183517535904974
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Energy: 1.1036966885861121
Energy: 1.3363559079898837
Energy: 1.421884141387927
Energy: 1.0046124346435836
Energy: 1.0165036814769441
Energy: 1.0046124346426686
Energy: 1.4218841413915886
Energy: 1.004612434641753
Energy: 1.0280869887439068
Energy: 1.3452341524262763
Energy: 1.0071763951346262
Energy: 1.3452341524262763
Energy: 1.028086988744822
Energy: 1.3452341524262763
Energy: 1.0148564789354344
Energy: 1.3311631480987316
Energy: 1.0326986799211249
Energy: 1.3311631480987316
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Energy: 1.3311631480996469
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Energy: 1.2268828159340124
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Energy: 1.076823092695138
Energy: 1.321278080670928
Energy: 1.1090141978310941
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Energy: 1.321278080670928
Energy: 1.0092327188951302
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Energy: 1.4304917078583839
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Energy: 1.0092327188951302
Energy: 1.1782918569578065
Energy: 1.0181677862068608
Energy: 1.380053250157302
Energy: 1.4674061896746498
Energy: 1.3800532501582172
Energy: 1.0181677862068608
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Energy: 1.003766419038936
Energy: 1.3851213577694672
Energy: 1.2269078778545746
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Energy: 1.0037664190380207
Energy: 1.3851213577694672
Energy: 1.0072210233314287
Energy: 1.3204541172220439
Energy: 1.1089586219997407
Energy: 1.3204541172211288
Energy: 1.0072210233314287
Energy: 1.3204541172202133
Energy: 1.0076192988915187
Energy: 1.0040950972384777
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Energy: 1.0040950972384777
Energy: 1.0050235541706065
Energy: 1.3778440785391293
Energy: 1.0332558724504846
Energy: 1.3778440785391293
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Energy: 1.0040569540348478
Energy: 1.3502073195740374
Energy: 1.0072289572039999
Energy: 1.3502073195740374
Energy: 1.0040569540339326
Energy: 1.3502073195740374
Energy: 1.410209494620741
Energy: 1.1833973373595204
Energy: 1.0170705368598707
Energy: 1.1833973373595204
Energy: 1.4102094946198256
Energy: 1.1833973373576896
Energy: 1.4394410836724238
Energy: 1.3690396120886439
Energy: 1.2358845872073767
Energy: 1.3690396120886439
Energy: 1.4394410836724238
Energy: 1.3690396120886439
Energy: 1.5501683862269804
Energy: 1.365946098573613
Energy: 1.0058852428704184
Energy: 1.365946098573613
Energy: 1.5501683862269804
Energy: 1.365946098573613
Energy: 1.5403768522190904
Energy: 1.3687979395458796
Energy: 1.0101316270515082
Energy: 1.3687979395458796
Energy: 1.5403768522190904
Energy: 1.3687979395458796
Energy: 1.4446811386958378
Energy: 1.3698275172221308
Energy: 1.01588313425807
Energy: 1.3698275172221308
Energy: 1.4446811386949223
Energy: 1.3698275172221308
Energy: 1.4259665818946083
Energy: 1.418042929795334
Energy: 1.0190457264599544
Energy: 1.4180429297962496
Energy: 1.4259665818946083
Energy: 1.418042929795334
Energy: 1.004408313932319
Energy: 1.3692949169031683
Energy: 1.0045091192498965
Energy: 1.3692949169031683
Energy: 1.004408313932319
Energy: 1.3692949169031683
Energy: 1.0047847209193606
Energy: 1.3780055894162986
Energy: 1.0342336355287602
Energy: 1.3780055894162986
Energy: 1.004784720920276
Energy: 1.3780055894162986
Energy: 1.005008027778328
Energy: 1.3714219377150796
Energy: 1.0028114535979695
Energy: 1.3714219377150796
Energy: 1.005008027778328
Energy: 1.3714219377141643
Energy: 1.0064188859087009
Energy: 1.4173022622927378
Energy: 1.1092694844360862
Energy: 1.4173022622927378
Energy: 1.0064188859077854
Energy: 1.4173022622927378
Energy: 1.0053620497717206
Energy: 1.3725431419139515
Energy: 1.4259348496175834
Energy: 1.3725431419139515
Energy: 1.0053620497726357
Energy: 1.3725431419139515
Energy: 1.0162752146035172
Energy: 1.3834009428698468
Energy: 1.474651239559002
Energy: 1.3834009428698468
Energy: 1.0162752146035172
Energy: 1.3834009428698468
Energy: 1.0052809275964558
Energy: 1.3612222056309307
Energy: 1.2958973848212036
Energy: 1.3612222056300152
Energy: 1.0052809275964558
Energy: 1.3612222056309307
Energy: 1.0754581841671078
Energy: 1.3239210950905869
Energy: 1.1135206613397637
Energy: 1.3239210950896718
Energy: 1.0754581841671078
Energy: 1.3239210950896718
Energy: 1.004990955108445
Energy: 1.171549462651121
Energy: 1.2106523543983325
Energy: 1.1715494624342908
Energy: 1.004990955108445
Energy: 1.1715494626062901
Energy: 1.0062449259588078
Energy: 1.3319923102629836
Energy: 1.0291602335736314
Energy: 1.3319923102629836
Energy: 1.0062449259578923
Energy: 1.3319923102629836

minimum gb energy = 1.0028114535979695 eV
minimum distance =  2.23399112770257 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.2218397794886442
Energy: 1.5232197043880706
Energy: 1.30951233828841
Energy: 1.5232197043868856
Energy: 1.2218397794886442
Energy: 1.5232197043880706
Energy: 1.370739422223498
Energy: 1.1616128520250963
Energy: 1.1647042062337831
Energy: 1.1616128520262816
Energy: 1.370739422223498
Energy: 1.161612852027467
Energy: 1.106898481809317
Energy: 1.5017688575972996
Energy: 1.2895876724058764
Energy: 1.5017688575972996
Energy: 1.106898481809317
Energy: 1.5017688575972996
Energy: 1.0853417350111556
Energy: 1.0891043283143522
Energy: 1.167712570992775
Energy: 1.0891043283143522
Energy: 1.0853417350111556
Energy: 1.0891043283143522
Energy: 1.103604673432967
Energy: 1.1142404037082074
Energy: 1.0880859350831629
Energy: 1.1142404037093923
Energy: 1.103604673432967
Energy: 1.1142404037093923
Energy: 1.0884908644695208
Energy: 1.484259581027159
Energy: 1.159098079832481
Energy: 1.484259581025974
Energy: 1.0884908644695208
Energy: 1.484259581027159
Energy: 1.0879663123273278
Energy: 1.3004154120083717
Energy: 1.3733265173885507
Energy: 1.3004154120083717
Energy: 1.0879663123273278
Energy: 1.3004154120083717
Energy: 1.1032367459212875
Energy: 1.4938434432095058
Energy: 1.225883224584398
Energy: 1.4938434432095058
Energy: 1.1032367459212875
Energy: 1.4938434432095058
Energy: 1.166209422899017
Energy: 1.1628072138542302
Energy: 1.086391098805338
Energy: 1.1628072138530452
Energy: 1.166209422900202
Energy: 1.1628072138530452
Energy: 1.0856090193171364
Energy: 1.4794761994355352
Energy: 1.159363451728203
Energy: 1.4794761994355352
Energy: 1.0856090193171364
Energy: 1.4794761994355352
Energy: 1.0880065368684428
Energy: 1.0855218158600997
Energy: 1.0884881563322877
Energy: 1.0855218158589146
Energy: 1.0880065368684428
Energy: 1.0855218158589146
Energy: 1.1355926929050912
Energy: 1.3089892416904803
Energy: 1.1653782232094911
Energy: 1.3089892416999616
Energy: 1.1355926929050912
Energy: 1.3089892416916655
Energy: 1.1740041396179548
Energy: 1.5147179054222075
Energy: 1.1200424494916608
Energy: 1.5147179054222075
Energy: 1.1740041396179548
Energy: 1.5147179054222075
Energy: 1.3804813964540916
Energy: 1.4682285849555314
Energy: 1.0880268927557377
Energy: 1.4682285849555314
Energy: 1.3804813964540916
Energy: 1.4682285849555314
Energy: 1.6424011958089868
Energy: 1.4947342821333414
Energy: 1.0923258915684946
Energy: 1.4947342821333414
Energy: 1.6424011958089868
Energy: 1.4947342821333414
Energy: 1.081493863625989
Energy: 1.5147661503273049
Energy: 1.1265332282999447
Energy: 1.5147661503284897
Energy: 1.081493863625989
Energy: 1.5147661503284897
Energy: 1.1407050557184344
Energy: 1.3222938025486313
Energy: 1.0858194676903772
Energy: 1.3222938026280104
Energy: 1.1407050557184344
Energy: 1.3222938025450761
Energy: 1.0801374960843364
Energy: 1.548729890229628
Energy: 1.0801575645541857
Energy: 1.548729890229628
Energy: 1.0801374960843364
Energy: 1.548729890229628
Energy: 1.0857259158710457
Energy: 1.5034148650327168
Energy: 1.1321273971974908
Energy: 1.5034148650327168
Energy: 1.0857259158710457
Energy: 1.5034148650327168
Energy: 1.1108273190717586
Energy: 1.5075903947555809
Energy: 1.0872364623611444
Energy: 1.5075903947508404
Energy: 1.1108273190717586
Energy: 1.5075903947555809
Energy: 1.0966201110473828
Energy: 1.4910967234058543
Energy: 1.6420464842195877
Energy: 1.4910967234070394
Energy: 1.0966201110461975
Energy: 1.4910967234070394
Energy: 1.0874687606185152
Energy: 1.4856080898984083
Energy: 1.4101963932497923
Energy: 1.4856080898984083
Energy: 1.0874687606173303
Energy: 1.4856080898984083
Energy: 1.1771202836351178
Energy: 1.5016497512823068
Energy: 1.1378404479607105
Energy: 1.5016497512823068
Energy: 1.1771202836351178
Energy: 1.5016497512823068
Energy: 1.1652287642683579
Energy: 1.3054166226890656
Energy: 1.082322415428859
Energy: 1.305416622350244
Energy: 1.1652287642683579
Energy: 1.3054166229070274

minimum gb energy = 1.0801374960843364 eV
minimum distance =  2.24843550935796 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.6048021994933117
Energy: 1.4482728331779322
Energy: 1.4020735533402515
Energy: 1.448272832955129
Energy: 1.6048021994933117
Energy: 1.4482728331812846
Energy: 1.4566362199886884
Energy: 1.1829487202466817
Energy: 1.1892530292862984
Energy: 1.1829487202466817
Energy: 1.4566362199886884
Energy: 1.1829487202466817
Energy: 1.483990222025328
Energy: 1.3712308010997631
Energy: 1.680575615814518
Energy: 1.3712308010997631
Energy: 1.483990222025328
Energy: 1.3712308010997631
Energy: 1.193616674174204
Energy: 1.3494589095496932
Energy: 1.4462062787572065
Energy: 1.3494589095496932
Energy: 1.193616674174204
Energy: 1.3494589095446652
Energy: 1.1847650457395216
Energy: 1.1729485831036703
Energy: 1.1948725246867766
Energy: 1.1729485831036703
Energy: 1.1847650457395216
Energy: 1.1729485831036703
Energy: 1.2017912895036718
Energy: 1.2090230669774586
Energy: 1.2673174365256215
Energy: 1.2090230669757827
Energy: 1.2017912894885872
Energy: 1.2090230669707545
Energy: 1.194617950389092
Energy: 1.371477119030514
Energy: 1.4586458737755068
Energy: 1.3714771190355424
Energy: 1.194617950389092
Energy: 1.371477119027162
Energy: 1.4397362091325243
Energy: 1.5881158919769294
Energy: 1.4460484604346926
Energy: 1.5881158919752532
Energy: 1.4397362091342003
Energy: 1.5881158919752532
Energy: 1.430010411185129
Energy: 1.4384006369475744
Energy: 1.2087392404268176
Energy: 1.4384006369475744
Energy: 1.430010411185129
Energy: 1.4384006369475744
Energy: 1.522388687708332
Energy: 1.185024675729649
Energy: 1.1880384589279807
Energy: 1.185024675731325
Energy: 1.522388687710008
Energy: 1.185024675729649
Energy: 1.5857711055473067
Energy: 1.6136721972114376
Energy: 1.1845021830056313
Energy: 1.6136721972114376
Energy: 1.5857711055473067
Energy: 1.6136721972114376
Energy: 1.4405269926014954
Energy: 1.422137218868596
Energy: 1.1917469886049235
Energy: 1.4221372188802903
Energy: 1.4405269926014954
Energy: 1.4221372188618917
Energy: 1.4391934122822136
Energy: 1.660679254458333
Energy: 1.4276364028707231
Energy: 1.660679254458333
Energy: 1.4391934122822136
Energy: 1.660679254456657
Energy: 1.198422683414974
Energy: 1.392314666242279
Energy: 1.4279313500437218
Energy: 1.3923146662590393
Energy: 1.198422683414974
Energy: 1.3923146662607155
Energy: 1.1885547363152504
Energy: 1.5548375754989452
Energy: 1.2428964558566447
Energy: 1.5548375754989452
Energy: 1.1885547363152504
Energy: 1.5548375754989452
Energy: 1.1926125626146835
Energy: 1.6837576274335677
Energy: 1.1941374376628293
Energy: 1.6837576274335677
Energy: 1.1926125626146835
Energy: 1.6837576274335677
Energy: 1.192361440900201
Energy: 1.5051426128276983
Energy: 1.4274483197494814
Energy: 1.5051426128293743
Energy: 1.1923614408985246
Energy: 1.5051426128293743

minimum gb energy = 1.1729485831036703 eV
minimum distance =  2.26845593576468 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.7667034747547798
Energy: 1.709173433100265
Energy: 1.5974673646802073
Energy: 1.709173433100265
Energy: 1.7667034747547798
Energy: 1.709173433100912
Energy: 1.4820977840169882
Energy: 1.197876264636063
Energy: 1.2003301533546709
Energy: 1.1978762646367103
Energy: 1.4820977840163407
Energy: 1.1978762646373575
Energy: 1.2109332168684623
Energy: 1.295015125328264
Energy: 1.430244280640494
Energy: 1.295015125328264
Energy: 1.2109332168684623
Energy: 1.295015125325028
Energy: 1.3575359733353636
Energy: 1.500340234391221
Energy: 1.3089983081444738
Energy: 1.5003402343841012
Energy: 1.3575359733360108
Energy: 1.5003402344229062
Energy: 1.1991696315527958
Energy: 1.2248119911344209
Energy: 1.541349011397345
Energy: 1.2248119911344209
Energy: 1.1991696315527958
Energy: 1.2248119911344209
Energy: 1.3330319929142964
Energy: 1.5284953461370183
Energy: 1.3669109151248053
Energy: 1.5284953425781158
Energy: 1.3330319929136492
Energy: 1.52849534214985
Energy: 1.1983347223468115
Energy: 1.3525375244409896
Energy: 1.5915416538194866
Energy: 1.3525375244371063
Energy: 1.198334722347459
Energy: 1.3525375244429314
Energy: 1.4802235015578353
Energy: 1.3402441073565436
Energy: 1.192899292040797
Energy: 1.3402441074005562
Energy: 1.4802235015584824
Energy: 1.3402441072802282
Energy: 1.3650005220183608
Energy: 1.5707794307350422
Energy: 1.1848284631739907
Energy: 1.5707794307356895
Energy: 1.3650005220177135
Energy: 1.5707794307331004
Energy: 1.67945674964424
Energy: 1.2563548118246157
Energy: 1.1983497244335732
Energy: 1.256354811817496
Energy: 1.6794567496435928
Energy: 1.25635481181426
Energy: 1.3398917279693652
Energy: 1.6993207721924641
Energy: 1.3236056931392537
Energy: 1.6993207721918167
Energy: 1.3398917279693652
Energy: 1.6993207721918167
Energy: 1.1846855379854728
Energy: 1.6160548856618335
Energy: 1.2084852343840136
Energy: 1.6160548856618335
Energy: 1.1846855379854728
Energy: 1.6160548856618335
Energy: 1.1960815024400189
Energy: 1.3764468974511006
Energy: 1.7573026028012098
Energy: 1.376446897351455
Energy: 1.1960815024400189
Energy: 1.3764468974646633
Energy: 1.1865141245002242
Energy: 1.7343265183893763
Energy: 1.756932238347129
Energy: 1.7343265183887293
Energy: 1.1865141245008715
Energy: 1.7343265183893763
Energy: 1.1966845005500666
Energy: 1.6964036733389085
Energy: 1.3259737396769964
Energy: 1.6964036733382615
Energy: 1.1966845005500666
Energy: 1.6964036733376142
Energy: 1.3160008520437994
Energy: 1.6570615750467619
Energy: 1.2087518781190916
Energy: 1.6570615750467619
Energy: 1.316000852043152
Energy: 1.6570615750474091
Energy: 1.33448767081298
Energy: 1.5174623455084417
Energy: 1.1924302601495242
Energy: 1.5174623455097362
Energy: 1.3344876708136275
Energy: 1.5174623455084417
Energy: 1.7033803575515136
Energy: 1.54598509639021
Energy: 1.1822792216407747
Energy: 1.5459850958299661
Energy: 1.7033803575521607
Energy: 1.5459850962802384
Energy: 1.5313140994938603
Energy: 1.514612004704713
Energy: 1.2010692325271772
Energy: 1.514611991231316
Energy: 1.5313140994938603
Energy: 1.5146120009937976
Energy: 1.1935913305277164
Energy: 1.542836827073368
Energy: 1.1930279430245951
Energy: 1.5428368267032941
Energy: 1.1935913305277164
Energy: 1.5428368269116168
Energy: 1.2009813252828652
Energy: 1.5043547777202373
Energy: 1.6985552509425093
Energy: 1.5043547741820469
Energy: 1.2009813252828652
Energy: 1.5043547465475031
Energy: 1.1823788238956878
Energy: 1.55656993259127
Energy: 1.7035980001694415
Energy: 1.55656993259127
Energy: 1.1823788238956878
Energy: 1.5565699325835032
Energy: 1.177036547054491
Energy: 1.554505126363926
Energy: 1.3347412901845546
Energy: 1.5545051263626313
Energy: 1.177036547054491
Energy: 1.5545051263626313
Energy: 1.2091932153141036
Energy: 1.5069126585123076
Energy: 1.3173340003508998
Energy: 1.5069126585097188
Energy: 1.2091932153147509
Energy: 1.5069126585123076
Energy: 1.316635946357145
Energy: 1.6579246412689068
Energy: 1.1825378152225947
Energy: 1.6579246412682593
Energy: 1.3166359463577926
Energy: 1.6579246412689068
Energy: 1.7797332366742602
Energy: 1.7343296031458122
Energy: 1.1870375092854704
Energy: 1.7343296031458122
Energy: 1.7797332366749075
Energy: 1.7343296031458122
Energy: 1.752764724380777
Energy: 1.3552384419752115
Energy: 1.1955569692859438
Energy: 1.355238441976506
Energy: 1.752764724380777
Energy: 1.3552384419752115
Energy: 1.208628226442759
Energy: 1.6058411882887171
Energy: 1.1855477664576461
Energy: 1.6058411882725359
Energy: 1.208628226442759
Energy: 1.6058411882731831
Energy: 1.3140500819021588
Energy: 1.6278232389203704
Energy: 1.3402140604643675
Energy: 1.6278232389203704
Energy: 1.3140500819008645
Energy: 1.6278232389203704
Energy: 1.1980550572966666
Energy: 1.3362053473386157
Energy: 1.681815966874561
Energy: 1.3362053473379685
Energy: 1.1980550572973137
Energy: 1.3362053473379685
Energy: 1.18269812082262
Energy: 1.5592072503851004
Energy: 1.3650680636715895
Energy: 1.5592072505597963
Energy: 1.1826981208232672
Energy: 1.559207250807571
Energy: 1.1947099762967215
Energy: 1.3453484320458884
Energy: 1.495264945913719
Energy: 1.3453484320387687
Energy: 1.1947099762967215
Energy: 1.3453484320478304
Energy: 1.5907501036651297
Energy: 1.3015456053782515
Energy: 1.1983021841719237
Energy: 1.301545605346566
Energy: 1.5907501036644827
Energy: 1.3015456053368575
Energy: 1.366945021244438
Energy: 1.5057858696698023
Energy: 1.3261334091047676
Energy: 1.5057858703387532
Energy: 1.3669450212437908
Energy: 1.5057858694213804
Energy: 1.4962811106201326
Energy: 1.2248119911337736
Energy: 1.1990368360741932
Energy: 1.2248119911331266
Energy: 1.4962811106220741
Energy: 1.2248119911331266
Energy: 1.3076345830579932
Energy: 1.5450026388123015
Energy: 1.3579697998668472
Energy: 1.5450026388148903
Energy: 1.307634583057346
Energy: 1.5450026388155376
Energy: 1.430217420652358
Energy: 1.294213935663092
Energy: 1.2086248967252384
Energy: 1.294213935662445
Energy: 1.430217420652358
Energy: 1.2942139356637394
Energy: 1.1956022405886957
Energy: 1.1954501749049167
Energy: 1.4905612758978202
Energy: 1.1954501749036222
Energy: 1.1956022405880482
Energy: 1.1954501749042694
Energy: 1.4683942131946577
Energy: 1.7091734330996176
Energy: 1.7667034747593107
Energy: 1.709173433100912
Energy: 1.468394213195305
Energy: 1.7091734330996176
Energy: 1.2003301533546709
Energy: 1.197876264636063
Energy: 1.4820977840176353
Energy: 1.197876264636063
Energy: 1.2003301533546709
Energy: 1.197876264636063
Energy: 1.430244280616546
Energy: 1.295015125299786
Energy: 1.2109332168684623
Energy: 1.295015125299786
Energy: 1.4302442806146043
Energy: 1.295015125300433
Energy: 1.3089983081431793
Energy: 1.5003402347975106
Energy: 1.3575359733314802
Energy: 1.5003402348291959
Energy: 1.3089983081438266
Energy: 1.500340234779388
Energy: 1.5413490113960506
Energy: 1.2248119911357154
Energy: 1.1991696315527958
Energy: 1.2248119911350681
Energy: 1.5413490113960506
Energy: 1.2248119911344209

minimum gb energy = 1.177036547054491 eV
minimum distance =  2.25134481020531 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.3861231806183691
Energy: 1.6790268979701939
Energy: 1.5418885103532936
Energy: 1.6790268979701939
Energy: 1.3861231806183691
Energy: 1.6790268979701939
Energy: 1.297977538751842
Energy: 1.1613185949367988
Energy: 1.1595110455105073
Energy: 1.1613185949357452
Energy: 1.297977538751842
Energy: 1.1613185949357452
Energy: 1.1576012869471304
Energy: 1.3302560240110335
Energy: 1.2818512399141313
Energy: 1.3302560240131414
Energy: 1.1576012869471304
Energy: 1.3302560240131414
Energy: 1.4021958004777106
Energy: 1.4720028523581339
Energy: 1.348331908197674
Energy: 1.472002852359188
Energy: 1.4021958005809407
Energy: 1.472002852359188
Energy: 1.1541364408218358
Energy: 1.2226219655159885
Energy: 1.3935556389828012
Energy: 1.2226219655149346
Energy: 1.1541364408218358
Energy: 1.2226219655128268
Energy: 1.4069634384450445
Energy: 1.4822319638813357
Energy: 1.3485848695092062
Energy: 1.4822319638802819
Energy: 1.4069634384460985
Energy: 1.4822319638802819
Energy: 1.1550013531158736
Energy: 1.3439292860149492
Energy: 1.1706145506409191
Energy: 1.343929286018111
Energy: 1.1550013531148198
Energy: 1.343929286030757
Energy: 1.6078338532118552
Energy: 1.251422267415463
Energy: 1.1487049382126184
Energy: 1.2514222674123012
Energy: 1.6078338532097476
Energy: 1.2514222674112474
Energy: 1.3833925283946262
Energy: 1.6755384394423356
Energy: 1.1641662542740108
Energy: 1.6755384394423356
Energy: 1.3833925283946262
Energy: 1.6755384394423356
Energy: 1.2655225897537397
Energy: 1.157849297671286
Energy: 1.1489243765891335
Energy: 1.157849297671286
Energy: 1.2655225897569011
Energy: 1.1578492976691783
Energy: 1.154911744113288
Energy: 1.4250672796776216
Energy: 1.3761126105271408
Energy: 1.425067279680783
Energy: 1.1549117441143417
Energy: 1.4250672796797295
Energy: 1.2059591713889557
Energy: 1.3786857834937416
Energy: 1.345956827215399
Energy: 1.3786857834958492
Energy: 1.205959171387902
Energy: 1.3786857834937416
Energy: 1.1596196113955666
Energy: 1.5010905019382095
Energy: 1.3760218910588182
Energy: 1.501090501941371
Energy: 1.1596196113955666
Energy: 1.501090501941371
Energy: 1.3642942740604111
Energy: 1.5502895119679823
Energy: 1.346957328110981
Energy: 1.5502895119679823
Energy: 1.3642942740604111
Energy: 1.5502895119679823
Energy: 1.1572910452280336
Energy: 1.3427738503926105
Energy: 1.1654684397014983
Energy: 1.3427738503926105
Energy: 1.1572910452311953
Energy: 1.3427738503905031
Energy: 1.5865741520702705
Energy: 1.615818490990411
Energy: 1.1473834008093684
Energy: 1.6158184909893571
Energy: 1.5865741520723784
Energy: 1.6158184909872493
Energy: 1.3901925342745056
Energy: 1.7399896910002928
Energy: 1.159732860941791
Energy: 1.739989690999239
Energy: 1.3901925342745056
Energy: 1.739989690999239
Energy: 1.3221102610807294
Energy: 1.7102969347363
Energy: 1.1546390986079917
Energy: 1.7102969347363
Energy: 1.3221102610817834
Energy: 1.7102969347384076
Energy: 1.1571314622092763
Energy: 1.5086614150556767
Energy: 1.3619688082046904
Energy: 1.5086614150567308
Energy: 1.1571314622092763
Energy: 1.5086614150567308
Energy: 1.3149430464193805
Energy: 1.7285181404125802
Energy: 1.3543679342489086
Energy: 1.7285181404136338
Energy: 1.3149430464204346
Energy: 1.7285181404136338
Energy: 1.15225240043642
Energy: 1.5485120860539492
Energy: 1.380118881915253
Energy: 1.5485120859981423
Energy: 1.152252400435366
Energy: 1.5485120860507875
Energy: 1.1586359112827158
Energy: 1.5064044604989941
Energy: 1.3553477518245614
Energy: 1.506404460502156
Energy: 1.158635911281662
Energy: 1.506404460502156
Energy: 1.1646065039373064
Energy: 1.3445113633523393
Energy: 1.1570809658360455
Energy: 1.344511363410254
Energy: 1.1646065039373064
Energy: 1.3445113635440462
Energy: 1.388114288855671
Energy: 1.7450474784724037
Energy: 1.155527137914248
Energy: 1.7450474784724037
Energy: 1.388114288855671
Energy: 1.7450474784734575
Energy: 1.3915927526860936
Energy: 1.811975160420035
Energy: 1.1517291094079805
Energy: 1.811975160421089
Energy: 1.3915927526860936
Energy: 1.811975160421089
Energy: 1.1609916289642588
Energy: 1.4018552476208428
Energy: 1.1614883564867644
Energy: 1.401855247634543
Energy: 1.160991628962151
Energy: 1.401855247611406
Energy: 1.1553372654958296
Energy: 1.5009170464854373
Energy: 1.3509376967254187
Energy: 1.5009170464854373
Energy: 1.1553372654958296
Energy: 1.5009170464854373

minimum gb energy = 1.1473834008093684 eV
minimum distance =  2.25033208522068 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.4610871640986434
Energy: 1.6914071847712089
Energy: 1.5815797074759856
Energy: 1.6914071847712089
Energy: 1.4610871640986434
Energy: 1.6914071847712089
Energy: 1.2582178164047615
Energy: 1.2162485498763511
Energy: 1.201280897402903
Energy: 1.2162485498763511
Energy: 1.2582178164039934
Energy: 1.2162485498763511
Energy: 1.2008721212467832
Energy: 1.355682826745227
Energy: 1.568370906090707
Energy: 1.3556828267160839
Energy: 1.2008721212467832
Energy: 1.3556828267375833
Energy: 1.491961369253245
Energy: 1.6530202815151471
Energy: 1.3744632947952278
Energy: 1.65302028152129
Energy: 1.4919613692524771
Energy: 1.6530202815243613
Energy: 1.1969152540967443
Energy: 1.273863702744065
Energy: 1.3352849373358802
Energy: 1.2738637027448327
Energy: 1.1969152540959764
Energy: 1.273863702744065
Energy: 1.4146147247849998
Energy: 1.3361061523657611
Energy: 1.2650659726376368
Energy: 1.3361061524271889
Energy: 1.4146147248333742
Energy: 1.3361061523688325
Energy: 1.265003078156813
Energy: 1.3605497400458584
Energy: 1.2216393815084554
Energy: 1.3605497401187692
Energy: 1.2650030781560448
Energy: 1.360549740068126
Energy: 1.3579745977851863
Energy: 1.2708419186092694
Energy: 1.199317336279884
Energy: 1.2708419186085016
Energy: 1.3579745977813469
Energy: 1.2708419186085016
Energy: 1.3862138879858579
Energy: 1.4341036441365727
Energy: 1.367867280873059
Energy: 1.434103699093844
Energy: 1.3862138879858579
Energy: 1.434103618323798
Energy: 1.4263866483389351
Energy: 1.3515387515629902
Energy: 1.2030729692947932
Energy: 1.3515387515407578
Energy: 1.426386648338167
Energy: 1.3515387516382045
Energy: 1.2015810295179812
Energy: 1.2895669177177034
Energy: 1.7410811355137241
Energy: 1.2895669177177034
Energy: 1.2015810295179812
Energy: 1.2895669177177034
Energy: 1.2142489198289863
Energy: 1.6589046577453892
Energy: 1.4651896839352423
Energy: 1.6589046590263323
Energy: 1.2142489198289863
Energy: 1.658904660383292
Energy: 1.2053653418600836
Energy: 1.2196795142307486
Energy: 1.3807410172391708
Energy: 1.2196795142299808
Energy: 1.2053653418593155
Energy: 1.2196795142299808
Energy: 1.405137071144678
Energy: 1.4445169891903964
Energy: 1.25569350035314
Energy: 1.4445169891903964
Energy: 1.4051370711400708
Energy: 1.4445169891903964
Energy: 1.3810369821286108
Energy: 1.4224675409256862
Energy: 1.219105675009628
Energy: 1.422493574442218
Energy: 1.3810369821286108
Energy: 1.422430050672573
Energy: 1.374787372621802
Energy: 1.4630939294600926
Energy: 1.2046827065787453
Energy: 1.4630939294623961
Energy: 1.3747873726248732
Energy: 1.4630939294577892
Energy: 1.264330129558558
Energy: 1.4687226476876105
Energy: 1.3987709870061482
Energy: 1.4687226476860749
Energy: 1.2643301295577902
Energy: 1.4687226476876105
Energy: 1.2107363595743552
Energy: 1.3627036672237145
Energy: 1.261445444460084
Energy: 1.3627035611843548
Energy: 1.2107363595728193
Energy: 1.362703630724991
Energy: 1.2159740969449302
Energy: 1.3459214179239152
Energy: 1.371019690105832
Energy: 1.3459214173475067
Energy: 1.2159740969449302
Energy: 1.3459214187597166
Energy: 1.201573938385451
Energy: 1.7763626624065179
Energy: 1.378800990718438
Energy: 1.7763626624057498
Energy: 1.201573938385451
Energy: 1.7763626624072857
Energy: 1.205239386614446
Energy: 1.39599145135081
Energy: 1.2149869638776942
Energy: 1.3959914511313105
Energy: 1.205239386614446
Energy: 1.3959914511512745
Energy: 1.754982279759781
Energy: 1.5167279244865037
Energy: 1.204539573654622
Energy: 1.5167279244872713
Energy: 1.7549822797590133
Energy: 1.5167279244872713
Energy: 1.8704700613707637
Energy: 1.6694754648435242
Energy: 1.2120754460757288
Energy: 1.6694754648435242
Energy: 1.8704700613707637
Energy: 1.6694754648427563
Energy: 1.223203040363035
Energy: 1.7869428211121101
Energy: 1.2172469538715813
Energy: 1.7869428211144138
Energy: 1.223203040362267
Energy: 1.7869428211121101
Energy: 1.2059377750027809
Energy: 1.554019891144423
Energy: 1.3738511496963541
Energy: 1.554019891143655
Energy: 1.2059377750035485
Energy: 1.554019891123691
Energy: 1.2160444260348175
Energy: 1.7475274596930928
Energy: 1.4070516457952158
Energy: 1.7475274596930928
Energy: 1.2160444260348175
Energy: 1.7475274596930928
Energy: 1.2147190168632707
Energy: 1.4724982099021442
Energy: 1.3544075809138072
Energy: 1.4724982099159656
Energy: 1.2147190168632707
Energy: 1.4724982099343589
Energy: 1.3543744261961803
Energy: 1.7234041617831588
Energy: 1.3546598209736767
Energy: 1.7234041617831588
Energy: 1.354374426196948
Energy: 1.7234041617831588
Energy: 1.3546974791133453
Energy: 1.4741065377291476
Energy: 1.2038542068205589
Energy: 1.4741065413786187
Energy: 1.3546974791133453
Energy: 1.474106550354608
Energy: 1.3801523109662988
Energy: 1.7492884564060327
Energy: 1.2151873112634457
Energy: 1.7492884564068003
Energy: 1.380152310965531
Energy: 1.7492884564060327
Energy: 1.3746845701248662
Energy: 1.5404048815683684
Energy: 1.2065361173076194
Energy: 1.5404048815530462
Energy: 1.3746845701240986
Energy: 1.540404881484708
Energy: 1.2170783768562492
Energy: 1.5662513783819911
Energy: 1.2020299888581893
Energy: 1.5662513783819911
Energy: 1.2170783768562492
Energy: 1.566251378382759
Energy: 1.2128417638747218
Energy: 1.4512900697968854
Energy: 1.6611311217553804
Energy: 1.4512900699051168
Energy: 1.2128417638747218
Energy: 1.4512900700325098
Energy: 1.205797131684994
Energy: 1.5342206731207517
Energy: 1.751641850540862
Energy: 1.5342206731207517
Energy: 1.2057971316842264
Energy: 1.5342206731222874
Energy: 1.2103801798077236
Energy: 1.3631152423353703
Energy: 1.2767217632379475
Energy: 1.3631152423254234
Energy: 1.210380179806956
Energy: 1.3631152423430488
Energy: 1.377155055639729
Energy: 1.74536798480651
Energy: 1.200597172854241
Energy: 1.74536798480651
Energy: 1.3771550556389611
Energy: 1.745367984805742

minimum gb energy = 1.1969152540959764 eV
minimum distance =  2.2393289024267 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 1.21980268177111
Energy: 1.2299460008803438
Energy: 1.4982996966431383
Energy: 1.2299460008803438
Energy: 1.21980268177111
Energy: 1.2299460008800551
Energy: 1.5179196191989524
Energy: 1.230648534533712
Energy: 1.2291664367151092
Energy: 1.230648534533712
Energy: 1.5179196252309435
Energy: 1.2306485345334552
Energy: 1.2303457277430752
Energy: 1.2311830922104081
Energy: 1.8016925088217404
Energy: 1.2311830922106968
Energy: 1.2303457277433638
Energy: 1.2311830922104081
Energy: 1.4993187217262174
Energy: 1.2299460008803438
Energy: 1.21980268177111
Energy: 1.2299460008803438
Energy: 1.4999879363917015
Energy: 1.2299460008803438
Energy: 1.2291664367148205
Energy: 1.2306485345340001
Energy: 1.5179196765844754
Energy: 1.2306485345334552
Energy: 1.2291664367148205
Energy: 1.230648534533712
Energy: 1.8016925088248503
Energy: 1.2311830922104081
Energy: 1.2303457277430752
Energy: 1.2311830922106968
Energy: 1.8016925088240168
Energy: 1.2311830922104081
Energy: 1.21980268177111
Energy: 1.2299460008800551
Energy: 1.4986079932980059
Energy: 1.2299460008809209
Energy: 1.21980268177111
Energy: 1.2299460008803438
Energy: 1.5179196688351448
Energy: 1.230648534533712
Energy: 1.2291664367151092
Energy: 1.230648534533712
Energy: 1.5179196670359572
Energy: 1.230648534533712
Energy: 1.2303457277433638
Energy: 1.2311830922104081
Energy: 1.801692508824273
Energy: 1.2311830922106968
Energy: 1.2303457277433638
Energy: 1.2311830922101514
Energy: 1.4987674203452503
Energy: 1.2299460008806324
Energy: 1.21980268177111
Energy: 1.2299460008803438
Energy: 1.4966546000493453
Energy: 1.2299460008803438

minimum gb energy = 1.21980268177111 eV
minimum distance =  2.25587218653226 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 1.7593978743183396
Energy: 1.7046441112316242
Energy: 1.6877906383612153
Energy: 1.704644111314324
Energy: 1.7593978743174952
Energy: 1.7046441113025042
Energy: 1.4532243511095655
Energy: 1.2356643602842117
Energy: 1.166888469020211
Energy: 1.235664360285056
Energy: 1.4532243510597536
Energy: 1.235664360285056
Energy: 1.1838519569221366
Energy: 1.1955771052801802
Energy: 1.3181623194419783
Energy: 1.195577105279336
Energy: 1.1838519569212926
Energy: 1.195577105279336
Energy: 1.6405624749143208
Energy: 1.4326334276018564
Energy: 1.2567201360389302
Energy: 1.4326332303953115
Energy: 1.6405624749143208
Energy: 1.4326333535849547
Energy: 1.2354208833594706
Energy: 1.2099399759163412
Energy: 1.5831604465167366
Energy: 1.209939975918874
Energy: 1.2354208833594706
Energy: 1.2099399759180298
Energy: 1.4368921332480429
Energy: 1.262623968382208
Energy: 1.1720849219703076
Energy: 1.2626239683813638
Energy: 1.4368921332666167
Energy: 1.2626239683813638
Energy: 1.2353937966425836
Energy: 1.2156156377653997
Energy: 1.2227281216728179
Energy: 1.2156156377645555
Energy: 1.2353937966425836
Energy: 1.2156156377670886
Energy: 1.2012524385931298
Energy: 1.6535934877022491
Energy: 1.2649730193024118
Energy: 1.653593487701405
Energy: 1.2012524385931298
Energy: 1.6535934877030936
Energy: 1.1850600652758976
Energy: 1.1967532255930036
Energy: 1.641547960577693
Energy: 1.1967532255744682
Energy: 1.1850600652758976
Energy: 1.196753225591315
Energy: 1.1844035311579824
Energy: 1.225252555321417
Energy: 1.1662722604296862
Energy: 1.225252555321417
Energy: 1.1844035311579824
Energy: 1.225252555321417
Energy: 1.647718908074862
Energy: 1.6678003971038264
Energy: 1.222870804853884
Energy: 1.6678003971012936
Energy: 1.647718908074862
Energy: 1.6678003971029822
Energy: 1.6575892172515494
Energy: 1.456181777642151
Energy: 1.164499222229804
Energy: 1.456181777644684
Energy: 1.6575892172515494
Energy: 1.456181777642151
Energy: 1.184783410614764
Energy: 1.297971830776514
Energy: 1.1836214056007954
Energy: 1.2979718307773582
Energy: 1.184783410614764
Energy: 1.2979718307782022
Energy: 1.1855826808578651
Energy: 1.6326969447958966
Energy: 1.2658703456020741
Energy: 1.6326969447950526
Energy: 1.1855826808570211
Energy: 1.6326969447950526
Energy: 1.231547346420514
Energy: 1.272850487091872
Energy: 1.2742646804851698
Energy: 1.2728504870901836
Energy: 1.231547346420514
Energy: 1.2728504870901836
Energy: 1.2586770968970775
Energy: 1.4135016811313184
Energy: 1.1719119901917552
Energy: 1.4135016813245405
Energy: 1.258677096897922
Energy: 1.4135016814629615
Energy: 1.242767642830516
Energy: 1.5506709500257863
Energy: 1.1712974628203268
Energy: 1.5506709500452043
Energy: 1.242767642830516
Energy: 1.5506709500426714
Energy: 1.2459197234318211
Energy: 1.3243898939842003
Energy: 1.2643229541128287
Energy: 1.3243898939842003
Energy: 1.245919723430977
Energy: 1.3243898939842003
Energy: 1.1866017826749375
Energy: 1.3882430915485187
Energy: 1.2656959855170704
Energy: 1.3882435650857865
Energy: 1.1866017826757815
Energy: 1.3882437103356207
Energy: 1.1896223913288102
Energy: 1.4367272248056786
Energy: 1.1638496855216383
Energy: 1.4367272248115885
Energy: 1.1896223913288102
Energy: 1.4367272248115885
Energy: 1.6667267589645796
Energy: 1.4885766312104929
Energy: 1.164691164868105
Energy: 1.4885766312104929
Energy: 1.6667267589662682
Energy: 1.4885766312104929
Energy: 1.641158177031285
Energy: 1.3016247933796243
Energy: 1.2204404686536128
Energy: 1.301624793485119
Energy: 1.641158177031285
Energy: 1.3016247933551406
Energy: 1.1882877855044622
Energy: 1.2242626685908076
Energy: 1.1642055243424707
Energy: 1.2242626685908076
Energy: 1.1882877855036178
Energy: 1.2242626685899631
Energy: 1.1895718000600128
Energy: 1.5098064634743142
Energy: 1.6213298538226182
Energy: 1.5098064634751585
Energy: 1.189571800060857
Energy: 1.5098064634751585
Energy: 1.201030230370658
Energy: 1.3255517938132808
Energy: 1.260821383480061
Energy: 1.3255517938115922
Energy: 1.2010302303715024
Energy: 1.3255517938124366
Energy: 1.2336437551903228
Energy: 1.5726523576827234
Energy: 1.2513697202615133
Energy: 1.5726523576768134
Energy: 1.2336437551903228
Energy: 1.5726523576852562
Energy: 1.219762658235795
Energy: 1.2360095571827945
Energy: 1.1755600284049876
Energy: 1.2360095566300686
Energy: 1.219762658234951
Energy: 1.2360095569262528
Energy: 1.2304778414111361
Energy: 1.4185288890980055
Energy: 1.418562205104103
Energy: 1.4185288891097867
Energy: 1.2304778414119804
Energy: 1.4185288891123196
Energy: 1.2949024687313502
Energy: 1.6510196172736176
Energy: 1.2596142592738546
Energy: 1.6510196172061147
Energy: 1.2949024687321944
Energy: 1.6510196173504077
Energy: 1.1847134153693462
Energy: 1.1956274150502677
Energy: 1.4051158402051596
Energy: 1.1956274150494233
Energy: 1.1847134153693462
Energy: 1.1956274150485788
Energy: 1.617144172061465
Energy: 1.2330461973089109
Energy: 1.165522489491322
Energy: 1.2330461973114437
Energy: 1.617144172064842
Energy: 1.2330461973105995
Energy: 1.7685280435184065
Energy: 1.714312377070237
Energy: 1.2233023333928963
Energy: 1.714312377070237
Energy: 1.7685280435184065
Energy: 1.714312377073614
Energy: 1.4629794918811496
Energy: 1.228769914849021
Energy: 1.1660722666020322
Energy: 1.2287699148481765
Energy: 1.4629794918803052
Energy: 1.2287699148481765

minimum gb energy = 1.1638496855216383 eV
minimum distance =  2.2365538702283 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.419235715242921
Energy: 1.5567839607813048
Energy: 1.573121830456944
Energy: 1.556783961446227
Energy: 1.419235715242921
Energy: 1.556783960371251
Energy: 1.6885891042250505
Energy: 1.3156115692228647
Energy: 1.152101840721912
Energy: 1.3156115692228647
Energy: 1.6885891042250505
Energy: 1.3156115692228647
Energy: 1.1361273215203131
Energy: 1.2177516154069756
Energy: 1.4160101279717636
Energy: 1.2177516154069756
Energy: 1.1361273215203131
Energy: 1.2177516154081238
Energy: 1.5607487545480878
Energy: 1.671721573722593
Energy: 1.2986263569239938
Energy: 1.671721573722593
Energy: 1.5607487545480878
Energy: 1.671721573722593
Energy: 1.2941339649839692
Energy: 1.714831583253891
Energy: 1.5667375293188008
Energy: 1.7148315832526881
Energy: 1.2941339649839692
Energy: 1.7148315832526881
Energy: 1.305468843417408
Energy: 1.1706432461217975
Energy: 1.1247616652576748
Energy: 1.1706432192602432
Energy: 1.305468843417408
Energy: 1.170643245496519
Energy: 1.1408862278823684
Energy: 1.3378509595008001
Energy: 1.1432653976284457
Energy: 1.3378509595008001
Energy: 1.1408862278835712
Energy: 1.3378509595008001
Energy: 1.2947513921527256
Energy: 1.653541994830147
Energy: 1.6979259468370258
Energy: 1.6535419945704117
Energy: 1.2947513921527256
Energy: 1.6535419948578156
Energy: 1.2843172562945868
Energy: 1.3059671326526767
Energy: 1.6751571813686295
Energy: 1.3059671326598947
Energy: 1.2843172562945868
Energy: 1.305967132634632
Energy: 1.2950614567374166
Energy: 1.3292801600984907
Energy: 1.1318147080803649
Energy: 1.329280160181442
Energy: 1.2950614567374166
Energy: 1.329280160344993
Energy: 1.3181321732578883
Energy: 1.3885938618302605
Energy: 1.1588449443603477
Energy: 1.3885938618110671
Energy: 1.3181321732566853
Energy: 1.388593861817082
Energy: 1.3196292640108382
Energy: 1.192636019321291
Energy: 1.2994982487401874
Energy: 1.1926360193224939
Energy: 1.3196292640108382
Energy: 1.192636019321291
Energy: 1.1444550724635507
Energy: 1.3812662027883675
Energy: 1.2972641215936485
Energy: 1.3812662027883675
Energy: 1.1444550724635507
Energy: 1.3812662027871645
Energy: 1.1409857532296257
Energy: 1.3253298691541109
Energy: 1.291283314712382
Energy: 1.3253298692022306
Energy: 1.1409857532308287
Energy: 1.3253298691914035
Energy: 1.6411790415460117
Energy: 1.5158002022929031
Energy: 1.2846750339627044
Energy: 1.5158002022929031
Energy: 1.6411790425981858
Energy: 1.5158002022916999
Energy: 1.6983812674270764
Energy: 1.7425467519096052
Energy: 1.286411955320102
Energy: 1.7425467519023874
Energy: 1.698381252970044
Energy: 1.7425467519108082
Energy: 1.1540918326180238
Energy: 1.3442661053528893
Energy: 1.1397465393383581
Energy: 1.344266105354092
Energy: 1.1540918326180238
Energy: 1.344266105354092
Energy: 1.1401298567633058
Energy: 1.1542094915577286
Energy: 1.3252574487330018
Energy: 1.1542094915529166
Energy: 1.1401298567633058
Energy: 1.1542094915541194
Energy: 1.6344396764123896
Energy: 1.7576351858375092
Energy: 1.2941936953851345
Energy: 1.7576351858279402
Energy: 1.6344396764123896
Energy: 1.7576351858411183
Energy: 1.3216506435245523
Energy: 1.5367545392554667
Energy: 1.5051631871394275
Energy: 1.5367544139324583
Energy: 1.3216506435245523
Energy: 1.5367544537852635
Energy: 1.595754437205359
Energy: 1.1822792982542418
Energy: 1.1181717839836294
Energy: 1.1822792985788837
Energy: 1.595754437205359
Energy: 1.1822792981640182
Energy: 1.1882798139473907
Energy: 1.3012026600283888
Energy: 1.6398299813423594
Energy: 1.301202660027186
Energy: 1.1882798139473907
Energy: 1.3012026600235769
Energy: 1.5906659402761802
Energy: 1.7627037907537437
Energy: 1.2241589741345273
Energy: 1.7627037907549463
Energy: 1.5906659402761802
Energy: 1.7627037906815646

minimum gb energy = 1.1181717839836294 eV
minimum distance =  2.23284395456893 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.4928213131465808
Energy: 1.4342250192062604
Energy: 1.576210613707485
Energy: 1.434225019204734
Energy: 1.4928213131465808
Energy: 1.4342250192054973
Energy: 1.619590663903456
Energy: 1.5266828790866152
Energy: 1.0579436559676028
Energy: 1.5266828790866152
Energy: 1.6195906639042192
Energy: 1.5266828790866152
Energy: 1.0612764061702857
Energy: 1.1438506587230348
Energy: 1.5999353073676412
Energy: 1.1438506587230348
Energy: 1.0612764061702857
Energy: 1.1438506587222719
Energy: 1.1373510676002037
Energy: 1.4355777069477438
Energy: 1.1082598131922834
Energy: 1.4355777069446911
Energy: 1.1373510675994407
Energy: 1.4355777069485072
Energy: 1.4178776918910476
Energy: 1.5138389193537498
Energy: 1.39689372366612
Energy: 1.5138389193079609
Energy: 1.4178776918902842
Energy: 1.513838919367452
Energy: 1.4199485381879717
Energy: 1.3852232170963676
Energy: 1.0658193658824957
Energy: 1.3852232170956045
Energy: 1.419948538184156
Energy: 1.3852232170963676
Energy: 1.066312833069756
Energy: 1.0896861505094542
Energy: 1.08534534556713
Energy: 1.0896861505102176
Energy: 1.066312833069756
Energy: 1.0896861505109805
Energy: 1.0786785158274883
Energy: 1.5101050655596402
Energy: 1.4164528158698353
Energy: 1.5101050655817714
Energy: 1.0786785158282512
Energy: 1.5101050655535349
Energy: 1.4109589489123446
Energy: 1.3215494416699343
Energy: 1.4166288824396414
Energy: 1.3215494416699343
Energy: 1.4109589489123446
Energy: 1.321549441669171
Energy: 1.1165958206313111
Energy: 1.2822006889213609
Energy: 1.068973964340933
Energy: 1.2822006889205977
Energy: 1.1165958206313111
Energy: 1.296307861000729
Energy: 1.0597172353116073
Energy: 1.402255035836007
Energy: 1.0862524988604856
Energy: 1.402255035836007
Energy: 1.0597172353116073
Energy: 1.402255035836007
Energy: 1.064312303920479
Energy: 1.1363311723691147
Energy: 1.7320402755013111
Energy: 1.136331172369878
Energy: 1.064312303920479
Energy: 1.136331172369878
Energy: 1.4171142921009263
Energy: 1.6242488138374436
Energy: 1.494153687391679
Energy: 1.6242488138374436
Energy: 1.4171142921009263
Energy: 1.6242488138359172
Energy: 1.05892984007719
Energy: 1.3852829487821832
Energy: 1.0725665287438
Energy: 1.3852829487692095
Energy: 1.05892984007719
Energy: 1.3852829487730254
Energy: 1.424115867357567
Energy: 1.1541007364806029
Energy: 1.060760444407504
Energy: 1.1541007364806029
Energy: 1.424115867357567
Energy: 1.1541007364813658
Energy: 1.1066567489750505
Energy: 1.4443646276508122
Energy: 1.6100856680423363
Energy: 1.4443646287462106
Energy: 1.1066567489758137
Energy: 1.444364627635584
Energy: 1.582968663878256
Energy: 1.6584022467051474
Energy: 1.4555472832071392
Energy: 1.6584022467059107
Energy: 1.582968663878256
Energy: 1.658402246706674
Energy: 1.0652727537333941
Energy: 1.0904395122592043
Energy: 1.6395675095458244
Energy: 1.0904395122592043
Energy: 1.0652727537341573
Energy: 1.0904395122599675
Energy: 1.3950160990242364
Energy: 1.0938657363963757
Energy: 1.063471887592586
Energy: 1.0938657363994284
Energy: 1.3950160990234732
Energy: 1.0938657363986652
Energy: 1.4505833434499353
Energy: 1.6172429493484215
Energy: 1.0789028869671746
Energy: 1.6172429493591056
Energy: 1.4505833434499353
Energy: 1.6172429493507108
Energy: 1.6142287919979827
Energy: 1.4127544929457676
Energy: 1.1132139508990215
Energy: 1.4127544929457676
Energy: 1.614228791999509
Energy: 1.4127544929465305
Energy: 1.0620060652042131
Energy: 1.0885158230588208
Energy: 1.4079100014924488
Energy: 1.0885158234364065
Energy: 1.0620060652042131
Energy: 1.0885158231412062
Energy: 1.0782343682507034
Energy: 1.4033830710452015
Energy: 1.0617174494013808
Energy: 1.4033830710444382
Energy: 1.0782343682507034
Energy: 1.4033830710459647
Energy: 1.455711021876729
Energy: 1.367988940936928
Energy: 1.0729777979394854
Energy: 1.367988940917849
Energy: 1.455711021876729
Energy: 1.3679889409331119
Energy: 1.7259448910203223
Energy: 1.1340550347857659
Energy: 1.0667936030725804
Energy: 1.1340550347857659
Energy: 1.7259448910203223
Energy: 1.1340550347857659
Energy: 1.0813338700480057
Energy: 1.4012083320111037
Energy: 1.0635617295308624
Energy: 1.4012083320118667
Energy: 1.0813338700480057
Energy: 1.4012083320111037
Energy: 1.0665730384779795
Energy: 1.101406314022389
Energy: 1.4016274725453268
Energy: 1.1014063140078894
Energy: 1.0665730384779795
Energy: 1.1014063139941526
Energy: 1.4202196230196125
Energy: 1.30895125437201
Energy: 1.1260309311919703
Energy: 1.30895125437201
Energy: 1.4202196230203759
Energy: 1.30895125437201
Energy: 1.4168002723877615
Energy: 1.4980390020786387
Energy: 1.0950746670270741
Energy: 1.498039002080165
Energy: 1.4168002723885247
Energy: 1.4980390020778755
Energy: 1.082759566253437
Energy: 1.0934900328551975
Energy: 1.0652288167153166
Energy: 1.0934900328544341
Energy: 1.082759566253437
Energy: 1.0934900328551975
Energy: 1.0650649105920018
Energy: 1.3245429137084674
Energy: 1.5618599175401708
Energy: 1.324542913705415
Energy: 1.0650649105920018
Energy: 1.3245429136276083
Energy: 1.3968794249466057
Energy: 1.624055142101333
Energy: 1.4491976788358187
Energy: 1.6240551420967542
Energy: 1.3968794249450793
Energy: 1.624055142102096
Energy: 1.1069273656089509
Energy: 1.4734161538413535
Energy: 1.5278723871380906
Energy: 1.4734161538421167
Energy: 1.1069273656089509
Energy: 1.4734161538421167
Energy: 1.5241094381715905
Energy: 1.1482398966606546
Energy: 1.0632895720915545
Energy: 1.148239896677444
Energy: 1.5241094384805276
Energy: 1.1482398966423737
Energy: 1.0593745452578047
Energy: 1.4090201833820992
Energy: 1.5198428599539655
Energy: 1.4090201824972262
Energy: 1.059374545258568
Energy: 1.4090201835262652
Energy: 1.4162198726847295
Energy: 1.6136179964671993
Energy: 1.4948747143862615
Energy: 1.6136179964542257
Energy: 1.4162198726862558
Energy: 1.6136179964679627
Energy: 1.0615179464056428
Energy: 1.724216281830015
Energy: 1.6255497953760656
Energy: 1.7242162818292517
Energy: 1.0615179464056428
Energy: 1.724216281830778

minimum gb energy = 1.0579436559676028 eV
minimum distance =  2.23904900281835 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.9164460532270116
Energy: 0.8990181236186853
Energy: 1.5717385422707446
Energy: 0.8990181264949004
Energy: 0.9164460532270116
Energy: 0.899018120852855
Energy: 1.6537331231547574
Energy: 0.9000246335637618
Energy: 0.8874546341369626
Energy: 0.9000246335637618
Energy: 1.6537331231547574
Energy: 0.9000246335616783
Energy: 0.9167630251385082
Energy: 1.1232978354783734
Energy: 1.2679700748465548
Energy: 1.123297835480457
Energy: 0.9167630251385082
Energy: 1.123297835480457
Energy: 1.6832572974170192
Energy: 0.8946317819693309
Energy: 0.8877495682539461
Energy: 0.8946317819693309
Energy: 1.6832572974170192
Energy: 0.8946317819693309
Energy: 0.9259259477674243
Energy: 0.9058165082636184
Energy: 0.890997655995633
Energy: 0.9058165082532001
Energy: 0.9259259477674243
Energy: 0.9058165082552839
Energy: 0.9169817160650144
Energy: 0.9335944002003462
Energy: 0.8880846658787518
Energy: 0.9335944002003462
Energy: 0.9169817160650144
Energy: 0.9335944002003462
Energy: 1.666368338302366
Energy: 0.8953493066646284
Energy: 0.8911921638347624
Energy: 0.8953493066646284
Energy: 1.666368338302366
Energy: 0.8953493066646284
Energy: 0.9164611907535726
Energy: 0.894574253327215
Energy: 0.888293155871885
Energy: 0.8945742533292985
Energy: 0.9164611907535726
Energy: 0.894574253327215
Energy: 1.6202423893284794
Energy: 0.935406263651379
Energy: 0.8864811951231164
Energy: 0.9354062636534626
Energy: 1.6202423893284794
Energy: 0.9354062636534626
Energy: 0.9140869423883071
Energy: 1.4546275889640516
Energy: 0.8890549313742474
Energy: 1.4546275889640516
Energy: 0.9140869423883071
Energy: 1.4546275889640516
Energy: 1.5739116607430537
Energy: 0.8938908147487536
Energy: 0.882255777652827
Energy: 0.8938908147487536
Energy: 1.5739116607430537
Energy: 0.8938908147487536
Energy: 0.9145400488534406
Energy: 1.1213510703666016
Energy: 1.6845776296923691
Energy: 1.121351070368685
Energy: 0.9145400488534406
Energy: 1.121351070368685
Energy: 1.5729861998689119
Energy: 0.8930185518388224
Energy: 0.8820552577801424
Energy: 0.8930185518367388
Energy: 1.5729861998689119
Energy: 0.8930185518367388
Energy: 0.9135159293123458
Energy: 1.5011586891710393
Energy: 0.8861715584338625
Energy: 1.5011586891731228
Energy: 0.9135159293123458
Energy: 1.5011586891731228

minimum gb energy = 0.8820552577801424 eV
minimum distance =  2.26653701082998 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.5680882446677626
Energy: 1.2286910986612012
Energy: 1.569434323757743
Energy: 1.228691098603556
Energy: 1.5680882446668472
Energy: 1.2286910986730797
Energy: 1.4157504471415914
Energy: 1.6796409808832948
Energy: 1.168570188544422
Energy: 1.6796409808832948
Energy: 1.4157504471406759
Energy: 1.6796409808832948
Energy: 1.1714422512811136
Energy: 1.41764242142954
Energy: 1.1630225777532843
Energy: 1.41764242142954
Energy: 1.1714422512801983
Energy: 1.41764242142954
Energy: 1.176248613548206
Energy: 1.2237671270146242
Energy: 1.163857118206665
Energy: 1.2237671270155397
Energy: 1.176248613548206
Energy: 1.2237671270146242
Energy: 1.401863151054542
Energy: 1.39147386909823
Energy: 1.1800156448457697
Energy: 1.3914738690836055
Energy: 1.401863151054542
Energy: 1.3914738691119601
Energy: 1.2066458185764852
Energy: 1.5662125799165987
Energy: 1.4198467235711985
Energy: 1.5662125799165987
Energy: 1.2066458185764852
Energy: 1.5662125799165987
Energy: 1.1771702240475828
Energy: 1.4448818563163541
Energy: 1.199522862913196
Energy: 1.4448818565908295
Energy: 1.1771702240475828
Energy: 1.444881856502999
Energy: 1.1636849142316565
Energy: 1.2745008413414338
Energy: 1.1677151913594164
Energy: 1.2745008413423489
Energy: 1.1636849142316565
Energy: 1.2745008413423489
Energy: 1.4265815573290281
Energy: 1.2610252708646204
Energy: 1.159762262711972
Energy: 1.2610252708582128
Energy: 1.4265815573290281
Energy: 1.2610252708600438
Energy: 1.233316990541332
Energy: 1.5339794859374536
Energy: 1.2206392926496104
Energy: 1.5339794859420302
Energy: 1.233316990541332
Energy: 1.5339794859411149
Energy: 1.3601478891081915
Energy: 1.3648631401228346
Energy: 1.435229410581135
Energy: 1.364863140540955
Energy: 1.3601478891081915
Energy: 1.3648631386205219
Energy: 1.1571954740669468
Energy: 1.3726554514784384
Energy: 1.453479046081943
Energy: 1.372655451483015
Energy: 1.1571954740669468
Energy: 1.3726554514811844
Energy: 1.1708098277030174
Energy: 1.4690783401688472
Energy: 1.3075497258525435
Energy: 1.4690783401688472
Energy: 1.1708098277030174
Energy: 1.4690783401697625
Energy: 1.1804562796305482
Energy: 1.3648866523400929
Energy: 1.1794976891197038
Energy: 1.364886652341008
Energy: 1.1804562796305482
Energy: 1.3648866523400929
Energy: 1.1598847639514263
Energy: 1.6117948034506404
Energy: 1.4238229192721437
Energy: 1.6117948034506404
Energy: 1.1598847639523417
Energy: 1.6117948034506404
Energy: 1.4856898050615317
Energy: 1.6642264942279927
Energy: 1.261727712700784
Energy: 1.6642264942279927
Energy: 1.4856898050624472
Energy: 1.6642264942279927
Energy: 1.2006283608178403
Energy: 1.64837184842653
Energy: 1.2602520662840413
Energy: 1.6483718484274452
Energy: 1.2006283608187556
Energy: 1.6483718484274452
Energy: 1.414477853150576
Energy: 1.6404542903703532
Energy: 1.1978919443100922
Energy: 1.6404542903721628
Energy: 1.414477853150576
Energy: 1.6404542903703532
Energy: 1.179275619915203
Energy: 1.1789131474090626
Energy: 1.1900809641589263
Energy: 1.1789131474090626
Energy: 1.179275619915203
Energy: 1.1789131474090626
Energy: 1.1612084941611414
Energy: 1.437004947902005
Energy: 1.1711187627050306
Energy: 1.437004947902005
Energy: 1.1612084941611414
Energy: 1.4370049479010896
Energy: 1.4441121045455165
Energy: 1.3658467211067353
Energy: 1.165749415778179
Energy: 1.3658467210756349
Energy: 1.4441121045455165
Energy: 1.3658467210984975
Energy: 1.53412821150361
Energy: 1.7103556979938042
Energy: 1.4259447258018283
Energy: 1.710355697992889
Energy: 1.53412821150361
Energy: 1.710355697992889
Energy: 1.180706333326598
Energy: 1.691304360496927
Energy: 1.235341305504521
Energy: 1.691304360496927
Energy: 1.180706333326598
Energy: 1.691304360496927
Energy: 1.160295033401447
Energy: 1.2616495182533942
Energy: 1.4090537472069224
Energy: 1.2616495182268495
Energy: 1.160295033401447
Energy: 1.2616495181454266
Energy: 1.2512779694312595
Energy: 1.2671068391833666
Energy: 1.153819285511581
Energy: 1.2671068391806206
Energy: 1.2512779694312595
Energy: 1.2671068391833666
Energy: 1.1998271867490573
Energy: 1.4438110221390867
Energy: 1.181399282539807
Energy: 1.443811022141833
Energy: 1.1998271867490573
Energy: 1.4438110221390867
Energy: 1.4345214277611973
Energy: 1.3823759419921966
Energy: 1.4031201995763845
Energy: 1.3823732690610704
Energy: 1.4345214277611973
Energy: 1.3823776311052118
Energy: 1.1783606605963306
Energy: 1.3708180652572475
Energy: 1.2022722833029647
Energy: 1.3708180657448916
Energy: 1.1783606605963306
Energy: 1.3708180654420616
Energy: 1.1735566256592482
Energy: 1.185543317181639
Energy: 1.1869728373250734
Energy: 1.185543317133147
Energy: 1.1735566256592482
Energy: 1.1855433171166918
Energy: 1.152159577924022
Energy: 1.4395627630905952
Energy: 1.1639268727689183
Energy: 1.4395627630905952
Energy: 1.152159577924022
Energy: 1.4395627630905952
Energy: 1.16856176115343
Energy: 1.6809461272367288
Energy: 1.4132274427467966
Energy: 1.6809461272367288
Energy: 1.1685617611543453
Energy: 1.6809461272358135

minimum gb energy = 1.152159577924022 eV
minimum distance =  2.22463731548962 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.3943916851249931
Energy: 1.388126592676089
Energy: 1.3505071296608264
Energy: 1.388126592676089
Energy: 1.3943916851249931
Energy: 1.388126592676089
Energy: 1.2626425978737466
Energy: 1.3573835339629996
Energy: 1.2378039652453223
Energy: 1.3573835339629996
Energy: 1.2626425978737466
Energy: 1.3573835339629996
Energy: 1.3029260910463485
Energy: 1.3492903457539782
Energy: 1.2377519544277638
Energy: 1.3492903457539782
Energy: 1.3029260910463485
Energy: 1.3492903457539782
Energy: 1.2378250784095743
Energy: 1.4848532849861062
Energy: 1.2375911903011971
Energy: 1.4848532849861062
Energy: 1.2378250784095743
Energy: 1.4848532849861062
Energy: 1.2374465734689384
Energy: 1.349209259310578
Energy: 1.230195825763453
Energy: 1.349209259310578
Energy: 1.2374465734689384
Energy: 1.349209259310578
Energy: 1.238101195918687
Energy: 1.3536857627459429
Energy: 1.2628346388261535
Energy: 1.35368576273617
Energy: 1.238101195918687
Energy: 1.3536857627182524
Energy: 1.3505071296608264
Energy: 1.388126592676089
Energy: 1.3943916851249931
Energy: 1.388126592676089
Energy: 1.3505071296608264
Energy: 1.3881265926777178
Energy: 1.2378039652453223
Energy: 1.5601475285625668
Energy: 1.2626425978737466
Energy: 1.3573835339629996
Energy: 1.237803965246951
Energy: 1.5601475285609379
Energy: 1.2377519544261348
Energy: 1.3492903457539782
Energy: 1.3029260910463485
Energy: 1.3492903457539782
Energy: 1.2377519544277638
Energy: 1.3492903457539782
Energy: 1.2375911903011971
Energy: 1.4848532849861062
Energy: 1.2378250784079454
Energy: 1.4848532849861062
Energy: 1.2375911903011971
Energy: 1.4848532849861062
Energy: 1.230195825763453
Energy: 1.349209259310578
Energy: 1.2374465734673097
Energy: 1.349209259310578
Energy: 1.230195825763453
Energy: 1.349209259312207
Energy: 1.2628346388326688
Energy: 1.3536857626726448
Energy: 1.238101195918687
Energy: 1.3536857626433625
Energy: 1.2628346388310399
Energy: 1.3536857625798744
Energy: 1.3943916851249931
Energy: 1.388126592676089
Energy: 1.497019526373713
Energy: 1.388126592676089
Energy: 1.3943916851249931
Energy: 1.3881265926777178
Energy: 1.2626425978737466
Energy: 1.3918357090881672
Energy: 1.2378039652453223
Energy: 1.3918357090881672
Energy: 1.2626425978737466
Energy: 1.3918357090881672
Energy: 1.3029260910447198
Energy: 1.3492903457539782
Energy: 1.2377519544277638
Energy: 1.3492903457539782
Energy: 1.3029260910463485
Energy: 1.3492903457539782
Energy: 1.2378250784079454
Energy: 1.4848532849861062
Energy: 1.2375911903011971
Energy: 1.6182625429686346
Energy: 1.2378250784079454
Energy: 1.4848532849861062
Energy: 1.2374465734673097
Energy: 1.349209259310578
Energy: 1.230195825765082
Energy: 1.349209259310578
Energy: 1.2374465734689384
Energy: 1.349209259310578

minimum gb energy = 1.230195825763453 eV
minimum distance =  2.2578431428785 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.3969845817951567
Energy: 1.6732594711310518
Energy: 1.506831140600492
Energy: 1.6732594711323816
Energy: 1.3969845821155233
Energy: 1.6732594711323816
Energy: 1.3060315574119268
Energy: 1.480662762550921
Energy: 1.3669778146741542
Energy: 1.480662758988228
Energy: 1.3060315574119268
Energy: 1.4806627659381213
Energy: 1.3996646535259054
Energy: 1.401731580314589
Energy: 1.3597755534053444
Energy: 1.4017315803159192
Energy: 1.3996646535259054
Energy: 1.401731580314589
Energy: 1.3920871196659599
Energy: 1.4145826173784461
Energy: 1.3216436331336296
Energy: 1.4145826173784461
Energy: 1.3920871196659599
Energy: 1.4145826173784461
Energy: 1.3214796955102077
Energy: 1.5317228741427071
Energy: 1.3664706353826408
Energy: 1.5317228741413773
Energy: 1.3214796955115375
Energy: 1.5317228741427071
Energy: 1.3921705955630224
Energy: 1.4465177611579494
Energy: 1.7870080611257066
Energy: 1.4465177611552893
Energy: 1.3921705955630224
Energy: 1.4465177611566193
Energy: 1.4017432221587913
Energy: 1.5082072467605117
Energy: 1.358777010299905
Energy: 1.5082072467618417
Energy: 1.4017432221561315
Energy: 1.5082072467618417
Energy: 1.342535092423081
Energy: 1.390811804754396
Energy: 1.3797055637994728
Energy: 1.390811804754396
Energy: 1.342535092423081
Energy: 1.3908118047703553
Energy: 1.3461666602115863
Energy: 1.6042139338377086
Energy: 1.3295152119623708
Energy: 1.6042139338377086
Energy: 1.3461666602075963
Energy: 1.6042139338377086
Energy: 1.3925384963511775
Energy: 1.6467911959086878
Energy: 1.3744351608605228
Energy: 1.6467911959100179
Energy: 1.3925384963498475
Energy: 1.6467911959100179
Energy: 1.3541503669937272
Energy: 1.4088304970327696
Energy: 1.36902641490402
Energy: 1.4088304970340995
Energy: 1.3541503669937272
Energy: 1.4088304970340995
Energy: 1.3516565555531197
Energy: 1.3802148252592026
Energy: 1.3359151073092932
Energy: 1.3802148252565427
Energy: 1.3516565555531197
Energy: 1.3802148253283297
Energy: 1.3647936664757256
Energy: 1.4159411047078947
Energy: 1.3477683844718071
Energy: 1.415941104650737
Energy: 1.3647936664757256
Energy: 1.4159411048341795
Energy: 1.35360196955902
Energy: 1.3878782916719428
Energy: 1.320313986524905
Energy: 1.3878782916772625
Energy: 1.35360196955902
Energy: 1.3878782916785928
Energy: 1.386827610930301
Energy: 1.4996817140667507
Energy: 1.3726337737052454
Energy: 1.4996817140680807
Energy: 1.386827610930301
Energy: 1.4996817140667507
Energy: 1.356297463797621
Energy: 1.5168678330937708
Energy: 1.328457927044205
Energy: 1.5168678330924408
Energy: 1.356297463797621
Energy: 1.5168678330924408
Energy: 1.342465980330106
Energy: 1.4063577881094196
Energy: 1.3334168721974273
Energy: 1.4063577890891694
Energy: 1.342465980330106
Energy: 1.406357788177217
Energy: 1.418661879876554
Energy: 1.5233283290600432
Energy: 1.3731893704506137
Energy: 1.523328329061373
Energy: 1.4186618798752242
Energy: 1.5233283290600432
Energy: 1.3539445339514469
Energy: 1.4296716304796182
Energy: 1.3148183688049755
Energy: 1.4296716304796182
Energy: 1.3539445339514469
Energy: 1.4296716304796182
Energy: 1.380951357737103
Energy: 1.5235246833324323
Energy: 1.3596618175504116
Energy: 1.5235246833337626
Energy: 1.380951357737103
Energy: 1.5235246833324323
Energy: 1.3520023357198365
Energy: 1.4019256900468755
Energy: 1.3446464790114585
Energy: 1.4019256900455455
Energy: 1.3520023357198365
Energy: 1.4019256900455455

minimum gb energy = 1.3060315574119268 eV
minimum distance =  2.27264001611769 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.5550958535653934
Energy: 1.426374004405358
Energy: 1.6174802426842234
Energy: 1.4263740042058877
Energy: 1.5538203364100625
Energy: 1.4263740043851791
Energy: 1.498954932113415
Energy: 1.3621449206082312
Energy: 1.332759913513951
Energy: 1.362144919716257
Energy: 1.4989549321145361
Energy: 1.3621449207863763
Energy: 1.3601580270560856
Energy: 1.3897004179544747
Energy: 1.3332284390316602
Energy: 1.389700417958959
Energy: 1.3601580270560856
Energy: 1.389700417956717
Energy: 1.4661560877871775
Energy: 1.5568863726460291
Energy: 1.5489278517010212
Energy: 1.5568863726460291
Energy: 1.4661560877871775
Energy: 1.5568863726460291
Energy: 1.330789593904823
Energy: 1.5564474245203084
Energy: 1.3796740219680337
Energy: 1.5564474245203084
Energy: 1.330789593904823
Energy: 1.5564474245191873
Energy: 1.4398175786060774
Energy: 1.4363542295947147
Energy: 1.370642557026258
Energy: 1.4363542296092886
Energy: 1.4398175786060774
Energy: 1.4363542296384102
Energy: 1.357398602136529
Energy: 1.5004410817808909
Energy: 1.3602630063584311
Energy: 1.5004410817775276
Energy: 1.3573986021354076
Energy: 1.5004410817808909
Energy: 1.4479142531032945
Energy: 1.5161276725412878
Energy: 1.3576404380791671
Energy: 1.5161276725412878
Energy: 1.4479142531032945
Energy: 1.5161276725412878
Energy: 1.4879176259757223
Energy: 1.5582463908110775
Energy: 1.3924991099759352
Energy: 1.5582463908110775
Energy: 1.4879176257381872
Energy: 1.5582463908110775
Energy: 1.433488866730571
Energy: 1.6178478417441398
Energy: 1.3690906911096143
Energy: 1.6178478417430189
Energy: 1.433488866730571
Energy: 1.617847841745261
Energy: 1.3680221302440467
Energy: 1.3942266824213432
Energy: 1.3946917861839296
Energy: 1.3942266824504908
Energy: 1.3680221301544135
Energy: 1.3942266824303116
Energy: 1.4229304585702442
Energy: 1.58399770024361
Energy: 1.3910371918976192
Energy: 1.58399770024361
Energy: 1.422930458621787
Energy: 1.5839977002447312
Energy: 1.424351344222004
Energy: 1.6101472432544448
Energy: 1.3655346074605053
Energy: 1.6101472432555657
Energy: 1.424351344222004
Energy: 1.6101472432544448
Energy: 1.378556506947257
Energy: 1.561571323171698
Energy: 1.3810216687954044
Energy: 1.5615713231706023
Energy: 1.378556506947257
Energy: 1.561571323171698
Energy: 1.4431985136728191
Energy: 1.434367301334099
Energy: 1.3564253772493633
Energy: 1.434367301334099
Energy: 1.4431985136728191
Energy: 1.434367301334099
Energy: 1.3144071966019586
Energy: 1.5564474245180662
Energy: 1.3446411846978454
Energy: 1.5564474245169453
Energy: 1.3144071966019586
Energy: 1.5564474245169453
Energy: 1.4651854888821023
Energy: 1.542735401949537
Energy: 1.3206870368581656
Energy: 1.5427354019506578
Energy: 1.4651854888821023
Energy: 1.542735401949537
Energy: 1.3461135596170783
Energy: 1.375556237151582
Energy: 1.3518638416703928
Energy: 1.3755562371627923
Energy: 1.3461135596170783
Energy: 1.3755562371448555
Energy: 1.4098146020480857
Energy: 1.341619460145218
Energy: 1.3302627175765285
Energy: 1.3416194614865296
Energy: 1.4098146020480857
Energy: 1.3416194603805367
Energy: 1.5542449704930585
Energy: 1.4263740034943517
Energy: 1.5751786083136001
Energy: 1.42637400348202
Energy: 1.5542430216429206
Energy: 1.426374003776729
Energy: 1.4989549321145361
Energy: 1.3621449116908584
Energy: 1.332759913516193
Energy: 1.3621449107092511
Energy: 1.4989549321145361
Energy: 1.3621449116617368
Energy: 1.3601580270560856
Energy: 1.389700417958959
Energy: 1.3332284390316602
Energy: 1.38970041796008
Energy: 1.3601580270560856
Energy: 1.38970041796008
Energy: 1.4661560877871775
Energy: 1.5568863726460291
Energy: 1.5489278517010212
Energy: 1.5568863726460291
Energy: 1.4661560877871775
Energy: 1.5568863726460291
Energy: 1.330789593904823
Energy: 1.5564474245225506
Energy: 1.3796740219680337
Energy: 1.5564474245214297
Energy: 1.330789593904823
Energy: 1.5564474245225506
Energy: 1.4398175786049565
Energy: 1.436354229567835
Energy: 1.370642557026258
Energy: 1.4363542295823832
Energy: 1.4398175786049565
Energy: 1.4363542295375666

minimum gb energy = 1.3144071966019586 eV
minimum distance =  2.27062752739711 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.7948852923135346
Energy: 1.3920559494817892
Energy: 1.3187448109126276
Energy: 1.392055949461468
Energy: 1.7948852923135346
Energy: 1.3920559494488882
Energy: 1.292087662356171
Energy: 1.4645021637760094
Energy: 1.25294741962041
Energy: 1.464502163777945
Energy: 1.2920876623639126
Energy: 1.4645021637750417
Energy: 1.2668288040662563
Energy: 1.4922588457139843
Energy: 1.2598676623819955
Energy: 1.492258845714952
Energy: 1.2668288040662563
Energy: 1.492258845714952
Energy: 1.4734253581856132
Energy: 1.490884906785946
Energy: 1.3002320602642834
Energy: 1.490884906785946
Energy: 1.4734253581856132
Energy: 1.490884906785946
Energy: 1.2905173552249039
Energy: 1.469355978730168
Energy: 1.3052611848419091
Energy: 1.469355978730168
Energy: 1.2905173552249039
Energy: 1.4693559787311359
Energy: 1.3250876886744523
Energy: 1.455975851735028
Energy: 1.296902410263908
Energy: 1.455975851735028
Energy: 1.3250876845500879
Energy: 1.455975851735028
Energy: 1.2893711441760425
Energy: 1.5301076617372509
Energy: 1.3042913409414716
Energy: 1.5301076617362834
Energy: 1.2893711441760425
Energy: 1.5301076617362834
Energy: 1.2993622094077961
Energy: 1.4455623626437852
Energy: 1.3054014275655914
Energy: 1.4455623626447531
Energy: 1.2993622094077961
Energy: 1.4455623626447531
Energy: 1.2899265183502995
Energy: 1.4941344022657592
Energy: 1.3514676857726442
Energy: 1.4941344022657592
Energy: 1.289926518351267
Energy: 1.4941344022657592
Energy: 1.2979140243533214
Energy: 1.3946295508608888
Energy: 1.2528995662633926
Energy: 1.3946295508599211
Energy: 1.2979140243533214
Energy: 1.3946295508599211
Energy: 1.4847411184702142
Energy: 1.5267575271110627
Energy: 1.2992798953102507
Energy: 1.5267575271120306
Energy: 1.4847411184711818
Energy: 1.5267575271110627
Energy: 1.2964296371025914
Energy: 1.5512698393750473
Energy: 1.2516158702091529
Energy: 1.5512698393760147
Energy: 1.2964296366199166
Energy: 1.5512698393750473
Energy: 1.299463308324176
Energy: 1.5050781471999435
Energy: 1.2538396662712965
Energy: 1.5050778767875697
Energy: 1.299463308324176
Energy: 1.505078592332659
Energy: 1.3075231441862518
Energy: 1.5244776415778851
Energy: 1.364629900566769
Energy: 1.5244776415778851
Energy: 1.3075231441862518
Energy: 1.5244776415778851
Energy: 1.2949962948865983
Energy: 1.5046117257352543
Energy: 1.2542024092998831
Energy: 1.5046117257352543
Energy: 1.2949962948865983
Energy: 1.5046117257362221
Energy: 1.287436430542027
Energy: 1.4851486587722822
Energy: 1.255930150142106
Energy: 1.4851486587713145
Energy: 1.287436430542027
Energy: 1.4851486587713145
Energy: 1.3039699906503017
Energy: 1.4513519952501304
Energy: 1.2554283316798032
Energy: 1.4513519952501304
Energy: 1.303969990656108
Energy: 1.4513519952501304
Energy: 1.301145732558924
Energy: 1.5625994982085702
Energy: 1.2541932043816173
Energy: 1.5625994982085702
Energy: 1.301145732558924
Energy: 1.5625994982085702
Energy: 1.3034416436907477
Energy: 1.4512497512724831
Energy: 1.3473468240397297
Energy: 1.4512497512724831
Energy: 1.3034416436897798
Energy: 1.4512497512724831
Energy: 1.287437293339474
Energy: 1.4868656409654024
Energy: 1.2556536702740246
Energy: 1.4868656409634669
Energy: 1.287437293339474
Energy: 1.4868656409634669
Energy: 1.2926133331744039
Energy: 1.5014035195453947
Energy: 1.2543288372873413
Energy: 1.5014035195463404
Energy: 1.2926133331744039
Energy: 1.5014035195463404
Energy: 1.3109360140702535
Energy: 1.5244790572868707
Energy: 1.4882143678249176
Energy: 1.5244790572868707
Energy: 1.3109360140702535
Energy: 1.5244790572868707
Energy: 1.3169418951396932
Energy: 1.4174286890643217
Energy: 1.2540443694495735
Energy: 1.4174286890662569
Energy: 1.316941895140661
Energy: 1.4174286890672247
Energy: 1.3018170784460228
Energy: 1.5520297417180346
Energy: 1.2514351255967329
Energy: 1.5520297417248086
Energy: 1.3018170784469905
Energy: 1.55202974173255
Energy: 1.4688781818397507
Energy: 1.5250965334456952
Energy: 1.3022458772855434
Energy: 1.5250965334456952
Energy: 1.4688781818397507
Energy: 1.5250965334447273
Energy: 1.2995415303604159
Energy: 1.3699351382934177
Energy: 1.2527956769968513
Energy: 1.3699351382818052
Energy: 1.2995415303604159
Energy: 1.3699351383533698
Energy: 1.2941752083069527
Energy: 1.4939915017678809
Energy: 1.3547406691743742
Energy: 1.4939915017678809
Energy: 1.2941752083069527
Energy: 1.4939915017678809
Energy: 1.2966047825480678
Energy: 1.4456679699693429
Energy: 1.3068465994759881
Energy: 1.4456679699693429
Energy: 1.2966047825480678
Energy: 1.4456679699693429
Energy: 1.3095486439882462
Energy: 1.5301076617353158
Energy: 1.2964476762183537
Energy: 1.5301076617353158
Energy: 1.3095486439882462
Energy: 1.5301076617353158

minimum gb energy = 1.2514351255967329 eV
minimum distance =  2.2570605502034 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.4072544288935973
Energy: 1.5472088988847157
Energy: 1.3527758048648881
Energy: 1.5472088988847157
Energy: 1.4072547187160784
Energy: 1.5472088988847157
Energy: 1.2562227744034107
Energy: 1.449070464842342
Energy: 1.244932555576599
Energy: 1.4490704648721142
Energy: 1.2562227744042613
Energy: 1.4490704648712636
Energy: 1.230568292558548
Energy: 1.4872308008270236
Energy: 1.241174679140169
Energy: 1.4872308008261728
Energy: 1.230568292558548
Energy: 1.487230800827874
Energy: 1.236492218946135
Energy: 1.4427958542303303
Energy: 1.2507615148699591
Energy: 1.4427958542303303
Energy: 1.2364922189469854
Energy: 1.4427958542294799
Energy: 1.214509254987652
Energy: 1.4699728926633944
Energy: 1.225271068897699
Energy: 1.469972892665096
Energy: 1.214509254987652
Energy: 1.469972892665096
Energy: 1.2891363096715465
Energy: 1.430248165091088
Energy: 1.2949539332574924
Energy: 1.4302481650902377
Energy: 1.2891363096715465
Energy: 1.4302481650902377
Energy: 1.224450906444531
Energy: 1.5103786734831386
Energy: 1.2209063974810421
Energy: 1.5103786734831386
Energy: 1.224450906444531
Energy: 1.5103786734831386
Energy: 1.2256078886007986
Energy: 1.4275352391549283
Energy: 1.230485984715069
Energy: 1.4275352391549283
Energy: 1.2256078886007986
Energy: 1.4275352391557787
Energy: 1.2170723336907545
Energy: 1.4238080180668156
Energy: 1.234458812164777
Energy: 1.4238080180668156
Energy: 1.2170723336907545
Energy: 1.4238080180668156
Energy: 1.2170421634751056
Energy: 1.4537050133120704
Energy: 1.2251677122725673
Energy: 1.4537050133120704
Energy: 1.2170421634751056
Energy: 1.4537050132984604
Energy: 1.25296908708746
Energy: 1.4377573844262455
Energy: 1.3007673486261608
Energy: 1.4377573844262455
Energy: 1.25296908708746
Energy: 1.4377573844262455
Energy: 1.2461273974920586
Energy: 1.527997483244148
Energy: 1.2194556835977715
Energy: 1.527997483221181
Energy: 1.2461273974920586
Energy: 1.5279974832228822
Energy: 1.2408613784206541
Energy: 1.433392610592117
Energy: 1.437881721164453
Energy: 1.4333926105938186
Energy: 1.2408613784206541
Energy: 1.4333926105912667
Energy: 1.2627157677628489
Energy: 1.3391145033894294
Energy: 1.2653109313346107
Energy: 1.3391145066544123
Energy: 1.2627157677628489
Energy: 1.3391145019601243
Energy: 1.2288873565352618
Energy: 1.3370444262737209
Energy: 1.2497870364142185
Energy: 1.3370444062330613
Energy: 1.2288873565361125
Energy: 1.3370444193814988
Energy: 1.2624152351620619
Energy: 1.5197949853941863
Energy: 1.2299262296016422
Energy: 1.5197949853941863
Energy: 1.2624152351671658
Energy: 1.5197949853941863
Energy: 1.2200762884241767
Energy: 1.4734034890552095
Energy: 1.2208401752470042
Energy: 1.4734034890552095
Energy: 1.220076288423326
Energy: 1.4734034890552095
Energy: 1.2319108201361237
Energy: 1.3658225944289513
Energy: 1.2171863910314578
Energy: 1.3658225948370646
Energy: 1.2319108201361237
Energy: 1.3658225943396731
Energy: 1.2311394826203435
Energy: 1.417909344155739
Energy: 1.281650133437807
Energy: 1.417909344155739
Energy: 1.2311394826186421
Energy: 1.417909344155739
Energy: 1.2221128320985895
Energy: 1.5355452045040463
Energy: 1.217102191606415
Energy: 1.5355452045040463
Energy: 1.2221128320985895
Energy: 1.5355452045040463
Energy: 1.2283713195488666
Energy: 1.3689433661211554
Energy: 1.229022553533702
Energy: 1.3689433661186035
Energy: 1.2283713195471655
Energy: 1.3689433661177528
Energy: 1.4488390598115493
Energy: 1.4236515516440138
Energy: 1.217089156952637
Energy: 1.4236515516448647
Energy: 1.4488390598115493
Energy: 1.4236515516440138
Energy: 1.2274777373865071
Energy: 1.4403820921419586
Energy: 1.2143818729589964
Energy: 1.4403820921419586
Energy: 1.2274777373865071
Energy: 1.4403820921419586
Energy: 1.2365164291690747
Energy: 1.467349252056449
Energy: 1.3709117310793313
Energy: 1.467349252056449
Energy: 1.236516429168224
Energy: 1.467349252056449
Energy: 1.2169517175483033
Energy: 1.4211480976175646
Energy: 1.2218709328485815
Energy: 1.4211480975937465
Energy: 1.216951717547453
Energy: 1.421148097602253
Energy: 1.2586019913684439
Energy: 1.4915159531874516
Energy: 1.240839903683677
Energy: 1.491515954352324
Energy: 1.2586019913667426
Energy: 1.4915159541856373
Energy: 1.2614859265078815
Energy: 1.2230471316061164
Energy: 1.222658910279632
Energy: 1.223047123896817
Energy: 1.2614859265019271
Energy: 1.223047138361463
Energy: 1.2560177707972977
Energy: 1.2224019958706458
Energy: 1.22280313964363
Energy: 1.2224019958723469
Energy: 1.2560177706969609
Energy: 1.2224019958672432
Energy: 1.3339857877019925
Energy: 1.4329248214816528
Energy: 1.6516681959305493
Energy: 1.4329248236769965
Energy: 1.333985787702843
Energy: 1.4329248228811853
Energy: 1.2168012223756783
Energy: 1.3842024004082305
Energy: 1.2244490246607003
Energy: 1.3842024004141849
Energy: 1.2168012223756783
Energy: 1.3842024004099316
Energy: 1.2177631624066587
Energy: 1.48420173652558
Energy: 1.230518422575021
Energy: 1.4842017365247295
Energy: 1.2177631624075096
Energy: 1.4842017365247295
Energy: 1.24002073844694
Energy: 1.4147960847428414
Energy: 1.3083785437531452
Energy: 1.4147960847428414
Energy: 1.24002073844694
Energy: 1.4147960847428414
Energy: 1.2144983719006088
Energy: 1.5047174862711847
Energy: 1.2244034886859256
Energy: 1.5047174862711847
Energy: 1.2144983719006088
Energy: 1.5047174862703343

minimum gb energy = 1.2143818729589964 eV
minimum distance =  2.26318186913339 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.014951354439925894
Energy: 0.015394783512186873
Energy: 1.5365118065700225
Energy: 0.015394783509438332
Energy: 0.014951354439258392
Energy: 0.015394783508731564
Energy: 0.015238580817390653
Energy: 0.6921850908199084
Energy: 0.015238580816683885
Energy: 0.6921850908199084
Energy: 0.015238580817390653
Energy: 0.6921850908199084
Energy: 1.5365118065700225
Energy: 0.015394783509438332
Energy: 0.014951354439925894
Energy: 0.015394783508024798
Energy: 1.53651180657069
Energy: 0.015394783508731564
Energy: 0.015238580817390653
Energy: 0.6921850908199084
Energy: 0.015238580817390653
Energy: 0.6921850908199084
Energy: 0.015238580817390653
Energy: 0.6921850908199084

minimum gb energy = 0.014951354439258392 eV
minimum distance =  2.45897522123253 Angstroms
sigma value = 1