Model name: model_name=Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Fe__MO_331285495617_004
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.882650256156921
cohesive_energy=3.880282732726341
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.7940372859215e-19, 2.49059959931934e-19, 3.04448808345948e-19, 3.5054022575285995e-19, 3.8937698736101997e-19, 4.22655798225834e-19, 4.5148536457803e-19, 4.76625118142124e-19, 4.98618196797042e-19, 5.1806061025063195e-19, 5.351942871746279e-19, 5.50177843055796e-19, 5.632163565032879e-19, 5.74481260416942e-19, 5.841183528704519e-19, 5.92249399288002e-19, 5.9919002846649e-19, 6.05316751914906e-19, 6.102338320046519e-19, 6.14223251823312e-19, 6.175381552790579e-19, 6.19846891808652e-19, 6.211991288877479e-19, 6.21641329638732e-19, 6.21165483178434e-19, 6.19620984903258e-19, 6.1681397144049e-19, 6.125089228249319e-19, 6.06422253792366e-19, 5.982159050730179e-19, 5.874765150953159e-19, 5.742681709246199e-19, 5.5766641664311195e-19, 5.36772431159118e-19, 5.10663360731454e-19, 4.78184036007006e-19, 4.383026552334779e-19, 3.8972305751396396e-19, 3.29320998412164e-19, 2.5402830967396797e-19, 1.59806705093379e-19, 4.1228490887395196e-20, -1.0856605220245438e-19, -2.99964315947382e-19, -5.45843955260826e-19, -8.640762891890759e-19, -1.2881323897930258e-18, -1.86313916414592e-18, -2.6623369127178e-18, -3.81120971166018e-18, -5.529800499886619e-18, -8.23842429556068e-18, -1.2845611380758399e-17, -2.15878881841794e-17]
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: 0.013312883098954353
Energy: 0.14503905848042362
Energy: 0.03141729892645956
Energy: 0.03122231550122182
Energy: 0.14264514878176737
Energy: 0.03313566164411334
Energy: 0.14425117890627956
Energy: 0.031361743052394156
Energy: 0.03208727288726382
Energy: 0.016774862219271415
Energy: 0.03231539467444885
Energy: 0.03163133509130537
Energy: 0.14738678037422415
Energy: 0.015229326379739882
Energy: 0.01496928000363336
Energy: 0.032705373382795555
Energy: 0.03154298048153253
Energy: 0.14653987649539932
Energy: 0.03681161940432556
Energy: 0.1408660127871818
Energy: 0.030865324277706878
Energy: 0.0344410144103655
Energy: 0.13916565085584126
Energy: 0.017805470191391396
Energy: 0.031879150188478894
Energy: 0.14113968824102638
Energy: 0.018120817887536198
Energy: 0.013641024774433727
Energy: 0.14433040895285662
Energy: 0.03205632231185814
Energy: 0.015764661096011153
Energy: 0.14118726543089538
Energy: 0.0329819597403354
Energy: 0.030865991390996265
Energy: 0.03219492941424797
Energy: 0.03623009944131655
Energy: 0.014681237050208159
Energy: 0.0209934840476564
Energy: 0.03088613629865801
Energy: 0.023442816787880644
Energy: 0.016369146203840952
Energy: 0.031151859427595678
Energy: 0.030816114578619404
Energy: 0.019561375739447846
Energy: 0.01397749697522979
Energy: 0.03492246255558961
Energy: 0.03148726431881989
Energy: 0.031132146738492926
Energy: 0.03435308317702632
Energy: 0.01391882815752864
Energy: 0.031135421094864002
Energy: 0.03244665193488372
Energy: 0.14144732298547072
Energy: 0.014056343524073233
Energy: 0.02110440136073633
Energy: 0.031021633142110774
Energy: 0.021596664970196352
Energy: 0.01577615655255208
Energy: 0.14044909518212195
Energy: 0.032878456888413926
Energy: 0.021592535827321485
Energy: 0.13955776229074388
Energy: 0.03572258783380072
Energy: 0.14924328853950133
Energy: 0.03113671644939495
Energy: 0.03351776055409657
Energy: 0.013706187174471127
Energy: 0.016560069836063084
Energy: 0.150462134327511
Energy: 0.031632335137635866

minimum gb energy = 0.013312883098954353 eV
minimum distance =  2.49548858829239 Angstroms
sigma value = 3


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

Energy: 1.588244559142822
Energy: 1.3766069816086823
Energy: 1.3238065114978768
Energy: 1.2678716370688137
Energy: 1.3757241189213878
Energy: 1.3635256239231242
Energy: 1.3266348009558409
Energy: 1.324239975212053
Energy: 1.324832192995139
Energy: 1.548673155856645
Energy: 1.26717593951722
Energy: 1.3232329073233415
Energy: 1.3681215265018523
Energy: 1.4194668580057923
Energy: 1.37244921850262
Energy: 1.3256986411969258
Energy: 1.3240679714177925
Energy: 1.3576858052865646
Energy: 1.3612792199163941
Energy: 1.3740325945858536
Energy: 1.3079937100510062
Energy: 1.2751719776287656
Energy: 1.3686065368549816
Energy: 1.3144108048396008
Energy: 1.3241867322072203
Energy: 1.3684687014069776
Energy: 1.4171084306519153
Energy: 1.3702425644824463
Energy: 1.3747793199471425
Energy: 1.3241887732681763
Energy: 1.4585791956969671
Energy: 1.372141129654955
Energy: 1.3735884548705475
Energy: 1.2735992933708102
Energy: 1.2720678930813745
Energy: 1.3712725386967588
Energy: 1.3618557061898469
Energy: 1.328121909899446
Energy: 1.3675142560033993
Energy: 1.417829908939296
Energy: 1.4284054602418008
Energy: 1.3256532141870438
Energy: 1.4178298389078337
Energy: 1.446004843277804
Energy: 1.3256133496305624
Energy: 1.35818955197004
Energy: 1.3240156140027988
Energy: 1.2702757756837393
Energy: 1.2738169158640906
Energy: 1.2710760695463945
Energy: 1.3406984734673495
Energy: 1.275283464497997
Energy: 1.2602957600025013
Energy: 1.280244221310511
Energy: 1.3246082262068348
Energy: 1.3620917037292013
Energy: 1.3241238301300755
Energy: 1.2599344595270203
Energy: 1.273671974134647
Energy: 1.271926045832933
Energy: 1.268381206618832
Energy: 1.2724657027950836
Energy: 1.2781511654295181
Energy: 1.2716957110119633
Energy: 1.2708511598164678
Energy: 1.2632891306029894
Energy: 1.3074092633904062
Energy: 1.356292390930818
Energy: 1.27165325683776
Energy: 1.3054588673083896
Energy: 1.2832219423611801
Energy: 1.2789333008470998
Energy: 1.2795303123491422
Energy: 1.2746211112668888
Energy: 1.2608077282053483
Energy: 1.2594734606182412
Energy: 1.2578613738095175
Energy: 1.3150641184051277
Energy: 1.2823020469371524
Energy: 1.2730896768171527
Energy: 1.2662027215853193
Energy: 1.304938568787528
Energy: 1.2606014111394361
Energy: 1.2577364646068974
Energy: 1.2593414802757326
Energy: 1.275789166352546
Energy: 1.274812337360166
Energy: 1.308882738663573
Energy: 1.2686756696596375
Energy: 1.2603908734704636
Energy: 1.3089847996156583
Energy: 1.3258997916625272
Energy: 1.2592764217288543
Energy: 1.268215430515335
Energy: 1.2717947645217889
Energy: 1.2779458207995211
Energy: 1.2731721981812412
Energy: 1.2751509245380783
Energy: 1.2595888531731299
Energy: 1.3096033588698215
Energy: 1.261824663598898
Energy: 1.3073433989215033
Energy: 1.326336599510846
Energy: 1.2719907525369472
Energy: 1.2705646607004584
Energy: 1.3047551861920867
Energy: 1.2825158525361438
Energy: 1.2772975232926829
Energy: 1.2728615131365997
Energy: 1.2711097553827095
Energy: 1.2587669508686752
Energy: 1.269205088079035
Energy: 1.3237046529514982
Energy: 1.325463387637688
Energy: 1.3264572248915645
Energy: 1.381761278727125
Energy: 1.364216521491323
Energy: 1.3274808972189507
Energy: 1.3254447175261284
Energy: 1.3178637963175097
Energy: 1.3675436844275723
Energy: 1.2577752655187566
Energy: 1.314113553012778
Energy: 1.364711379439969
Energy: 1.2745966649663205
Energy: 1.3273046738541106
Energy: 1.3685313414051201
Energy: 1.3768572699972137
Energy: 1.3312555662005041
Energy: 1.3807185395674333
Energy: 1.369940693743207
Energy: 1.3806429411910581
Energy: 1.3819368651169643
Energy: 1.3761232713760247
Energy: 1.3143115605215563
Energy: 1.3488765214760277
Energy: 1.3724552319587462
Energy: 1.261160585440981
Energy: 1.3067877818959166
Energy: 1.4446139766223067
Energy: 1.369124494338638
Energy: 1.3269098769470962
Energy: 1.3247300347909223
Energy: 1.3244364817181133
Energy: 1.3804482719112463
Energy: 1.385463381201874
Energy: 1.3285134434078958
Energy: 1.2618118714303697
Energy: 1.2691901132681764
Energy: 1.3767899541752302
Energy: 1.3266963968045467
Energy: 1.324709122542988
Energy: 1.2614593286134148
Energy: 1.3277911105593136
Energy: 1.3717290260007013
Energy: 1.3960736082341694
Energy: 1.3236404032643752
Energy: 1.562875218994042
Energy: 1.4416124422427523
Energy: 1.3724337907941622
Energy: 1.3673895077131226
Energy: 1.4151315062114076
Energy: 1.3684630190962639
Energy: 1.374522855296939
Energy: 1.3236426430447132
Energy: 1.2720364129992452
Energy: 1.2687494768538685
Energy: 1.345197488661776
Energy: 1.3135350896242903
Energy: 1.3784536708072106
Energy: 1.3271465135600764
Energy: 1.3193828172010358
Energy: 1.442234888216991
Energy: 1.3665739708959717
Energy: 1.4217713809460453
Energy: 1.3231244674057665
Energy: 1.3712296292293344
Energy: 1.3719628692560666
Energy: 1.2743245806118553
Energy: 1.273283208885104
Energy: 1.3270002555245215
Energy: 1.3260442450795142
Energy: 1.2725524182962829
Energy: 1.267159810554345
Energy: 1.2585960938894194
Energy: 1.445544532829915
Energy: 1.4162870292519705
Energy: 1.4219039018065383
Energy: 1.4431729506795854
Energy: 1.3245250969449156
Energy: 1.3596808279706127
Energy: 1.3232466113277577
Energy: 1.257900008339406
Energy: 1.272820232810466
Energy: 1.2745132780491308
Energy: 1.274460229332659
Energy: 1.2745969079358745
Energy: 1.3277469594787428
Energy: 1.2730341698577792
Energy: 1.3286320903648556
Energy: 1.320311614367196
Energy: 1.2726053291628083
Energy: 1.3258187377464952
Energy: 1.2679653217517717
Energy: 1.2682706721432606
Energy: 1.2744295408242816
Energy: 1.2710781409494056
Energy: 1.2794944499835255
Energy: 1.2772414891126393
Energy: 1.2708377310800387
Energy: 1.2626569655266149
Energy: 1.2581141766058066
Energy: 1.3138682468429694
Energy: 1.2822940182991114
Energy: 1.274751751156116
Energy: 1.2643389484243506
Energy: 1.2779656811279894
Energy: 1.2804596415271159
Energy: 1.2715623465988237
Energy: 1.2745217643859372
Energy: 1.2763185912946038
Energy: 1.2749375165921328
Energy: 1.2688132641195229
Energy: 1.2678970706162525
Energy: 1.2594466841718335
Energy: 1.3043649847226257
Energy: 1.2720315171435153
Energy: 1.2612059183968602
Energy: 1.2579567978573094
Energy: 1.2582714551933465
Energy: 1.2766631942893867
Energy: 1.2718128035656504
Energy: 1.2779373585581497
Energy: 1.2711708297243691
Energy: 1.312331372728398
Energy: 1.275910818225387
Energy: 1.3239920205977742
Energy: 1.259285772279565
Energy: 1.2672048108653962
Energy: 1.2738460302213563
Energy: 1.3073403639084746
Energy: 1.280224790371975
Energy: 1.2794641724674742
Energy: 1.2793273824029125
Energy: 1.2701994511574344
Energy: 1.2602712191681378
Energy: 1.3076031265441879
Energy: 1.3264236872845219
Energy: 1.2678533642018333
Energy: 1.3273957790214188
Energy: 1.3824344698278495
Energy: 1.3607388852636317
Energy: 1.3281326065192098
Energy: 1.323876881327173
Energy: 1.313909379467461
Energy: 1.273900718340446
Energy: 1.2690669554756275
Energy: 1.324292717611044
Energy: 1.325662130813837
Energy: 1.3265389310351765
Energy: 1.3431605331067678
Energy: 1.4459831663623748
Energy: 1.3713115500642927
Energy: 1.2655633930333572
Energy: 1.3805996889045982
Energy: 1.3678168290670987
Energy: 1.2621765870961918
Energy: 1.3114794595031116
Energy: 1.3298596281362194
Energy: 1.275464595100305
Energy: 1.2695781375961168
Energy: 1.3753339954665875
Energy: 1.2624851062063045
Energy: 1.3090760395550098
Energy: 1.4394659416313733
Energy: 1.3683469139516897
Energy: 1.3813242482267878
Energy: 1.3824499912232513
Energy: 1.3739465178711034
Energy: 1.270293020660982
Energy: 1.411322181745818
Energy: 1.3284660540347066
Energy: 1.2639299719481276
Energy: 1.2702566845422736
Energy: 1.5629379485338672
Energy: 1.3702014891571421
Energy: 1.327429837749213
Energy: 1.3929081385150153
Energy: 1.324184112211249
Energy: 1.383141083524574

minimum gb energy = 1.2577364646068974 eV
minimum distance =  2.33183102655827 Angstroms
sigma value = 75


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

Energy: 1.3900487495832545
Energy: 1.3173174721241574
Energy: 1.3412728745658022
Energy: 1.2757116473672205
Energy: 1.3137560357551092
Energy: 1.2923400896249118
Energy: 1.3116728123145864
Energy: 1.2965178061701828
Energy: 1.3240959493840512
Energy: 1.3093123466072663
Energy: 1.3034105025361848
Energy: 1.3359521006179964
Energy: 1.341387727898122
Energy: 1.2909814954743053
Energy: 1.3152313500247457
Energy: 1.3403672390861494
Energy: 1.294590308481931
Energy: 1.2992476069848267
Energy: 1.297001443822398
Energy: 1.3180110633131672
Energy: 1.383407356937889
Energy: 1.296333656849088
Energy: 1.295640746568371
Energy: 1.289548165411978
Energy: 1.3249754141582362
Energy: 1.2983998492847
Energy: 1.3226836863920344
Energy: 1.3159159076721905
Energy: 1.2997136807560967
Energy: 1.3125241796906784
Energy: 1.3051591468890877
Energy: 1.3607939913877902
Energy: 1.2930958637485033
Energy: 1.3274487633879004
Energy: 1.288067072692103
Energy: 1.3172425858921861
Energy: 1.2999645044662733
Energy: 1.3889369798826392
Energy: 1.2926302401473593
Energy: 1.3109051334925674
Energy: 1.377799442504787
Energy: 1.296543676963479
Energy: 1.2968244600829897
Energy: 1.3267696039897923
Energy: 1.2962654119250945
Energy: 1.2975114765668871
Energy: 1.2974762471155783
Energy: 1.313053666195397
Energy: 1.3242074595482032
Energy: 1.2936188289403068
Energy: 1.2902409416508631
Energy: 1.3081377477303153
Energy: 1.2960052107871318
Energy: 1.2958964841084661
Energy: 1.3294504002906857
Energy: 1.291186348823715
Energy: 1.2947414512778628
Energy: 1.3006593776269384
Energy: 1.3004945071130498
Energy: 1.296512810246517
Energy: 1.3153411735315998
Energy: 1.2945391086583276
Energy: 1.3024709432914956
Energy: 1.3062495443171591
Energy: 1.3822203944022333
Energy: 1.3017437065607471
Energy: 1.3100715430383008
Energy: 1.2947745070193182
Energy: 1.2858695851086914
Energy: 1.2997415478923797
Energy: 1.288708277042333
Energy: 1.3075246841205042
Energy: 1.2955859271058285
Energy: 1.3015705973989515
Energy: 1.2969079668989811
Energy: 1.3043857206695824
Energy: 1.3292357778404649
Energy: 1.4308415869520392
Energy: 1.3257708531319194
Energy: 1.3547106023612123
Energy: 1.306130140664232
Energy: 1.3153729755162435
Energy: 1.3077270837987105
Energy: 1.2885863809563325
Energy: 1.3291661114160067
Energy: 1.321090917259794
Energy: 1.2988963889168392
Energy: 1.3086166466829379
Energy: 1.2823182973879188
Energy: 1.3880945365140913
Energy: 1.3005592880644634
Energy: 1.2343373097722217
Energy: 1.269120838779519
Energy: 1.287059844711374
Energy: 1.3104830848646967
Energy: 1.3625022099224813
Energy: 1.3320352504599855
Energy: 1.3445244747507683
Energy: 1.2983756070967836
Energy: 1.3344913545515122
Energy: 1.2877161312885412
Energy: 1.2654510090011961
Energy: 1.2651199448807868
Energy: 1.2910870969744295
Energy: 1.3318396557055494
Energy: 1.265852307421926
Energy: 1.3312268241350977
Energy: 1.2561251089528898
Energy: 1.3374686025944922
Energy: 1.3052048148434878
Energy: 1.3297217467844213
Energy: 1.3059585084874599
Energy: 1.277340976864859
Energy: 1.3380255720905052
Energy: 1.284603249639581
Energy: 1.2727732414823367
Energy: 1.322691416179009
Energy: 1.3241779679932144
Energy: 1.3004153023030496
Energy: 1.33416426295699
Energy: 1.3072016691060504
Energy: 1.3057169251860172
Energy: 1.3516082779650125
Energy: 1.3240981254344604
Energy: 1.2937743061394995
Energy: 1.2917844234433684
Energy: 1.331938081710341
Energy: 1.3244954952969565
Energy: 1.2992028177773485
Energy: 1.2895344650504847
Energy: 1.2887737398298043
Energy: 1.333636154693801
Energy: 1.3355560405737097
Energy: 1.2952250747868275
Energy: 1.3498668215773568
Energy: 1.3038617004878796
Energy: 1.3053932710621619
Energy: 1.3057266071655642
Energy: 1.3553635016943195
Energy: 1.3820955494284393
Energy: 1.3237291508928453
Energy: 1.2947476521625063
Energy: 1.3057054821041003
Energy: 1.3010225762035936
Energy: 1.3008439852245663
Energy: 1.30405628552477
Energy: 1.3017177510333537
Energy: 1.3045233497242543
Energy: 1.3051587385830385
Energy: 1.2928683714470315
Energy: 1.2932069474210084
Energy: 1.2965694662018534
Energy: 1.3221571748977639
Energy: 1.3420362978420235
Energy: 1.2801187810002996
Energy: 1.3131486698714283
Energy: 1.333913016930059
Energy: 1.2980945509501252
Energy: 1.2976091251343997
Energy: 1.2979717936541308
Energy: 1.2877350318380636
Energy: 1.2940169247704285
Energy: 1.2965195079955705
Energy: 1.2950472379079416
Energy: 1.2940756037816834
Energy: 1.339610831936463
Energy: 1.4112853999072885
Energy: 1.2968400981458186
Energy: 1.2947964264431984
Energy: 1.3026168994363163
Energy: 1.3563643576141209
Energy: 1.3651074731254338
Energy: 1.3166333301175621
Energy: 1.2844554834181918
Energy: 1.3561568495407512
Energy: 1.3567868092061555
Energy: 1.309701946682984
Energy: 1.3082456696094829
Energy: 1.3601452297368561
Energy: 1.4393890127304527
Energy: 1.2951838572577887
Energy: 1.3433429187283483
Energy: 1.3521131086633738
Energy: 1.328605485239008
Energy: 1.3404777459669626
Energy: 1.3641483515373294
Energy: 1.306161132212712
Energy: 1.3455236339909915
Energy: 1.3485389748871806
Energy: 1.2909757637152872
Energy: 1.2843920684276762
Energy: 1.3793872149373838
Energy: 1.3484195354097868
Energy: 1.290734868368012
Energy: 1.2894009867510714
Energy: 1.3061310486217392
Energy: 1.299280144036428
Energy: 1.32700822327186
Energy: 1.3107426662656836
Energy: 1.3312209626538627
Energy: 1.3579203107086237
Energy: 1.3083250209125805
Energy: 1.30226402893577
Energy: 1.2749855150713685
Energy: 1.2622536016819936
Energy: 1.3258496476690391
Energy: 1.3869819678735436
Energy: 1.3158495948992222
Energy: 1.3257412282509304
Energy: 1.2947981338497234
Energy: 1.3980719764668272
Energy: 1.3627490254210244
Energy: 1.3577772274145532
Energy: 1.3460775362038016
Energy: 1.3342289717863254
Energy: 1.3340554122273536
Energy: 1.2772981786842705
Energy: 1.3997247496857916
Energy: 1.3454586466615601
Energy: 1.3483580461435982
Energy: 1.4258212189303758
Energy: 1.324449485997561
Energy: 1.3570253787706021
Energy: 1.2884185578148641
Energy: 1.3099268953841412
Energy: 1.3516979609553876
Energy: 1.3214733706625659
Energy: 1.2994586977768143
Energy: 1.3065482342054766
Energy: 1.3240940442422702
Energy: 1.438631865283275
Energy: 1.2958929652309343
Energy: 1.3143425081816285
Energy: 1.310517028403054
Energy: 1.2854635166268067
Energy: 1.3243730604186177
Energy: 1.331406452370279
Energy: 1.3065440441400629
Energy: 1.3086987839298019
Energy: 1.3083286193238606
Energy: 1.3112258548979443
Energy: 1.2940445120986306
Energy: 1.3047981032755833
Energy: 1.3036043832717217
Energy: 1.2852184060714693
Energy: 1.3086551713053085
Energy: 1.3052067448622593
Energy: 1.3140495659146862
Energy: 1.3047650481913688
Energy: 1.3020967194399413
Energy: 1.3043649513898605
Energy: 1.307169310239631
Energy: 1.2953723236745145
Energy: 1.303097788549223
Energy: 1.3223365035287444
Energy: 1.2614440742346458
Energy: 1.3040949321470743
Energy: 1.347257911111046
Energy: 1.30646509419619
Energy: 1.3058154011781384
Energy: 1.3124381396106504
Energy: 1.3079755336520582
Energy: 1.296676572725209
Energy: 1.296129604902337
Energy: 1.2960777143864248
Energy: 1.326208274590992
Energy: 1.3127254015228207
Energy: 1.3167343669424383
Energy: 1.330184288749179
Energy: 1.314002731100257
Energy: 1.3329465726927763
Energy: 1.3334940298168485
Energy: 1.3818153962334587
Energy: 1.3583331913792993
Energy: 1.3141053526720379
Energy: 1.3079755549775074
Energy: 1.331464044707084
Energy: 1.333794309327356
Energy: 1.306444537899203
Energy: 1.3326095381464247
Energy: 1.3727541539438997
Energy: 1.3193601153550194
Energy: 1.3209259938452804
Energy: 1.3180137055248748
Energy: 1.388993733719705
Energy: 1.2343157612989393
Energy: 1.3315283810176375
Energy: 1.3070707757760474
Energy: 1.3635878235207606
Energy: 1.3496429569929975
Energy: 1.3464245107359263
Energy: 1.3814470068041975
Energy: 1.3025398560087542
Energy: 1.2960300995481147
Energy: 1.2690265792781759
Energy: 1.2556163782931618
Energy: 1.3358125815369952
Energy: 1.2949219185863625
Energy: 1.2804157949301815
Energy: 1.3197895499214356
Energy: 1.3777652389425374
Energy: 1.2968726367408543
Energy: 1.3042421142581002
Energy: 1.3550440887709092
Energy: 1.331030091485345
Energy: 1.2628058677122087
Energy: 1.3977727102331374
Energy: 1.3104172360088788
Energy: 1.29076586447489
Energy: 1.3149401937545775
Energy: 1.262384665548133
Energy: 1.3073636459213558
Energy: 1.3166791631463408
Energy: 1.3346653051657402
Energy: 1.2623134788742567
Energy: 1.2698870214201572
Energy: 1.3284868893954302
Energy: 1.3290096258384507
Energy: 1.3531697251101262
Energy: 1.3767833897048705
Energy: 1.3329090922148428
Energy: 1.303274319057425
Energy: 1.3176684065394468
Energy: 1.30736367298178
Energy: 1.289732333514382
Energy: 1.3230601119315777
Energy: 1.3476966505791874
Energy: 1.3301624456189844
Energy: 1.382300419960913
Energy: 1.3015862024379234
Energy: 1.3035444784784067
Energy: 1.3007568026039265
Energy: 1.300508452338719
Energy: 1.29583826453177
Energy: 1.3204582867543948
Energy: 1.2908438592189828
Energy: 1.2935459384440515
Energy: 1.3034434027549167
Energy: 1.3324825858763356
Energy: 1.3029752712094154
Energy: 1.3047247212997088
Energy: 1.2976669759060404
Energy: 1.2957056303879042
Energy: 1.2947473477549984
Energy: 1.299818139843757
Energy: 1.29769755225799
Energy: 1.3089420690454676
Energy: 1.3035564730133167
Energy: 1.3011767510674344
Energy: 1.3339867079206729
Energy: 1.2976246462477585
Energy: 1.2956911470695243
Energy: 1.3036837019932068
Energy: 1.3052038483156405
Energy: 1.2919127369301573
Energy: 1.295304949303991
Energy: 1.3353951199512357
Energy: 1.2950229033356973
Energy: 1.323075709601785
Energy: 1.3719296853467982
Energy: 1.316638930663023
Energy: 1.3135211519542087
Energy: 1.345617918445947
Energy: 1.3328557681513062
Energy: 1.2944005291535077
Energy: 1.2952693164944646
Energy: 1.2932687780568937
Energy: 1.2888749444999286
Energy: 1.356247067747964
Energy: 1.30521514693423
Energy: 1.2924240227533945
Energy: 1.2774997602124776
Energy: 1.3454551229619731
Energy: 1.31529445450108
Energy: 1.3032042387643303
Energy: 1.3183221348669036
Energy: 1.319170781522008
Energy: 1.3571894214033606
Energy: 1.3746206587887946
Energy: 1.306561738284298
Energy: 1.3006283899735884
Energy: 1.32314668575264
Energy: 1.3426172832633867
Energy: 1.3010333371404943
Energy: 1.371960305976545
Energy: 1.347237994052893
Energy: 1.2629366270250062
Energy: 1.31923141403634
Energy: 1.3089943207415715
Energy: 1.3017282400520025
Energy: 1.2644215296683048
Energy: 1.344816104688657
Energy: 1.2956282982373704
Energy: 1.2876983120724237
Energy: 1.3055975972135514
Energy: 1.3143788585843441
Energy: 1.2825968934063432
Energy: 1.3129147250265198
Energy: 1.3501117057678913
Energy: 1.3593451390551647
Energy: 1.275949934569195
Energy: 1.3340711476521068
Energy: 1.326245891951407
Energy: 1.293050805989058
Energy: 1.3079676027557372
Energy: 1.3646099728051537
Energy: 1.298738308505579
Energy: 1.3380703409088948
Energy: 1.33281865544151
Energy: 1.2856435513713447
Energy: 1.3000645682449148
Energy: 1.298192860402785
Energy: 1.3649578471264792
Energy: 1.3172342813064348
Energy: 1.3545753884626852
Energy: 1.3562668079373192
Energy: 1.3564534508992865
Energy: 1.3326120483243338
Energy: 1.3061674154436689
Energy: 1.3675568175214523
Energy: 1.3437943500923017
Energy: 1.3037154297482196
Energy: 1.3054595633290584
Energy: 1.3064650937646414
Energy: 1.3409577612944883
Energy: 1.3131992474947618
Energy: 1.3476038239331773
Energy: 1.3475644768473436
Energy: 1.2962468884611258
Energy: 1.3467600493696668
Energy: 1.3461858606130401
Energy: 1.3065974214124911
Energy: 1.303931158190776
Energy: 1.3047218901658189
Energy: 1.2972864294822266
Energy: 1.3062083049085316
Energy: 1.2995361618047168
Energy: 1.3194566507954724
Energy: 1.3038353635286906
Energy: 1.3074178934149279
Energy: 1.3000361497849229
Energy: 1.3443502278375883
Energy: 1.2970707413516431
Energy: 1.302963097458902
Energy: 1.305325365809878
Energy: 1.2986059570670831
Energy: 1.3028762132773721
Energy: 1.3000837676177939
Energy: 1.3153600379608628
Energy: 1.2778109086715426
Energy: 1.2562397274349155
Energy: 1.3921419999251547
Energy: 1.3052516618758832
Energy: 1.296728928105278
Energy: 1.306180855988609
Energy: 1.297306337095606
Energy: 1.2977027240930727
Energy: 1.3631456859314064
Energy: 1.2985852711590324
Energy: 1.2979670408946777
Energy: 1.3069133524189038
Energy: 1.310384344953652
Energy: 1.3080341756979872
Energy: 1.3110273510380763
Energy: 1.3687167499564208
Energy: 1.3587167130111193
Energy: 1.2966279111726573
Energy: 1.3103802923080876
Energy: 1.2537039327193837
Energy: 1.3064407250202457
Energy: 1.3292748417271585
Energy: 1.3094472702050528
Energy: 1.3381745596438208
Energy: 1.3622686351985913
Energy: 1.2902629955860894
Energy: 1.30124129034684
Energy: 1.2798512914129747
Energy: 1.3140848192565808
Energy: 1.259915658536172
Energy: 1.2887071702645834
Energy: 1.2806205838091764
Energy: 1.3061071369322454
Energy: 1.3357917345981236
Energy: 1.3003863894313705
Energy: 1.3581543381476942
Energy: 1.2856039717029055
Energy: 1.3358789037520207
Energy: 1.3061184070337262
Energy: 1.2306396657387266
Energy: 1.2689448173607567
Energy: 1.3054847481266207
Energy: 1.3707757284777278
Energy: 1.31605639973098
Energy: 1.289945769960038
Energy: 1.2975810709094557
Energy: 1.353871096494936
Energy: 1.2990758687240298
Energy: 1.34977499252111
Energy: 1.2560140924177279
Energy: 1.3369228599678742
Energy: 1.2816699232288677
Energy: 1.27727164371362
Energy: 1.2735117000922864
Energy: 1.309192167831161
Energy: 1.3128534894473873
Energy: 1.2966211763793098
Energy: 1.3242847917696534
Energy: 1.289681242487972
Energy: 1.3006237499577626
Energy: 1.2829663630108097
Energy: 1.3129681397134594
Energy: 1.3390043690106357
Energy: 1.2904981604328563
Energy: 1.3114634058614478
Energy: 1.3334566537789982
Energy: 1.2991809266953984
Energy: 1.301336324968718
Energy: 1.3035512828899545
Energy: 1.29641867293034
Energy: 1.3213341583630243
Energy: 1.3433168150369426
Energy: 1.3386740292584458
Energy: 1.2946352972509985
Energy: 1.2955947516124264
Energy: 1.2968668491404982
Energy: 1.310364909536192
Energy: 1.2929428813663888
Energy: 1.3177647790700837
Energy: 1.3154385984852455
Energy: 1.2918258644106506
Energy: 1.2957763137245812
Energy: 1.2949145448504682
Energy: 1.3385128340445915
Energy: 1.297198655864472
Energy: 1.2944934673992232
Energy: 1.3173545908447382
Energy: 1.2919817797537567
Energy: 1.293108969868002
Energy: 1.2920150400600865
Energy: 1.2881864977807196
Energy: 1.2919601265424487
Energy: 1.3111311828676169
Energy: 1.3610223289827788
Energy: 1.3213332720652922
Energy: 1.292523065472269
Energy: 1.2907094524424043
Energy: 1.2946809138593232
Energy: 1.2923559902854886
Energy: 1.295226915936798
Energy: 1.3183704325909842
Energy: 1.3063593236122173
Energy: 1.3405934781853936
Energy: 1.3128370690323243
Energy: 1.331247625042361
Energy: 1.3103112828888623
Energy: 1.3087884157682756
Energy: 1.2917889136080623
Energy: 1.314657105636467
Energy: 1.3149852699952163
Energy: 1.3138168167783764
Energy: 1.2941871130482303
Energy: 1.3119574137656482
Energy: 1.299018938133321
Energy: 1.306409108601874
Energy: 1.4285301122093244
Energy: 1.3681870172788488
Energy: 1.335507607319693
Energy: 1.3141678939468042
Energy: 1.3260777044111491
Energy: 1.295584338902135
Energy: 1.2578628741336673
Energy: 1.3158314607774293
Energy: 1.2949244393847577
Energy: 1.2973625138419758
Energy: 1.3441135581409405
Energy: 1.3131800680391104
Energy: 1.3078585141558037
Energy: 1.319605716412785
Energy: 1.3017658097675457
Energy: 1.3047706166808024

minimum gb energy = 1.2306396657387266 eV
minimum distance =  2.29957003667876 Angstroms
sigma value = 105


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

Energy: 1.3757470273457946
Energy: 1.3731147169847608
Energy: 1.3948712354710937
Energy: 1.3437042051667945
Energy: 1.6262586506840708
Energy: 1.3641769781484858
Energy: 1.3651751879791292
Energy: 1.3532443910953973
Energy: 1.3854540638926456
Energy: 1.3396425034165915
Energy: 1.3316183739995102
Energy: 1.455641807432843
Energy: 1.3637578271487
Energy: 1.3409113282493954
Energy: 1.3497980191085706
Energy: 1.418503984188291
Energy: 1.364437831239213
Energy: 1.3526502541543848
Energy: 1.376580359011266
Energy: 1.359370639779981
Energy: 1.3913065996412217
Energy: 1.3382981166726704
Energy: 1.33871289092663
Energy: 1.3980185409071255
Energy: 1.3419037982140893
Energy: 1.3756970512341198
Energy: 1.3663345154437756
Energy: 1.368487736978954
Energy: 1.3877617474455086
Energy: 1.3647116966992523
Energy: 1.334124346769663
Energy: 1.3501630835211478
Energy: 1.3753565137649626
Energy: 1.3936527450264222
Energy: 1.34775051857901
Energy: 1.3877044163904029
Energy: 1.3526906635475469
Energy: 1.342140835035294
Energy: 1.3791899353754733
Energy: 1.3788187172010518
Energy: 1.339093943981619
Energy: 1.3540135686085155
Energy: 1.3501388779254568
Energy: 1.4182898251036933
Energy: 1.3503763675410734
Energy: 1.3520920615010763
Energy: 1.3528535181780719
Energy: 1.369530667345306
Energy: 1.412834785512975
Energy: 1.338179590948895
Energy: 1.3485675179750878
Energy: 1.3632260501503777
Energy: 1.3509697385324824
Energy: 1.3486383083730287
Energy: 1.374965691494214
Energy: 1.3423404401181886
Energy: 1.3503335099747833
Energy: 1.3527566463433625
Energy: 1.3489208727032886
Energy: 1.3496962018462806
Energy: 1.3420073199440454
Energy: 1.357072230344459
Energy: 1.3416609261843606
Energy: 1.3365388928919466
Energy: 1.3745535856966566
Energy: 1.3490617024902185
Energy: 1.350474127618727
Energy: 1.3503245726362147
Energy: 1.3504553336708098
Energy: 1.3476476076632422
Energy: 1.3420115192477557
Energy: 1.3732414719035835
Energy: 1.3457365855084678
Energy: 1.5101581383366776
Energy: 1.3714699547473868
Energy: 1.3420139091565126
Energy: 1.4168923771614153
Energy: 1.3529256528954392
Energy: 1.3951114453929023
Energy: 1.3418496690869572
Energy: 1.3372835751190644
Energy: 1.3363071781188876
Energy: 1.3763181873207164
Energy: 1.3736603490560508
Energy: 1.3913672998468813
Energy: 1.4046827302753315
Energy: 1.4285448099755276
Energy: 1.3539267823851668
Energy: 1.363004224707327
Energy: 1.382276064316261
Energy: 1.4601268976568271
Energy: 1.3502508008471026
Energy: 1.3478017870876735
Energy: 1.3420937407748197
Energy: 1.3496844228209124
Energy: 1.4242701923373744
Energy: 1.3697312941892168
Energy: 1.4041080637023509
Energy: 1.3398801386803592
Energy: 1.3753206343194797
Energy: 1.4542747772601348
Energy: 1.3524033440980472
Energy: 1.3667613685716147
Energy: 1.3781051896917123
Energy: 1.3417534794469657
Energy: 1.4753619438357979
Energy: 1.3426089387806648
Energy: 1.3417358512905466
Energy: 1.3393362787534095
Energy: 1.3604683652128808
Energy: 1.3567884031823134
Energy: 1.3569319879484953
Energy: 1.3581407843823416
Energy: 1.3879819017931516
Energy: 1.3419652185346518
Energy: 1.3378211541668577
Energy: 1.4255217109225213
Energy: 1.3431740601588174
Energy: 1.3320521128602496
Energy: 1.3575941225044093
Energy: 1.3696671691486924
Energy: 1.382262012798087
Energy: 1.3655355270766072
Energy: 1.3732003558379082
Energy: 1.3697024393038022
Energy: 1.424746617098758
Energy: 1.3408983994507162
Energy: 1.35628177877516
Energy: 1.3596436660142521
Energy: 1.3893604078615664
Energy: 1.3695651351791323
Energy: 1.370296598462622
Energy: 1.3700584855990505
Energy: 1.3721082365453936
Energy: 1.3701836478580842
Energy: 1.3867388989767333
Energy: 1.3881894238497865
Energy: 1.3895693802541542
Energy: 1.4230149655068733
Energy: 1.363669512742763
Energy: 1.368293066626336
Energy: 1.3565562796779123
Energy: 1.357024235215469
Energy: 1.3567073687812474
Energy: 1.3712916604395124
Energy: 1.3692935440830678
Energy: 1.3710040509690133
Energy: 1.3693626850188843
Energy: 1.3713469969440335
Energy: 1.341492393455976
Energy: 1.3867883376872365
Energy: 1.395638596324893
Energy: 1.3475775000860082
Energy: 1.4432844663341196
Energy: 1.4315164322415
Energy: 1.374388145863327
Energy: 1.3743883834186066
Energy: 1.3278997650395765
Energy: 1.3187540164052975
Energy: 1.3399884220479106
Energy: 1.368148163100379
Energy: 1.3479449800077896
Energy: 1.4033967031381136
Energy: 1.392357611657635
Energy: 1.3917489603745499
Energy: 1.3327278665969429
Energy: 1.3748833285349253
Energy: 1.3301104451266843
Energy: 1.3896691920039372
Energy: 1.3563852165676225
Energy: 1.3561728238867592
Energy: 1.393451420101554
Energy: 1.376539485975548
Energy: 1.3703909420387022
Energy: 1.3831035484621643
Energy: 1.348219509481151
Energy: 1.388003242513177
Energy: 1.341252842779335
Energy: 1.3966666982503708
Energy: 1.356605850230215
Energy: 1.2823945400652519
Energy: 1.3760792301430937
Energy: 1.4155793659093843
Energy: 1.369646642478616
Energy: 1.3774590098354995
Energy: 1.362450779609469
Energy: 1.331481934162093
Energy: 1.3935207781088261
Energy: 1.3503159095889585
Energy: 1.349910275678121
Energy: 1.4582369511859026
Energy: 1.4051236826090452
Energy: 1.3196036531017876
Energy: 1.3302810460152394
Energy: 1.3190021764143658
Energy: 1.3188637260078147
Energy: 1.3186793114306814
Energy: 1.387745894553067
Energy: 1.3979595284453412
Energy: 1.3323596653349479
Energy: 1.3683040205773285
Energy: 1.3702196793408017
Energy: 1.36241098302606
Energy: 1.420178372889127
Energy: 1.34195826187653
Energy: 1.3603649327329417
Energy: 1.3640244693550134
Energy: 1.3298818306219748
Energy: 1.4325577009722041
Energy: 1.3623938870570753
Energy: 1.3669940128599847
Energy: 1.3738480657487981
Energy: 1.3651546762163476
Energy: 1.419976570389033
Energy: 1.3875993559645559
Energy: 1.3881654883073555
Energy: 1.388024741483517
Energy: 1.3592095312478498
Energy: 1.3752734425671835
Energy: 1.4238310285454772
Energy: 1.365999777414044
Energy: 1.3619550612149498
Energy: 1.3649016787112564
Energy: 1.3670189167054196
Energy: 1.344712584992711
Energy: 1.3647568918076165
Energy: 1.3657164278507274
Energy: 1.3383518202590918
Energy: 1.3729351763231774
Energy: 1.3742763986432378
Energy: 1.3613072188981619
Energy: 1.3615039089702734
Energy: 1.366530922779038
Energy: 1.4021119194424048
Energy: 1.3641331956529044
Energy: 1.3655621488199479
Energy: 1.3875572606165936
Energy: 1.3662499236584638
Energy: 1.378529090885891
Energy: 1.3556286655840903
Energy: 1.3913544830946154
Energy: 1.3391741236221548
Energy: 1.3414131425174443
Energy: 1.3870389712988644
Energy: 1.3649588482043273
Energy: 1.3972471460538776
Energy: 1.3446249393354237
Energy: 1.3449922505507135
Energy: 1.3952552037044825
Energy: 1.3396558656871602
Energy: 1.4427667030299807
Energy: 1.3636800657433377
Energy: 1.4394612667430038
Energy: 1.3536574333947202
Energy: 1.369816410523464
Energy: 1.332531653805566
Energy: 1.3612507406798053
Energy: 1.3553759295752852
Energy: 1.3544330674162932
Energy: 1.3848078856336759
Energy: 1.3446295621836666
Energy: 1.3650647013196515
Energy: 1.3675633393682263
Energy: 1.4198943832614088
Energy: 1.338092940490676
Energy: 1.3785567415798194
Energy: 1.414322943621127
Energy: 1.3890068360712178
Energy: 1.4638450079918006
Energy: 1.3646319749159967
Energy: 1.3548112208512197
Energy: 1.3834722391654035
Energy: 1.4209244286959444
Energy: 1.3668287414310192
Energy: 1.3460637115608594
Energy: 1.3839468804487032
Energy: 1.419944207589181
Energy: 1.4196340038158057
Energy: 1.3864460577284878
Energy: 1.349455378555971
Energy: 1.3496380647478399
Energy: 1.383258773292956
Energy: 1.3666008708432218
Energy: 1.34404795259325
Energy: 1.345193858735621
Energy: 1.3599904294367218
Energy: 1.3573026562182566
Energy: 1.3334761879843755
Energy: 1.4389688467885833
Energy: 1.3215773212529756
Energy: 1.3423959513985462
Energy: 1.3623415167356965
Energy: 1.3904152937753398
Energy: 1.340424387383897
Energy: 1.3849500561883548
Energy: 1.3703953084526077
Energy: 1.37570939858943
Energy: 1.3845632176764353
Energy: 1.3612128604806906
Energy: 1.3572066806668792
Energy: 1.3220858385777856
Energy: 1.3619769925054912
Energy: 1.3619500867961734
Energy: 1.3194596070360238
Energy: 1.3843860121314675
Energy: 1.407474670164625
Energy: 1.3215006220587162
Energy: 1.3657691563552115
Energy: 1.3650961462991662
Energy: 1.365538915945163
Energy: 1.3205023827674127
Energy: 1.3591344791708733
Energy: 1.3587412136409198
Energy: 1.296309510394849
Energy: 1.3197130548001077
Energy: 1.3429026236978
Energy: 1.3560496975197016
Energy: 1.3522188093596543
Energy: 1.358867839278135
Energy: 1.3869279537531993
Energy: 1.3213105090753736
Energy: 1.3197774291681876
Energy: 1.3842270076675192
Energy: 1.3759308009425875
Energy: 1.3187572953756284
Energy: 1.319003524647982
Energy: 1.3247046470086046
Energy: 1.3252555164929125
Energy: 1.3191645550062152
Energy: 1.3790998092554345
Energy: 1.3485933394494172
Energy: 1.3745002422110189
Energy: 1.345854128818281
Energy: 1.3836352774685134
Energy: 1.3320942877087985
Energy: 1.3899545769836912
Energy: 1.3472740637447707
Energy: 1.3863225423531895
Energy: 1.3417394556258466
Energy: 1.391706374705073
Energy: 1.3390615240127108
Energy: 1.3405949543576356
Energy: 1.3290148946125067
Energy: 1.338916690594432
Energy: 1.3380303479080502
Energy: 1.377286233579769
Energy: 1.3522501442896024
Energy: 1.385898478667132
Energy: 1.3447643791279011
Energy: 1.3647186089008876
Energy: 1.3213320745925472
Energy: 1.3738308036556126
Energy: 1.4105034111141013
Energy: 1.492749660119577
Energy: 1.340194088185785
Energy: 1.4202281204974299
Energy: 1.3625112277742553
Energy: 1.3839363961800182
Energy: 1.4491763111370768
Energy: 1.3195240330234668
Energy: 1.414957642192589
Energy: 1.3188073581625535
Energy: 1.4242965590790702
Energy: 1.329349721355048
Energy: 1.3603054842150266
Energy: 1.3448965638814103
Energy: 1.3534424225202004
Energy: 1.3491282413061028
Energy: 1.4240561346099672
Energy: 1.39389542696801
Energy: 1.3378163206714104
Energy: 1.3944138032191151
Energy: 1.3388718327284523
Energy: 1.3900808237973121
Energy: 1.3603514394419898
Energy: 1.4684208715896025
Energy: 1.385636237635702
Energy: 1.3557669404089938
Energy: 1.3487364601832763
Energy: 1.3863966205241602
Energy: 1.3835831121649478
Energy: 1.3416860252494398
Energy: 1.3599238642572984
Energy: 1.3598735604592769
Energy: 1.3799861353574965
Energy: 1.3739994150661494
Energy: 1.3859113308005135
Energy: 1.3687901381635181
Energy: 1.3686333736865095
Energy: 1.3761694939150926
Energy: 1.374952311462892
Energy: 1.373934255480005
Energy: 1.3719170776878147
Energy: 1.3738051090065557
Energy: 1.5135111007243045
Energy: 1.373798933951648
Energy: 1.3735125381215272
Energy: 1.3732344731500339
Energy: 1.3474470905269504
Energy: 1.3687097004981739
Energy: 1.397671029816377
Energy: 1.3729878319503752
Energy: 1.3748248327309969
Energy: 1.374515481730278
Energy: 1.3635494749870067
Energy: 1.4136836746374368
Energy: 1.3467488989316778
Energy: 1.3444029494907581
Energy: 1.34783668522284
Energy: 1.3747675559314938
Energy: 1.392859461842697
Energy: 1.380888305171238
Energy: 1.3329208117688978
Energy: 1.3427757666068076
Energy: 1.3420296110087768
Energy: 1.364259849138266
Energy: 1.4815427435586883
Energy: 1.4889297408036055
Energy: 1.4142678961451454
Energy: 1.392626015449258
Energy: 1.371690182439579
Energy: 1.4008006368408426
Energy: 1.492588837175133
Energy: 1.3451328810518814
Energy: 1.3557757325500381
Energy: 1.4089604314266662
Energy: 1.3686488303494257
Energy: 1.384766345646297
Energy: 1.332478967344845
Energy: 1.4017353176380898
Energy: 1.4733921119902729
Energy: 1.338077860680228
Energy: 1.3911589138525216
Energy: 1.5318802437386343
Energy: 1.3914959422310316
Energy: 1.3472971887929983
Energy: 1.4039298147566748
Energy: 1.3884323940805638
Energy: 1.3493323661629535
Energy: 1.4157845184812017
Energy: 1.3422030601261459
Energy: 1.341966900179142
Energy: 1.3806547523516373
Energy: 1.401141165317336
Energy: 1.3610193564869295
Energy: 1.39389691529256
Energy: 1.4153890213662614
Energy: 1.3987638101391773
Energy: 1.3677173613616411
Energy: 1.3639280334149493
Energy: 1.3420505286938613
Energy: 1.3418794964515095
Energy: 1.3946279960020915
Energy: 1.3427748020972774
Energy: 1.4007768299408485
Energy: 1.3576136139578718
Energy: 1.4183544335409455
Energy: 1.346538630466865
Energy: 1.3659142567238884
Energy: 1.408144787297781
Energy: 1.3482837559072147
Energy: 1.3699029378597638
Energy: 1.3697350516809197
Energy: 1.3638372420547726
Energy: 1.36990504822652
Energy: 1.3804472986915757
Energy: 1.3695140647099644
Energy: 1.368845255046284
Energy: 1.3658675485230343
Energy: 1.4005806066978375
Energy: 1.3509536991372952
Energy: 1.3620693606524252
Energy: 1.3552761230963932
Energy: 1.3636702013248643
Energy: 1.3634816353403847
Energy: 1.3660262641146896
Energy: 1.3642309119943885
Energy: 1.3642692345518026
Energy: 1.3665700779680405
Energy: 1.363985606968378
Energy: 1.362338291602388
Energy: 1.364904503650579
Energy: 1.3409404989248757
Energy: 1.4483597959860899
Energy: 1.363146980736883
Energy: 1.3812470507853378
Energy: 1.367261821760443
Energy: 1.359704769451469
Energy: 1.366096894452564
Energy: 1.3640912633449518
Energy: 1.3522391872492356
Energy: 1.3640683708168624
Energy: 1.4620083322812945
Energy: 1.324899122954021
Energy: 1.361051483474151
Energy: 1.358962891752051
Energy: 1.3586422817229322
Energy: 1.3647810565496878
Energy: 1.3638193975491937
Energy: 1.3637881232790634
Energy: 1.3919818505626091
Energy: 1.42288487170642
Energy: 1.3495999398241594
Energy: 1.3489243232001566
Energy: 1.3413099143263905
Energy: 1.4652790493194499
Energy: 1.3789428780641275
Energy: 1.3485593426434805
Energy: 1.4526078136247313
Energy: 1.3664329056778415
Energy: 1.360241641794647
Energy: 1.3603703037697559
Energy: 1.3432961903667828
Energy: 1.3425339232775948
Energy: 1.3752611750807417
Energy: 1.3388428887330213
Energy: 1.3401238557736876
Energy: 1.3390955074274207
Energy: 1.3742158131476794
Energy: 1.4257046827194098

minimum gb energy = 1.2823945400652519 eV
minimum distance =  2.31232736325914 Angstroms
sigma value = 165


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

Energy: 1.39397672348737
Energy: 1.3658221489530202
Energy: 1.3662875312388751
Energy: 1.37890272068335
Energy: 1.3941530500674773
Energy: 1.3766019498586932
Energy: 1.375599920961165
Energy: 1.3646606006237505
Energy: 1.367083890063375
Energy: 1.3581869655329328
Energy: 1.37862910917092
Energy: 1.3639208896476476
Energy: 1.3942974164524318
Energy: 1.4932106177335407
Energy: 1.3592860992702354
Energy: 1.3674159728995208
Energy: 1.3641284256185624
Energy: 1.37598475840739
Energy: 1.3774885778350965
Energy: 1.3939155450271863
Energy: 1.3785260609529726
Energy: 1.3666203853710386
Energy: 1.3968291134249122
Energy: 1.3661711923619673
Energy: 1.3773508698947348
Energy: 1.3939149580811439
Energy: 1.499094700866219
Energy: 1.3660298632109782
Energy: 1.3924685538102277
Energy: 1.378785434818348
Energy: 1.467069638790498
Energy: 1.377445303684717
Energy: 1.3784219408091478
Energy: 1.379723331161952
Energy: 1.3769217346136866
Energy: 1.3775555498596943
Energy: 1.3761823483645064
Energy: 1.397907176025647
Energy: 1.3770390709174762
Energy: 1.3773572809493102
Energy: 1.3673846794201034
Energy: 1.3957225244580185
Energy: 1.3668016883683491
Energy: 1.3650058042435635
Energy: 1.3650247967923432
Energy: 1.368108907590413
Energy: 1.364045952720343
Energy: 1.395031483314205
Energy: 1.3786860376912013
Energy: 1.3668058518693893
Energy: 1.3784249558993593
Energy: 1.3654485864063004
Energy: 1.3650965324869395
Energy: 1.3676504502798443
Energy: 1.3670680008926552
Energy: 1.3970514738048625
Energy: 1.3774418309356804
Energy: 1.395110147566734
Energy: 1.3609999167221276
Energy: 1.37583890421965
Energy: 1.3916733602189084
Energy: 1.3601962402379255
Energy: 1.3575198912385626
Energy: 1.4034873068813822
Energy: 1.3786595423059977
Energy: 1.3789501879772121
Energy: 1.3937178380864426
Energy: 1.3767301029276782
Energy: 1.3785031496719438
Energy: 1.3952754558381815
Energy: 1.3905469086797133
Energy: 1.3572549435472785
Energy: 1.3600103277322069
Energy: 1.376644242970147
Energy: 1.3767213306892514
Energy: 1.358810281836256
Energy: 1.4201876254842078
Energy: 1.376802555098525
Energy: 1.377764048527192
Energy: 1.3765681503690959
Energy: 1.3673138729908405
Energy: 1.3652468669779045
Energy: 1.3649416408838493
Energy: 1.3681020881418813
Energy: 1.3971201153104598
Energy: 1.358294212224111
Energy: 1.3766226860634945
Energy: 1.4977387218989138
Energy: 1.387487622456783
Energy: 1.3979564716838897
Energy: 1.3764894112904416
Energy: 1.3941663677266074
Energy: 1.3769952912686356
Energy: 1.3798257369555964
Energy: 1.3943890018793164
Energy: 1.378017570257224
Energy: 1.376535543485229
Energy: 1.4194755782073671
Energy: 1.3697249991834397
Energy: 1.376440219972455
Energy: 1.3780132694864233
Energy: 1.3782055440458625
Energy: 1.39465017751699
Energy: 1.3921091083558885
Energy: 1.395772293110166
Energy: 1.3786767519044199
Energy: 1.375618319627945
Energy: 1.393531423767965
Energy: 1.394835166220745
Energy: 1.3771468723562477
Energy: 1.3977970295680069
Energy: 1.3669127710283329
Energy: 1.3665785799090295
Energy: 1.378685402863454
Energy: 1.3765803490085011
Energy: 1.3939834937591409
Energy: 1.3952054213970326
Energy: 1.3776339008789806
Energy: 1.3789637067098233
Energy: 1.3676805221464068
Energy: 1.3967365121551878
Energy: 1.3652927951698202
Energy: 1.3929115136772816
Energy: 1.381433591794613
Energy: 1.3760980695265115
Energy: 1.3776126498036476
Energy: 1.396230163485192
Energy: 1.3639496027051852
Energy: 1.3677619101019691
Energy: 1.3646208427694357
Energy: 1.3998283865509216
Energy: 1.376545206612952
Energy: 1.3769979609229228
Energy: 1.3584659416427365
Energy: 1.3778563968131123
Energy: 1.376312852815063
Energy: 1.4000728578772128
Energy: 1.3764801027424776
Energy: 1.3771446361732944
Energy: 1.3776003596766508
Energy: 1.3591537469415007
Energy: 1.3976230555820621
Energy: 1.366585749829802
Energy: 1.3662282546819384
Energy: 1.378973142505427
Energy: 1.395897120557905
Energy: 1.3613418095529533
Energy: 1.3632257165215118
Energy: 1.3936074346079856
Energy: 1.4596158887070734

minimum gb energy = 1.3572549435472785 eV
minimum distance =  2.30140993846267 Angstroms
sigma value = 41


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

Energy: 3.389863776299839
Energy: 1.1886025075996334
Energy: 1.2858665038268928
Energy: 1.1621873262402287
Energy: 1.0803180511556214
Energy: 1.0475029604581227
Energy: 1.0902182478516225
Energy: 1.1003108122511802
Energy: 1.1962571791633725
Energy: 1.131875697070734
Energy: 1.106108745854081
Energy: 1.1654260552225775
Energy: 1.0920065675202342
Energy: 1.1294723598595593
Energy: 1.1354229491058254
Energy: 1.2041619231496155
Energy: 1.312408912039165
Energy: 1.3249732339423568
Energy: 1.134278207942348
Energy: 1.203705239568926
Energy: 1.1075926469209105
Energy: 1.1070925455533658
Energy: 1.0738187014963712
Energy: 1.0652624713933885
Energy: 1.1399887944164142
Energy: 1.117215154640082
Energy: 1.1893366553546971
Energy: 1.109133740687408
Energy: 1.116163319623328
Energy: 1.1195497500565847
Energy: 1.1195018274116328
Energy: 1.1110128075814079
Energy: 1.1106492687141991
Energy: 1.1076046896892757
Energy: 1.1081250001447358
Energy: 1.1836981072430826
Energy: 1.31887097776007
Energy: 1.2539022159795647
Energy: 1.107064642856846
Energy: 1.1097152246311448
Energy: 1.1073710669673695
Energy: 1.1562382809457976
Energy: 1.1103060943018925
Energy: 1.106344103694412
Energy: 1.1023362089960163
Energy: 1.1367845156059055
Energy: 1.0991376740849657
Energy: 1.075016397967497
Energy: 1.0901198248195518
Energy: 1.1058278765776526
Energy: 1.0280238443295475
Energy: 1.07932597587638
Energy: 1.1010609257164359
Energy: 1.1085240914375478
Energy: 1.0997176683403846
Energy: 1.1395396776337698
Energy: 1.101297920861126
Energy: 1.1025231777440532
Energy: 1.1262882659072688
Energy: 1.0748192076229695
Energy: 1.0990405181323726
Energy: 1.067596449171187
Energy: 1.0715496906898097
Energy: 1.2194418697874525
Energy: 1.2013838885458878
Energy: 1.1382827799268451
Energy: 1.027585037029676
Energy: 1.0277822052487435
Energy: 1.143027759190826
Energy: 1.0695800870275365
Energy: 1.140961936759143
Energy: 1.0726384707451344
Energy: 1.1273820764539073
Energy: 1.1096108224662098
Energy: 1.1129364125643726
Energy: 1.2127395665593572
Energy: 1.2357441009187558
Energy: 1.1364552507335393
Energy: 1.1991128755402172
Energy: 1.208328585581297
Energy: 1.1084289902055764
Energy: 1.101627617263481
Energy: 1.0510267940826303
Energy: 1.0228600924356182
Energy: 1.0278377000115535
Energy: 1.0582989810757355
Energy: 1.1710270316631983
Energy: 1.146063194940043
Energy: 1.2338373625690822
Energy: 1.165199721701228
Energy: 1.1527482071151522
Energy: 1.159109893369975
Energy: 1.0472951749804005
Energy: 1.1552579894538282
Energy: 1.1136996067453528
Energy: 1.1319704268232473
Energy: 1.271120267653099
Energy: 1.1650747164655277
Energy: 1.23679139081007
Energy: 1.14067357367278
Energy: 1.2222165110725691
Energy: 1.1503902576111718
Energy: 1.1540239356103708
Energy: 1.1129397115611692
Energy: 1.1533417631223968
Energy: 1.1391286941622039
Energy: 1.1116584790242017
Energy: 1.1946702577924457
Energy: 1.20299844305475
Energy: 1.2481885431612145
Energy: 1.1179571120600271
Energy: 1.069681205193841
Energy: 1.0988131069775464
Energy: 1.1726092257948684
Energy: 1.108801009295228
Energy: 1.1146835883678554
Energy: 1.1071005156449267
Energy: 1.1079507194323288
Energy: 1.1108641436265094
Energy: 1.0725126340808948
Energy: 1.1101553037675291
Energy: 1.0262743987197203
Energy: 1.0252071714656692
Energy: 1.0698138885793125
Energy: 1.1107967197164335
Energy: 1.163287129970506
Energy: 1.2078248663277522
Energy: 1.0952857051735485
Energy: 1.0239619421222976
Energy: 1.105011253490744
Energy: 1.2628784408641387
Energy: 1.0250798989400898
Energy: 1.1099590979907998
Energy: 1.0726494508079616
Energy: 1.1028022542652125
Energy: 1.1111208168647355
Energy: 1.101868921238305
Energy: 1.0720823586795503
Energy: 1.2369007938482526
Energy: 1.0476215046869648
Energy: 1.2635121292703315
Energy: 1.172784989689908
Energy: 1.1092430274995373
Energy: 1.0726686335016458
Energy: 1.0732390820575464
Energy: 1.078876472585564
Energy: 1.1233733696618164
Energy: 1.1220194100417218
Energy: 1.0277553536629125
Energy: 1.2990383790146354
Energy: 1.1221786427121812
Energy: 1.1114379965360242
Energy: 1.1337612572561535
Energy: 1.1082352933722237
Energy: 1.1116990171832453
Energy: 1.0294356285472799
Energy: 1.071439686419184
Energy: 1.2242487178024084
Energy: 1.2012095048821099
Energy: 1.1207624941434733
Energy: 1.2523867814514298
Energy: 1.1773848282447816
Energy: 1.1227135051899464
Energy: 1.1226521102706477
Energy: 1.1241349157372014
Energy: 1.1328591448371235
Energy: 1.123516143107549
Energy: 1.112886637388514
Energy: 1.1932034369508677
Energy: 1.202949860128889
Energy: 1.1961410348035717
Energy: 1.3362804058926019
Energy: 1.2404323741857726
Energy: 1.1135380168865847
Energy: 1.0719919471767771
Energy: 1.0627571662362556
Energy: 1.1234432205056764
Energy: 1.2184182432760138
Energy: 1.1238888241567182
Energy: 1.191395799352454
Energy: 1.1966728294351536
Energy: 1.1074092133744085
Energy: 1.129348416065021
Energy: 1.178775430307741
Energy: 1.0249692054591697
Energy: 1.0280659650585207
Energy: 1.221476155119855
Energy: 1.0446998457641055
Energy: 1.2203551691605319
Energy: 1.2673698490338252
Energy: 1.1141551363256716
Energy: 1.1975541507511545
Energy: 1.1322904862773882
Energy: 1.1751434843742998
Energy: 1.1531648560076229
Energy: 1.1209999531177464
Energy: 1.2313780682924975
Energy: 1.1414506367431927
Energy: 1.1780737838471778
Energy: 1.182573031902083
Energy: 1.1922103654317746
Energy: 1.2393370628461808
Energy: 1.2126156539266453
Energy: 1.1990641260206165
Energy: 1.1941846914301
Energy: 1.1123183367261091
Energy: 1.1971859082923815
Energy: 1.2209867128462317
Energy: 1.1663044128939628
Energy: 1.1668042751574355
Energy: 1.1771943823145887
Energy: 1.1662364635939384
Energy: 1.0486211359864734
Energy: 1.2066548974229407
Energy: 1.219896947757839
Energy: 1.0295636694938897
Energy: 1.0717377345270571
Energy: 1.077261311033676
Energy: 1.093196981938586
Energy: 1.1057249402439993
Energy: 1.2268613951729257
Energy: 1.2160642489625286
Energy: 1.2481093855095207
Energy: 1.1835220322015811
Energy: 1.1114552709556627
Energy: 1.0798148995046661
Energy: 1.1113376217285784
Energy: 1.0909617279435575
Energy: 1.1239115024169677
Energy: 1.1687517059814108
Energy: 1.128603751597635
Energy: 1.1078368953264732
Energy: 1.240204808149644
Energy: 1.2961539423279291
Energy: 1.1106905777213592
Energy: 1.0430282899290584
Energy: 1.090220389121548
Energy: 1.1115683139554937
Energy: 1.110284372974534
Energy: 1.1104912510752891
Energy: 1.20196384130396
Energy: 1.110489097868847
Energy: 1.1098069049935955
Energy: 1.1659768871925262
Energy: 1.0904122709838642
Energy: 1.1004696028767027
Energy: 1.112392715418924
Energy: 1.109208508550027
Energy: 1.1108948862540335
Energy: 1.1065950523507644
Energy: 1.188649942840692
Energy: 1.0647693364209136
Energy: 1.0252014343780051
Energy: 1.204091861814975
Energy: 1.10900074989801
Energy: 1.024990643517463
Energy: 1.1141997341343008
Energy: 1.0708536885900042
Energy: 1.1631905092106327
Energy: 1.2020005035598922
Energy: 1.138359833534313
Energy: 1.0518409046708108
Energy: 1.046691623691182
Energy: 1.12699955434315
Energy: 1.1949630349171416
Energy: 1.0260306623697013
Energy: 1.0690766137441974
Energy: 1.0679516420809982
Energy: 1.1431384902776787
Energy: 1.0272598342342039
Energy: 1.2338647848580515
Energy: 1.0257111091983442
Energy: 1.1736399527921926
Energy: 1.21204688936651
Energy: 1.1737174413083207
Energy: 1.110473660109424
Energy: 1.1104664610965174
Energy: 1.1141964215467652
Energy: 1.026709615349403
Energy: 1.0941147548977335
Energy: 1.141879696641148
Energy: 1.103381666164221
Energy: 1.173405040333638
Energy: 1.1964421257096354
Energy: 1.1451147091141551
Energy: 1.1343227058284433
Energy: 1.1678543231792828
Energy: 1.1437004753715
Energy: 1.0280686759846815
Energy: 1.0519134044836413
Energy: 1.1458979309507877
Energy: 1.1390059167485913
Energy: 1.1106842896776663
Energy: 1.184225876201463
Energy: 1.2623000144004792
Energy: 1.1570586949606732
Energy: 1.140769106856731
Energy: 1.155607562101145
Energy: 1.161030103512023
Energy: 1.1546139319615991
Energy: 1.1087340184708905
Energy: 1.0976526324589577
Energy: 1.098956725567569
Energy: 1.1015932795691825
Energy: 1.0245061942077986
Energy: 1.2064703146835836
Energy: 1.0804867428417069
Energy: 1.0280550643581665
Energy: 1.0490149223370584
Energy: 1.1417058792939818
Energy: 1.1066250533241693
Energy: 1.1954024169987132
Energy: 1.1172928538440856
Energy: 1.1229347792575246
Energy: 1.1120924603459648
Energy: 1.1246090427465516
Energy: 1.1131606646348986
Energy: 1.074688675329607
Energy: 1.0465050231368749
Energy: 1.1006152856682343
Energy: 1.1714152481956972
Energy: 1.2011848125027524
Energy: 1.1182947441242785
Energy: 1.1071145622655094
Energy: 1.1034915833956271
Energy: 1.202075400283747
Energy: 1.1005487914001113
Energy: 1.1007898115157002
Energy: 1.0784478593934455
Energy: 1.1839066053537843
Energy: 1.1108779408056433
Energy: 1.134449852167671
Energy: 1.165557078817409
Energy: 1.1669908736569097
Energy: 1.1686702342235684
Energy: 1.178977305613074
Energy: 1.1602372715593405
Energy: 1.1070754585179536
Energy: 1.0694590654797784
Energy: 1.2637304201907156
Energy: 1.1074675585505813
Energy: 1.1079798658863047
Energy: 1.1759782706850708
Energy: 1.0987477374232255
Energy: 1.1401880920619814
Energy: 1.1645648510026265
Energy: 1.102752124069792
Energy: 1.10461485114714
Energy: 1.0995548926822956
Energy: 1.0268506812476275
Energy: 1.1087428693724608
Energy: 1.1186787993549763
Energy: 1.2056955450703994
Energy: 1.1286527990796569
Energy: 1.1635238751705808
Energy: 1.2944240832298488
Energy: 1.1155228039028662
Energy: 1.1143777294242985
Energy: 1.118958923285044
Energy: 1.1187091646670715
Energy: 1.1076109149313516
Energy: 1.1177024565236906
Energy: 1.1648887311226164
Energy: 1.167262484368985
Energy: 1.1172662004011062
Energy: 1.3026589887867517
Energy: 1.1497078190993273
Energy: 1.1685116840614032
Energy: 1.0919523664895647
Energy: 1.1082207066118066
Energy: 1.1070894840325496
Energy: 1.1659669239710717
Energy: 1.119320296903657
Energy: 1.1142456722608396
Energy: 1.1658370625512164
Energy: 1.1184857165376454
Energy: 1.1276067223618564
Energy: 1.144363721857244
Energy: 1.076001247118423
Energy: 1.1073833005073177
Energy: 1.1093237871032924
Energy: 1.3075403964757313
Energy: 1.1676226682536572
Energy: 1.1633331525928892
Energy: 1.1034337201215834
Energy: 1.0924570632424087
Energy: 1.1115090947284727
Energy: 1.1280693499173489
Energy: 1.2095021138238407
Energy: 1.1782507259682387

minimum gb energy = 1.0228600924356182 eV
minimum distance =  2.32623028634786 Angstroms
sigma value = 185


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

Energy: 3.3157624831811354
Energy: 1.466895345576067
Energy: 1.4989466681735792
Energy: 1.5286116998805535
Energy: 1.505277438923051
Energy: 1.4992103671270303
Energy: 1.4935922006655924
Energy: 1.5228411557057844
Energy: 1.5614909396514094
Energy: 1.5097362960707899
Energy: 1.4755975216145767
Energy: 1.4859415973908714
Energy: 1.5740343412703972
Energy: 1.502564256544288
Energy: 1.4948471691636744
Energy: 1.4811241022215693
Energy: 1.5130858626855175
Energy: 1.5392633602196095
Energy: 1.5191422069838316
Energy: 1.480053221963408
Energy: 1.4784423017849058
Energy: 1.4638265339569747
Energy: 1.4833745294658631
Energy: 1.5378670446090708
Energy: 1.5387617140997438
Energy: 1.4631101690593575
Energy: 1.4855405314556107
Energy: 1.4850355276919875
Energy: 1.4140600596645212
Energy: 1.479237729726348
Energy: 1.4970625074943953
Energy: 1.4834150322440882
Energy: 1.5259764984273676
Energy: 1.5311938811011596
Energy: 1.5548091584054617
Energy: 1.5254757346806735
Energy: 1.532947109951341
Energy: 1.4825485235260936
Energy: 1.4646237534522604
Energy: 1.4825689552976176
Energy: 1.4790958436577117
Energy: 1.5260673252627575
Energy: 1.485031352830334
Energy: 1.4842950511503996
Energy: 1.5101175896036922
Energy: 1.5688853638330418
Energy: 1.5284695723421764
Energy: 1.5720105208246462
Energy: 1.4870279289043924
Energy: 1.4654978676025197
Energy: 1.5240535974470724
Energy: 1.4837515331231963
Energy: 1.553590749712372
Energy: 1.6068995666257728
Energy: 1.5260470297706907
Energy: 1.4955222063041902
Energy: 1.5111423985689982
Energy: 1.4728641627792678
Energy: 1.4789478901303628
Energy: 1.487355431926557
Energy: 1.5121488312798959
Energy: 1.487580720266597
Energy: 1.5619572968025275
Energy: 1.5039572809087638
Energy: 1.526202886966235
Energy: 1.532318692411493
Energy: 1.5541826507378926
Energy: 1.5542501997183396
Energy: 1.471000328949895
Energy: 1.4964360064705855
Energy: 1.528498724122722
Energy: 1.5362471527323345
Energy: 1.5273417970627508
Energy: 1.524787540145911
Energy: 1.5119407276914323
Energy: 1.592861033051064
Energy: 1.4714848120857522
Energy: 1.4694924611535367
Energy: 1.4849065734183817
Energy: 1.4749835194240506
Energy: 1.6003681182639646
Energy: 1.5551860537482871
Energy: 1.5995261681293476
Energy: 1.5821502580472828
Energy: 1.5398756352909355
Energy: 1.5654285704576627
Energy: 1.5012307439394486
Energy: 1.5097676480986126
Energy: 1.5113645471495372
Energy: 1.503959692576306
Energy: 1.500176283940275
Energy: 1.5135951501354357
Energy: 1.5308008390731511
Energy: 1.5777759274223013
Energy: 1.4931166747049274
Energy: 1.4924392642551312
Energy: 1.4831549230164622
Energy: 1.4744000797989147
Energy: 1.4834158955957666
Energy: 1.5140853459630583
Energy: 1.5987516622954892
Energy: 1.54916793499869
Energy: 1.4971407944017712
Energy: 1.510130414900523
Energy: 1.496751855441801
Energy: 1.5143554303859716
Energy: 1.5194611783878225
Energy: 1.467770868462421
Energy: 1.5023940907143996
Energy: 1.5000527389761875
Energy: 1.5752141791082852
Energy: 1.4669187290820354
Energy: 1.490841473026724
Energy: 1.5258929061794653
Energy: 1.5760725509654059
Energy: 1.4803552634396575
Energy: 1.5038245681161815
Energy: 1.502127049568942
Energy: 1.4512785962406352
Energy: 1.5130788240686366
Energy: 1.5045542435099337
Energy: 1.5198834688853298
Energy: 1.475787869995644
Energy: 1.5216669113356283
Energy: 1.545352817176216
Energy: 1.4785784661259693
Energy: 1.4932869707376393
Energy: 1.4845146409322647
Energy: 1.469340890600398
Energy: 1.5008398719522982
Energy: 1.5569241912833829
Energy: 1.479953567277302
Energy: 1.4901660632275684
Energy: 1.5458078125184718
Energy: 1.4971213857494705
Energy: 1.4862184162734806
Energy: 1.497111894261509
Energy: 1.4885939887303843
Energy: 1.5302794462453266
Energy: 1.6024758690055663
Energy: 1.4864145980749273
Energy: 1.612395116783121
Energy: 1.551321130051443
Energy: 1.567305632941699
Energy: 1.4764752181112666
Energy: 1.488894670548558
Energy: 1.500271269406269
Energy: 1.5075650518387143
Energy: 1.4954577592572997
Energy: 1.4956133651017525
Energy: 1.5044331813601945
Energy: 1.5125775856244945
Energy: 1.5559750803860701
Energy: 1.467868269561473
Energy: 1.572336426101215
Energy: 1.4808437808322639
Energy: 1.4914275812387792
Energy: 1.4952712170859819
Energy: 1.4159139170576638
Energy: 1.4975698831603792
Energy: 1.46760314645157
Energy: 1.5701452821173632
Energy: 1.5968236946345564
Energy: 1.4629776914825163
Energy: 1.501858140119984
Energy: 1.5005680949763747
Energy: 1.5195833154427876
Energy: 1.6232154044747478
Energy: 1.4762646571599245
Energy: 1.5329399002147563
Energy: 1.5367324001018574
Energy: 1.5506863589272377
Energy: 1.5576698690947923
Energy: 1.569959913877285
Energy: 1.515148524186074
Energy: 1.471510080806786
Energy: 1.4693600993972942
Energy: 1.6576450710769033
Energy: 1.5021464108457674
Energy: 1.4884762681509798
Energy: 1.5288583093767554
Energy: 1.4982102275327727
Energy: 1.4816871207437625
Energy: 1.4936766195084241
Energy: 1.4905517891708624
Energy: 1.4859637950892968
Energy: 1.464645755535207
Energy: 1.472250973927348
Energy: 1.5584717235669419
Energy: 1.5172835392166129
Energy: 1.553090898671745
Energy: 1.5650676881608263
Energy: 1.4889644112679021
Energy: 1.5051142921509673
Energy: 1.494392911774725
Energy: 1.4975873497156778
Energy: 1.4980701151596634
Energy: 1.503487596287108
Energy: 1.5040991993963866
Energy: 1.510488626085418
Energy: 1.5315968688970256
Energy: 1.4901693957045972
Energy: 1.5276652485190643
Energy: 1.4871311375502534
Energy: 1.4748883945762077
Energy: 1.4888822285900953
Energy: 1.499501087612007
Energy: 1.4972318902871584
Energy: 1.4881075848223944
Energy: 1.5197902578124955
Energy: 1.5110176769923214
Energy: 1.5131363996462461
Energy: 1.502233907712452
Energy: 1.497386491531238
Energy: 1.4720079604031715
Energy: 1.492939861401589
Energy: 1.494170370172211
Energy: 1.5167052993182977
Energy: 1.5227513626465667
Energy: 1.5181564243806884
Energy: 1.5883792401715573
Energy: 1.5132064588582077
Energy: 1.4958576704572273
Energy: 1.4677049103656015
Energy: 1.496048929916544
Energy: 1.5333484419058938
Energy: 1.5119686121434601
Energy: 1.5331948582502704
Energy: 1.5089346896177411
Energy: 1.567000882365377
Energy: 1.5806283748700993
Energy: 1.5054528060938086
Energy: 1.4822247009603315
Energy: 1.5013517665331177
Energy: 1.4811574477234495
Energy: 1.4794129304407273
Energy: 1.489269128604786
Energy: 1.4873534436870042
Energy: 1.5347650780027753
Energy: 1.4970077124321701
Energy: 1.5459669703160959
Energy: 1.5068320957625059
Energy: 1.5132245826879671
Energy: 1.5106888464031907
Energy: 1.4826414039669658
Energy: 1.4829594387361955
Energy: 1.4846593686109177
Energy: 1.5767602516872017
Energy: 1.523592536541082
Energy: 1.4710055118336207
Energy: 1.5298952093443743
Energy: 1.4899141378433594
Energy: 1.501418169674675
Energy: 1.5000492876672196
Energy: 1.508550270242063
Energy: 1.512946769334639
Energy: 1.510378243397817
Energy: 1.625634218942832
Energy: 1.5488724759769161
Energy: 1.5043329180762994
Energy: 1.5455438907703911
Energy: 1.5351360713441484
Energy: 1.4651805842050847
Energy: 1.5306814628046406
Energy: 1.4957260815223397
Energy: 1.5021437378477915
Energy: 1.5124841060107386
Energy: 1.5154340117486542
Energy: 1.5100308507534645
Energy: 1.5187541602879675
Energy: 1.4720072497977243
Energy: 1.5060943096141337
Energy: 1.5267281664352101
Energy: 1.5050862293899847
Energy: 1.5250860389346155
Energy: 1.4872269151371393
Energy: 1.5882665731378536
Energy: 1.5339762413037525
Energy: 1.532648560611629
Energy: 1.4989791330017699
Energy: 1.499779485740749
Energy: 1.484152298929971
Energy: 1.4786724025271956
Energy: 1.5068365838914595
Energy: 1.5218076912239955
Energy: 1.4999324287905709
Energy: 1.487041518751442
Energy: 1.468212487286353
Energy: 1.492600698219875
Energy: 1.49510226901188
Energy: 1.4681470099906462
Energy: 1.4643566286065708
Energy: 1.4866130811913214
Energy: 1.5152273165865393
Energy: 1.5953870967567203
Energy: 1.5576747114285905
Energy: 1.4991145614855759
Energy: 1.485527168565107
Energy: 1.4835140402235478
Energy: 1.4879141504013824
Energy: 1.4113884942128687
Energy: 1.4836266234021909
Energy: 1.5022054586798366
Energy: 1.5014685836609347
Energy: 1.482688939113646
Energy: 1.5563912256122687
Energy: 1.5231240869733214
Energy: 1.4871825314640317
Energy: 1.487571244188859
Energy: 1.4651656704005764
Energy: 1.4808974121294296
Energy: 1.4789352729787317
Energy: 1.4654888254030982
Energy: 1.4548628193887518
Energy: 1.4832148098368978
Energy: 1.41479828916033
Energy: 1.5118189057150082
Energy: 1.5288246052674115
Energy: 1.5484171769803385
Energy: 1.5041023753686207
Energy: 1.4619046771283863
Energy: 1.5469877501789226
Energy: 1.5378220593714063
Energy: 1.5988087467803427
Energy: 1.5294856924588136
Energy: 1.5414762489475078
Energy: 1.5441999304331722
Energy: 1.5218257176825891
Energy: 1.4148004786378412
Energy: 1.507748350058241

minimum gb energy = 1.4113884942128687 eV
minimum distance =  2.27256146311945 Angstroms
sigma value = 33


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

Energy: 1.3974835433552306
Energy: 1.366545885326956
Energy: 1.3567846626747035
Energy: 1.381679213377129
Energy: 1.38546650399647
Energy: 1.4375136661955057
Energy: 1.576039365085906
Energy: 1.4571008009552189
Energy: 1.3784076196972108
Energy: 1.3437334004466126
Energy: 1.3694136341334078
Energy: 1.4391477552432557
Energy: 1.4465012101275343
Energy: 1.4472320291306917
Energy: 1.4468400541030146
Energy: 1.3859703353761925
Energy: 1.368686764077959
Energy: 1.5077480716815652
Energy: 1.3658306563844775
Energy: 1.3854522499729496
Energy: 1.365474311346427
Energy: 1.4218668722959977
Energy: 1.379453138669237
Energy: 1.3716685012126253
Energy: 1.3554617449172102
Energy: 1.3671621639922995
Energy: 1.3689435317336744
Energy: 1.3692125182565498
Energy: 1.3689127788620936
Energy: 1.3686208684432046
Energy: 1.3715736776790253
Energy: 1.3674975421527547
Energy: 1.3954479537347615
Energy: 1.3951408860043775
Energy: 1.3699096363575067
Energy: 1.3605724692311412
Energy: 1.4934157672537656
Energy: 1.3690165880565073
Energy: 1.3707902153761653
Energy: 1.3689126191315562
Energy: 1.3688990146644615
Energy: 1.3878051094982424
Energy: 1.369418510146714
Energy: 1.3670946384555343
Energy: 1.4354129958392239
Energy: 1.3712883469322261
Energy: 1.5233478734885628
Energy: 1.520449460979772
Energy: 1.3726395189970841
Energy: 1.36869824030443
Energy: 1.37444204188434
Energy: 1.3836860446843982
Energy: 1.556532056242674
Energy: 1.481811457509757
Energy: 1.5230667881001365
Energy: 1.3462563063973818
Energy: 1.4358068836849958
Energy: 1.369300624037836
Energy: 1.4024695701031156
Energy: 1.404550433547811
Energy: 1.4397950851312054
Energy: 1.4400629485827965
Energy: 1.4328460105840723
Energy: 1.49386082047948
Energy: 1.3972119801255996
Energy: 1.3577223292000116
Energy: 1.3718500992903404
Energy: 1.3738612298753072
Energy: 1.3705970958673233
Energy: 1.4426377800582266
Energy: 1.523709202520868
Energy: 1.4581231200920541
Energy: 1.4333855677177132
Energy: 1.368948608132751
Energy: 1.3604147223000032
Energy: 1.358761409644429
Energy: 1.3605040752030104
Energy: 1.373728655096298
Energy: 1.3700562742755777
Energy: 1.367831309630327
Energy: 1.5230808373821851
Energy: 1.485904724354307
Energy: 1.3798347327263536
Energy: 1.3621419956448069
Energy: 1.3557876871318786
Energy: 1.3599664863951917
Energy: 1.3600752491025578
Energy: 1.35998407318019
Energy: 1.3579329867648113
Energy: 1.360041964371282
Energy: 1.3522259075428753
Energy: 1.405425383824556
Energy: 1.3856445771224593
Energy: 1.3365513940063878
Energy: 1.376628323255304
Energy: 1.372578595989895
Energy: 1.3732110517675615
Energy: 1.3590910177732891
Energy: 1.3918911694329044
Energy: 1.4010004893595118
Energy: 1.5236431922087916
Energy: 1.4658390595550645
Energy: 1.363266847004896
Energy: 1.485270965762711
Energy: 1.4918308560671547
Energy: 1.3723511721652626
Energy: 1.5480648265234598
Energy: 1.4499549952673658
Energy: 1.4861474127607397
Energy: 1.566197026420082
Energy: 1.4056186889768987
Energy: 1.3574675323958525
Energy: 1.3627351526104843
Energy: 1.3547180342787952
Energy: 1.5709564857869491
Energy: 1.5071478589445253
Energy: 1.446805161738769
Energy: 1.4475399850563937
Energy: 1.3965679747389996
Energy: 1.3687338483356608
Energy: 1.368662263978955
Energy: 1.3671215065050983
Energy: 1.368624265929439
Energy: 1.3553940234448305
Energy: 1.3562429748592413
Energy: 1.4404568630945769
Energy: 1.4420900888412698
Energy: 1.4634203858570447
Energy: 1.3741374934318293
Energy: 1.3678387724562788
Energy: 1.5228066567362155
Energy: 1.3682978405945445
Energy: 1.3677948600050973
Energy: 1.368103592584358
Energy: 1.380426885686739
Energy: 1.4255441318498923
Energy: 1.3700201227085773
Energy: 1.397986912512841
Energy: 1.3501986925696647
Energy: 1.3783626041853532
Energy: 1.5477098833740004
Energy: 1.4833305211696515
Energy: 1.3677960205258577
Energy: 1.3885594126865388
Energy: 1.3595745202169836
Energy: 1.4284914553161914
Energy: 1.3802026315104285
Energy: 1.465186916319803
Energy: 1.3591498731563039
Energy: 1.554878589019321
Energy: 1.3855564567315024
Energy: 1.3943232063723894
Energy: 1.426989951679986
Energy: 1.4464869513145244
Energy: 1.449131074193184
Energy: 1.4891086784055108
Energy: 1.549911933887327
Energy: 1.5486667443731266
Energy: 1.3464982822747626
Energy: 1.4469739349236965
Energy: 1.3685931684182642
Energy: 1.3773784617306681
Energy: 1.5601179203697781
Energy: 1.4562816690319107
Energy: 1.4613952739886307
Energy: 1.4298717545907988
Energy: 1.473794303240293
Energy: 1.4517601525959478
Energy: 1.3548915672467654
Energy: 1.3456073540751738
Energy: 1.3926256471372722
Energy: 1.3681618253249543
Energy: 1.3620009948501284
Energy: 1.5300304334856734
Energy: 1.550284807566205
Energy: 1.4627379063069008
Energy: 1.3889022209549802
Energy: 1.3541099744403562
Energy: 1.3535267253968462
Energy: 1.3553644770897588
Energy: 1.3543681625713724
Energy: 1.3540389789210456
Energy: 1.3576805473224094
Energy: 1.4718646681551215
Energy: 1.4862572912888208
Energy: 1.4405347383621137
Energy: 1.346227659475758
Energy: 1.3468123217944796
Energy: 1.351389862822322
Energy: 1.355108145132735
Energy: 1.3692716374829537
Energy: 1.4296305648680216
Energy: 1.3568182451501036
Energy: 1.3631233077157552
Energy: 1.3704993690709488
Energy: 1.3695409725857437
Energy: 1.5802088349343828
Energy: 1.331618670539029
Energy: 1.3549042002491392
Energy: 1.377463033811769
Energy: 1.4690687035099323
Energy: 1.4418164362650232
Energy: 1.4860737799100245
Energy: 1.5495585984402327
Energy: 1.5378839613710853
Energy: 1.4597503030596295
Energy: 1.503342478907237
Energy: 1.5019923529700263
Energy: 1.3564998327373687
Energy: 1.3490339553276802
Energy: 1.418234137947965
Energy: 1.3678524376806935
Energy: 1.3566631058578869
Energy: 1.3577559583139804
Energy: 1.3503253155150925
Energy: 1.3462122430735488
Energy: 1.346742275388416
Energy: 1.3603104289803762
Energy: 1.4996606615615002
Energy: 1.5081829972430199
Energy: 1.3698465801956852
Energy: 1.3523559995098589
Energy: 1.3489931030540372
Energy: 1.3570339939366984
Energy: 1.358350479909471
Energy: 1.353212174016653
Energy: 1.3568020800214573
Energy: 1.345580876586235
Energy: 1.4489754096521694
Energy: 1.434625885692661
Energy: 1.4113839548472935
Energy: 1.3842787192723964
Energy: 1.3597203437451013
Energy: 1.5305275909131166
Energy: 1.357533295951932
Energy: 1.3568032859701777
Energy: 1.3567335468938682
Energy: 1.396420678744015
Energy: 1.3562517194894537
Energy: 1.3671349809147642
Energy: 1.388067245893318
Energy: 1.4868241043174282
Energy: 1.5173332517570053
Energy: 1.539767743574737
Energy: 1.546493554963494
Energy: 1.35685852874932
Energy: 1.3781211330831311
Energy: 1.3989873128174457
Energy: 1.4199136068717515
Energy: 1.3534139484666652
Energy: 1.5692334517806095
Energy: 1.437206809602698
Energy: 1.4151091904273554
Energy: 1.3892669940618254
Energy: 1.3942323653622424
Energy: 1.3957168845011365
Energy: 1.3779198633003267
Energy: 1.352705700075912
Energy: 1.44745994419696
Energy: 1.5638525821847027
Energy: 1.4744072531142312
Energy: 1.3533895835980803
Energy: 1.3541846836993567
Energy: 1.3656463338103095
Energy: 1.3787301669747942
Energy: 1.3659941900729435
Energy: 1.5359083921274779
Energy: 1.4706571335475966
Energy: 1.3547542242476263
Energy: 1.4689998350875402
Energy: 1.352986885164405
Energy: 1.355471702754428
Energy: 1.3546510976881987
Energy: 1.352738994605044
Energy: 1.356665057196697
Energy: 1.3488125709194776
Energy: 1.5432006530008782
Energy: 1.5619701963333485
Energy: 1.4591182445586035
Energy: 1.3530961910881147
Energy: 1.3598973501401805
Energy: 1.352731494604101
Energy: 1.354661737534877
Energy: 1.3544115931304737
Energy: 1.3532914546149748
Energy: 1.3635221671286424
Energy: 1.3695395876995966
Energy: 1.4410700612303113
Energy: 1.439190972400784
Energy: 1.4948209349062138
Energy: 1.3314573993660825
Energy: 1.3587553726215467
Energy: 1.365492354838577
Energy: 1.4089747397470707
Energy: 1.3559876621762306
Energy: 1.445836765340794
Energy: 1.3587048728987456
Energy: 1.3480302321891013
Energy: 1.3741769343392263
Energy: 1.3323127026118409
Energy: 1.3314584417378421
Energy: 1.3608559179933724
Energy: 1.3745495999424138
Energy: 1.456879346532684
Energy: 1.437543290681845
Energy: 1.4407464903833629
Energy: 1.5632505947548299
Energy: 1.5454525641620613
Energy: 1.3912943756649816
Energy: 1.3338566632354583
Energy: 1.359942295765757
Energy: 1.4545236294100783
Energy: 1.3785798900069053
Energy: 1.4815381315514502
Energy: 1.3741242763674721
Energy: 1.3551023279056915
Energy: 1.3557777137403275
Energy: 1.356080003787536
Energy: 1.3644394822361474
Energy: 1.353568737354031
Energy: 1.3547996313921697
Energy: 1.353992408991721
Energy: 1.34103261229299
Energy: 1.3576157283395383
Energy: 1.3973431140043593
Energy: 1.3466756823571284
Energy: 1.3624199880672452
Energy: 1.3559449567591084
Energy: 1.3559502329955402
Energy: 1.356230153055358
Energy: 1.3987149138183579
Energy: 1.382292897442284
Energy: 1.381967597607632
Energy: 1.3901175670223593
Energy: 1.3619213573689506
Energy: 1.3570603279135145
Energy: 1.5451153008784764
Energy: 1.5636613990851376
Energy: 1.3550311085616686
Energy: 1.3552268357901476
Energy: 1.3468307988037338
Energy: 1.406295075892982
Energy: 1.4528790098372422
Energy: 1.3952978138062875
Energy: 1.4862832816429068
Energy: 1.3589361120291177
Energy: 1.4544688012443228
Energy: 1.4177291915492152
Energy: 1.3528489021503518
Energy: 1.423197381130295
Energy: 1.3945089689253651
Energy: 1.4632225737108688
Energy: 1.5522695062784473
Energy: 1.5586965264102264
Energy: 1.5443139124633616
Energy: 1.345834745586385
Energy: 1.4085282399484165
Energy: 1.3751815730557253
Energy: 1.3936546512155739
Energy: 1.397924767133645
Energy: 1.4450127963211654
Energy: 1.4731505624168686
Energy: 1.4551295022832125
Energy: 1.4768800092820598
Energy: 1.3573098849826213
Energy: 1.3775426315542214
Energy: 1.4066127940896873
Energy: 1.373803387771117
Energy: 1.3599112619729727
Energy: 1.3465010085479208
Energy: 1.553898031544583
Energy: 1.5508875914442701
Energy: 1.4633970697488499
Energy: 1.3834263871481347
Energy: 1.3582881069549477
Energy: 1.3543589613058467
Energy: 1.3572566709124083
Energy: 1.350352887669489
Energy: 1.3527260522333358
Energy: 1.353203402602105
Energy: 1.4404901683671458
Energy: 1.3865168304999975
Energy: 1.3686573322310627
Energy: 1.3456006626848493
Energy: 1.3477808118446752
Energy: 1.3763242827095234
Energy: 1.3568925704222197
Energy: 1.356969553132085
Energy: 1.3523153057447268
Energy: 1.369476409133573
Energy: 1.4555722154859
Energy: 1.3702498224132749
Energy: 1.367119266531751
Energy: 1.3547336230151812
Energy: 1.3395928333783043
Energy: 1.3641772297209838
Energy: 1.3703386168351845
Energy: 1.406812053726858
Energy: 1.3863025096709216
Energy: 1.365935515806525
Energy: 1.4527979351807179
Energy: 1.3976984747067724
Energy: 1.3616273953957636
Energy: 1.594332583737817
Energy: 1.3321259591934067
Energy: 1.38481281016068
Energy: 1.4334022971713005
Energy: 1.5156727739007676
Energy: 1.4393841276324184
Energy: 1.5502857277273632
Energy: 1.3537539909079226
Energy: 1.3539308400950305
Energy: 1.345641612056245
Energy: 1.3464140580838315
Energy: 1.4538925796426863
Energy: 1.4290342495919761
Energy: 1.3910254502775814
Energy: 1.3555538498355475
Energy: 1.349924588155286
Energy: 1.3539394983886084
Energy: 1.3540483920501984
Energy: 1.3533007897099267
Energy: 1.3531612356286231
Energy: 1.353275225583118
Energy: 1.3478677790968545
Energy: 1.3883282563945638
Energy: 1.4068119224726312
Energy: 1.3943287753901485
Energy: 1.360640440892351
Energy: 1.3611774302976511
Energy: 1.548118150098779
Energy: 1.3470584630355948
Energy: 1.3532312604810537
Energy: 1.4027111854162033
Energy: 1.378201585155361
Energy: 1.343772481297568
Energy: 1.3773818903758308
Energy: 1.3799238925816966
Energy: 1.3599890223569606
Energy: 1.5171846601859622
Energy: 1.4697788754178092
Energy: 1.4003401759895966
Energy: 1.3613635959261214
Energy: 1.3714675848090452
Energy: 1.3905254794163335
Energy: 1.4606974001529587
Energy: 1.347715261722363
Energy: 1.4572841637488954
Energy: 1.4729269876677806
Energy: 1.486071072430504
Energy: 1.417559723127379
Energy: 1.3865159250513572
Energy: 1.3946819207550756
Energy: 1.3898865408721324
Energy: 1.3560391722721037
Energy: 1.4593914913874282
Energy: 1.513664270635092
Energy: 1.51521655914421
Energy: 1.3568849086889407
Energy: 1.4022554682551056
Energy: 1.4060812043047797
Energy: 1.3570157705446564
Energy: 1.3455682431109859
Energy: 1.508668896000288
Energy: 1.4587159756089014
Energy: 1.367208513507202
Energy: 1.4586016518458833
Energy: 1.3682114357906325
Energy: 1.367171160897194
Energy: 1.3579302158428375
Energy: 1.3687314009275569
Energy: 1.3611359634277989
Energy: 1.3544664686900925
Energy: 1.5059618617333583
Energy: 1.555380022561432
Energy: 1.4017937231496063
Energy: 1.3543201372861082
Energy: 1.3559788190342354
Energy: 1.367990560871587
Energy: 1.3684405467733598
Energy: 1.3690933869793247
Energy: 1.3671074141173796
Energy: 1.3879775634731493
Energy: 1.352319850973469
Energy: 1.4165674007574547
Energy: 1.4199405588375296
Energy: 1.3840934640804943
Energy: 1.3545884159377415
Energy: 1.364238627248381
Energy: 1.3624371568299218
Energy: 1.4062747346352498
Energy: 1.4057404344670528
Energy: 1.4370156748488423
Energy: 1.5397442449652556
Energy: 1.3643471399955909
Energy: 1.3865621275692268
Energy: 1.4925647810953266
Energy: 1.5611878370163268
Energy: 1.5257992504012508
Energy: 1.3767149059777717
Energy: 1.3568585379843212
Energy: 1.3694285782618931
Energy: 1.5739820951196661
Energy: 1.4519572202083861
Energy: 1.3994155748962982
Energy: 1.3813569135217287
Energy: 1.337826536912399
Energy: 1.5555237990934068
Energy: 1.392259346267527
Energy: 1.403871919561634
Energy: 1.4692749004093777
Energy: 1.4017805000902057
Energy: 1.3598645302714019
Energy: 1.3602782928428079
Energy: 1.3593404411674828
Energy: 1.374659032108525
Energy: 1.3558237797957866
Energy: 1.353861763077148
Energy: 1.423353618267675
Energy: 1.417959674975083
Energy: 1.405875642470393
Energy: 1.3703290794646548
Energy: 1.3688532821784272
Energy: 1.4013450142258872
Energy: 1.3589767602386984
Energy: 1.359844184765919
Energy: 1.3599232652282123
Energy: 1.37002765353896
Energy: 1.4081464607729208
Energy: 1.3880518037774785
Energy: 1.3638096550693868
Energy: 1.4286739455875004
Energy: 1.3550295027146677
Energy: 1.5309424488919954
Energy: 1.4477025264487353
Energy: 1.3592221473654766
Energy: 1.360202237540704
Energy: 1.363962563167241
Energy: 1.3591462913491446
Energy: 1.366979354113095
Energy: 1.4385580791047872
Energy: 1.4797719791935149
Energy: 1.486903503773774
Energy: 1.4470766706397895
Energy: 1.4886422703715356
Energy: 1.3706840206542337
Energy: 1.400157982805248
Energy: 1.3878002737039865
Energy: 1.4370695203169233
Energy: 1.4836670800359193
Energy: 1.403010519190612
Energy: 1.3701642663504796
Energy: 1.3821668295838938
Energy: 1.4766840360619486
Energy: 1.4200672169863604
Energy: 1.4796288743841362
Energy: 1.368441384029169
Energy: 1.437336408800404
Energy: 1.4352042962247324
Energy: 1.5285824509939858
Energy: 1.3696121191419663
Energy: 1.368436689744439
Energy: 1.3893147926631628
Energy: 1.372442849825116
Energy: 1.3642806290265799
Energy: 1.3647763446676706
Energy: 1.4792639190180055
Energy: 1.4025621809847504
Energy: 1.4313028730632142
Energy: 1.4359016390093897
Energy: 1.3664522373589052
Energy: 1.3687310001993864
Energy: 1.369380569189988
Energy: 1.3669348754305466
Energy: 1.3680964630733248
Energy: 1.358290812052773
Energy: 1.457227110755082
Energy: 1.3993885668948902
Energy: 1.3538080950420246
Energy: 1.3706277386959054
Energy: 1.3692520712570233
Energy: 1.3722917868454294
Energy: 1.3694325896441175
Energy: 1.3647503676710426
Energy: 1.3679840990153815
Energy: 1.36791448753143
Energy: 1.36291961753043
Energy: 1.3623617072778957
Energy: 1.3629962291601014
Energy: 1.393709924121349
Energy: 1.3772785343862435
Energy: 1.3631450175392195
Energy: 1.4848373264191006
Energy: 1.381806086449707
Energy: 1.3723236741087363
Energy: 1.3639352802303366
Energy: 1.5778803118269795
Energy: 1.4756966879825624
Energy: 1.3647859732393064
Energy: 1.3437961604573316

minimum gb energy = 1.3314573993660825 eV
minimum distance =  2.27615273650271 Angstroms
sigma value = 219


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

Energy: 2.6664183766158245
Energy: 1.1306187135464192
Energy: 1.1173935937716837
Energy: 1.1704250262002176
Energy: 1.1694894774743676
Energy: 1.116932213291917
Energy: 1.1297376356919602
Energy: 1.170193334156975
Energy: 1.1179102654017763
Energy: 1.054489290976626
Energy: 1.1256493440975235
Energy: 1.164984176611636
Energy: 1.1137196409373147
Energy: 1.0588961976236062
Energy: 1.1323845540119595
Energy: 1.1165910144163345
Energy: 1.167124357908485
Energy: 1.1228059745163839
Energy: 1.1641490828725463
Energy: 1.1672202258722586
Energy: 1.1241817632976794
Energy: 1.1675966158172144
Energy: 1.1683699779131598
Energy: 1.112868161981092
Energy: 1.1145648075912853
Energy: 1.1258131717187947
Energy: 1.127426476001327
Energy: 1.1122639951264002
Energy: 1.124264254736296
Energy: 1.1108291021871006
Energy: 1.1220161880353223
Energy: 1.1100899094222323
Energy: 1.1325287011704996
Energy: 1.1166166856685154
Energy: 1.1346006256984964
Energy: 1.1249829012673165
Energy: 1.1664469163069497
Energy: 1.1704616409302495
Energy: 1.1275469900930746
Energy: 1.1114946542316773
Energy: 1.1248508715401087
Energy: 1.117964173805438
Energy: 1.06212472166191
Energy: 1.1142608490694679
Energy: 1.1125445708784185
Energy: 1.0622744809805102
Energy: 1.1677485173433175
Energy: 1.204172334206777
Energy: 1.1202470312686676
Energy: 1.130996358699599
Energy: 1.1687743671885342
Energy: 1.1691792004867594
Energy: 1.1677764311725922
Energy: 1.2349573201867667
Energy: 1.1180310955750337
Energy: 1.0611573329467923
Energy: 1.112111365685854
Energy: 1.1134223543986748
Energy: 1.0487719839535337
Energy: 1.232025403707181
Energy: 1.1251495382056844
Energy: 1.1124807107149675
Energy: 1.1201142578549594
Energy: 1.124359087091306
Energy: 1.1315411602977186
Energy: 1.1261202632147023
Energy: 1.1742341386761161
Energy: 1.168287750020313
Energy: 1.099188713335655
Energy: 1.110133672979506
Energy: 1.1223140016816908
Energy: 1.1171021118733198
Energy: 1.1117042817857266
Energy: 1.1233423506694047
Energy: 1.1080382853072057
Energy: 1.127241037242753
Energy: 1.1715553006039503
Energy: 1.127546117266434
Energy: 1.128708878277974
Energy: 1.2026837309712421
Energy: 1.0603457017234919
Energy: 1.169381768090558
Energy: 1.1673965211358976
Energy: 1.1231815700305146
Energy: 1.1123829926202906
Energy: 1.123483271375406
Energy: 1.0611239361329752
Energy: 1.0624747446076082
Energy: 1.1225342671634415
Energy: 1.1120353472478313

minimum gb energy = 1.0487719839535337 eV
minimum distance =  2.34264613622999 Angstroms
sigma value = 15


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

Energy: 1.608457894275202
Energy: 1.548045032298021
Energy: 1.5536360838272625
Energy: 1.6096218042555088
Energy: 1.546522552207298
Energy: 1.5497852100380138
Energy: 1.5634681848974201
Energy: 1.5722087230148936
Energy: 1.6016781302737393
Energy: 1.5434234580085189
Energy: 1.606646483394641
Energy: 1.5491436173417181
Energy: 1.5433328973975622
Energy: 1.5302849580645999
Energy: 1.5392014053308123
Energy: 1.5475634247846461
Energy: 1.5343152016263228
Energy: 1.5656691702400467
Energy: 1.5575255180567447
Energy: 1.575933362492576
Energy: 1.6281207210587505
Energy: 1.5394618691415265
Energy: 1.6062719236694005
Energy: 1.544101976801056
Energy: 1.551740012996292
Energy: 1.6310775589903155
Energy: 1.552512874454774
Energy: 1.5454101192385181
Energy: 1.5531734011181348
Energy: 1.5566964671037455
Energy: 1.5563804562967036
Energy: 1.5203930973884943
Energy: 1.5164028215467837
Energy: 1.60346825515185
Energy: 1.5345591780847276
Energy: 1.5493285807428914
Energy: 1.5757051414695755
Energy: 1.549641706468567
Energy: 1.5579433869575026
Energy: 1.5442682277350832
Energy: 1.5799199700404751
Energy: 1.5210481767247346
Energy: 1.5216951569668202
Energy: 1.606712374534077
Energy: 1.5400504395849441
Energy: 1.6048023798195201
Energy: 1.5742827900673282
Energy: 1.5684328679372361
Energy: 1.562589958008478
Energy: 1.5711876145395602
Energy: 1.6103037242505154
Energy: 1.5476066098065275
Energy: 1.5410259291093416
Energy: 1.5716862246542336
Energy: 1.5596165062549332
Energy: 1.5989390255133331
Energy: 1.548379948566425
Energy: 1.606589952096512
Energy: 1.5425175351112255
Energy: 1.5480706787632907
Energy: 1.6067322743494143
Energy: 1.5324824996323756
Energy: 1.6008084776453089
Energy: 1.5607398619658448
Energy: 1.5751540015341923
Energy: 1.544742462237191
Energy: 1.545022736011893
Energy: 1.630026163554357
Energy: 1.564931897312789
Energy: 1.5345920991904674
Energy: 1.6072343026906324
Energy: 1.5430481305222672
Energy: 1.5421289582318498
Energy: 1.527643521731705
Energy: 1.547658477428814
Energy: 1.5780312891595845
Energy: 1.5476687910243367
Energy: 1.5383852228991692
Energy: 1.559992041721903
Energy: 1.5308631922181368
Energy: 1.6030333613688197
Energy: 1.6052654821406862
Energy: 1.5554160761056646
Energy: 1.5650541256092805
Energy: 1.5408899886813332
Energy: 1.6049775731470424
Energy: 1.5049941975018164
Energy: 1.6724981945091044
Energy: 1.7981878906630797
Energy: 1.537767924667585
Energy: 1.5238688100411462
Energy: 1.5585229911642602
Energy: 1.5878151755588918
Energy: 1.5399023359244575
Energy: 1.5632187627969019
Energy: 1.5879639120928306
Energy: 1.5789313991466332
Energy: 1.5495522568482625
Energy: 1.619291973457691
Energy: 1.548293476313082
Energy: 1.6061984175200006
Energy: 1.549824644009453
Energy: 1.5574629171007741
Energy: 1.558524966103835
Energy: 1.5441865615520034
Energy: 1.5599842174547562
Energy: 1.5544009110116432
Energy: 1.5449585695182637
Energy: 1.5419941506131354
Energy: 1.5482957040486331
Energy: 1.6062388795205698
Energy: 1.5323806581564956
Energy: 1.5498345048259945
Energy: 1.5674580462705037
Energy: 1.5450041682004076
Energy: 1.5511773384075576
Energy: 1.5446128505279397
Energy: 1.636261352171086
Energy: 1.5206506463422285
Energy: 1.5445737075766828
Energy: 1.549189899763881
Energy: 1.5332359704022258
Energy: 1.5863654815112378
Energy: 1.577043197388561
Energy: 1.5644163503454345
Energy: 1.5579349016175918
Energy: 1.5729851711146043
Energy: 1.5815914921026148
Energy: 1.517697834324073
Energy: 1.6108352885725656
Energy: 1.539505569068983
Energy: 1.5181857400698506
Energy: 1.5370242174653013
Energy: 1.5416849723002415
Energy: 1.5379391070037816
Energy: 1.5788659739459627
Energy: 1.6067152249904686
Energy: 1.614816698937194
Energy: 1.5408016343043656
Energy: 1.5575317119675967
Energy: 1.5619953287099313
Energy: 1.5727968017136793
Energy: 1.5399678929418614
Energy: 1.5515854660949404
Energy: 1.5508935769798127
Energy: 1.565140669786665
Energy: 1.6068091260410955
Energy: 1.5353743659351848
Energy: 1.5985725660585104
Energy: 1.553362453130408
Energy: 1.5366179555927557
Energy: 1.5813186237115944
Energy: 1.5518398011165833
Energy: 1.6116241170135126
Energy: 1.536030450059073
Energy: 1.554209339951239
Energy: 1.536661120630508
Energy: 1.5385921885013754
Energy: 1.5425475051698097
Energy: 1.5407451696365337
Energy: 1.5674939856629961
Energy: 1.5393539301986723
Energy: 1.5413240561068464
Energy: 1.4979203073049543
Energy: 1.536856270620743
Energy: 1.630761258435246
Energy: 1.5403534033722412
Energy: 1.6042273895249652
Energy: 1.6189035631738395
Energy: 1.5757181346610456
Energy: 1.5582951760126744
Energy: 1.5590625678803032
Energy: 1.5669503521538812
Energy: 1.5835522008750669
Energy: 1.5481583336884106
Energy: 1.6203011760690145
Energy: 1.5970874981327094
Energy: 1.598884266340205
Energy: 1.5538602962700367
Energy: 1.5431216752088186
Energy: 1.5537643586462786
Energy: 1.5455412076365682
Energy: 1.5627103160540368
Energy: 1.6372934962405905
Energy: 1.5373743596751224
Energy: 1.5405716426821223
Energy: 1.5475856867594608
Energy: 1.542011698855834
Energy: 1.6367991885834619
Energy: 1.5456961734950752
Energy: 1.5626802356667004
Energy: 1.5444305769228581
Energy: 1.5458294793433285
Energy: 1.55130447328495
Energy: 1.555231557791146
Energy: 1.517805343953391
Energy: 1.6070309335055513
Energy: 1.538631527011941
Energy: 1.5453637990748534
Energy: 1.566543108982928
Energy: 1.559444523804738
Energy: 1.557174017594949
Energy: 1.5492406267783823
Energy: 1.5777501442057897
Energy: 1.5467946494944558
Energy: 1.5206587648588044
Energy: 1.6060106154883036
Energy: 1.5432724475104957
Energy: 1.6083208641765951
Energy: 1.544256216013491
Energy: 1.5460088407117316
Energy: 1.5431757774597303
Energy: 1.5677295583150348
Energy: 1.6033162641328833
Energy: 1.61222087478415
Energy: 1.5423513654159835
Energy: 1.5401578754077627
Energy: 1.5404251662078492
Energy: 1.597446822937645
Energy: 1.5403485005406081
Energy: 1.6371829135986815
Energy: 1.683792338841203
Energy: 1.5413617614112436
Energy: 1.6060694840436902
Energy: 1.5335650081204724
Energy: 1.5993374903865274
Energy: 1.553316245422287
Energy: 1.5483990219171944
Energy: 1.5507565229256761
Energy: 1.543316724776985
Energy: 1.5436828535837104
Energy: 1.5438498636916924
Energy: 1.5548579692673814
Energy: 1.549040027917614
Energy: 1.5353002141058223
Energy: 1.5400308951961046
Energy: 1.5448659573411192
Energy: 1.682231291111016
Energy: 1.5784566093261316
Energy: 1.544286061735987
Energy: 1.50369030624803
Energy: 1.6328080079449567
Energy: 1.5422708836157852
Energy: 1.5438058412503088
Energy: 1.6081083812099954
Energy: 1.6101064764114144
Energy: 1.5575183696746773
Energy: 1.5405615546350335
Energy: 1.6058271624549219
Energy: 1.5186953990351395
Energy: 1.6076171906253354
Energy: 1.6151530770385634
Energy: 1.543931782768707
Energy: 1.5221593427715872
Energy: 1.563106456483747
Energy: 1.5823637160516184
Energy: 1.5453176608075192
Energy: 1.5601971273124555
Energy: 1.5562423978357098
Energy: 1.534922852436283
Energy: 1.5574898251857834
Energy: 1.5370209818111682
Energy: 1.6058059560248499
Energy: 1.6029771510378978
Energy: 1.554918462427001
Energy: 1.6275625583815458
Energy: 1.5464850405560153
Energy: 1.5443788548866262
Energy: 1.5545601556917827
Energy: 1.5639646440782873
Energy: 1.6280531564410345
Energy: 1.5533888568031518
Energy: 1.5847286879025397
Energy: 1.6055009541013459
Energy: 1.5365029267957282
Energy: 1.5551255665897454
Energy: 1.5638500057070857
Energy: 1.5483205084215292
Energy: 1.5497071142688594
Energy: 1.5445869094081834
Energy: 1.5838085180451977
Energy: 1.52432568751222
Energy: 1.5223866009128053
Energy: 1.54452998387243
Energy: 1.5353402823692441
Energy: 1.5945735738884534
Energy: 1.5535643129847883
Energy: 1.5578540753091625
Energy: 1.5632050783027518
Energy: 1.5759079285052928
Energy: 1.612649051408504
Energy: 1.6139377065867428
Energy: 1.5455673502225153
Energy: 1.5403575760513926
Energy: 1.6103475305877568
Energy: 1.5479983670464668
Energy: 1.5496831718881479
Energy: 1.6065160276590114
Energy: 1.5754343754961353
Energy: 1.5539619981294512
Energy: 1.5420177014766665
Energy: 1.5351620308595149
Energy: 1.5438282257663796
Energy: 1.5581163991465152
Energy: 1.5427084494948098
Energy: 1.5459794608496475
Energy: 1.5482845224041846
Energy: 1.581417899396339
Energy: 1.566627752431292
Energy: 1.5437164671490846
Energy: 1.6012712656750516
Energy: 1.53396626396762
Energy: 1.6062879270358905
Energy: 1.5320671153844057
Energy: 1.5517992735342623
Energy: 1.556667315053638
Energy: 1.5393130596006355
Energy: 1.5716667623137641
Energy: 1.5568743191729197
Energy: 1.5296867998675197
Energy: 1.541991562364418
Energy: 1.6139074426585753
Energy: 1.604418513694198
Energy: 1.546958788586215
Energy: 1.5450470303308783
Energy: 1.54450185196569
Energy: 1.5394843861051233
Energy: 1.5013264595163782
Energy: 1.5424394343713104
Energy: 1.5401870961481188
Energy: 1.5224637110685022
Energy: 1.5563770949218443
Energy: 1.5766870612913986
Energy: 1.5517215001086273
Energy: 1.556543911441663
Energy: 1.5590484754774614
Energy: 1.5263056323913564
Energy: 1.5370717697487208
Energy: 1.5518713856168098
Energy: 1.5397955069295557
Energy: 1.6100582627737574
Energy: 1.554670605451289
Energy: 1.5482965192871851
Energy: 1.5486115943010346
Energy: 1.5435895057788311
Energy: 1.572822613802215
Energy: 1.5600320361720355
Energy: 1.5434072033687403
Energy: 1.539209634598794
Energy: 1.5432379050641345
Energy: 1.542753191987198
Energy: 1.5439504012863898
Energy: 1.553342608375584
Energy: 1.5729931537746704
Energy: 1.5446742956311768
Energy: 1.5569587013559303
Energy: 1.546695223729814
Energy: 1.6294066310888724
Energy: 1.6043573524752113
Energy: 1.5452578074800272
Energy: 1.6191374900054538
Energy: 1.5476377615442012
Energy: 1.5706444313441223
Energy: 1.5912367149999318
Energy: 1.5540876713387353
Energy: 1.5555531056877332
Energy: 1.5774442213410882
Energy: 1.5586793547242195
Energy: 1.6873705812675441
Energy: 1.6790844123190418
Energy: 1.5391710500068194
Energy: 1.5372576942037774
Energy: 1.5383884017376352
Energy: 1.5459238705550813
Energy: 1.5377550884712883
Energy: 1.565924341013131
Energy: 1.5527637917628074
Energy: 1.6158165801275093
Energy: 1.5423949083353354
Energy: 1.5397890194662587
Energy: 1.5607238097181633
Energy: 1.5426907563412526
Energy: 1.6015396021884223
Energy: 1.6292244281671497
Energy: 1.549581283495018
Energy: 1.563735833982262
Energy: 1.606284012351041
Energy: 1.5399382467972533
Energy: 1.6052871011823762
Energy: 1.555861027050039
Energy: 1.5678925058224382
Energy: 1.5570449622564158
Energy: 1.5493334263787168
Energy: 1.54224791569467
Energy: 1.5724928036783103
Energy: 1.5614173776734548
Energy: 1.5430122531128863
Energy: 1.6087889699720601
Energy: 1.5369244117490117
Energy: 1.5412202969530955
Energy: 1.5381336570088662
Energy: 1.538540313337449
Energy: 1.5416756090916965
Energy: 1.499310108374704
Energy: 1.515680837509935
Energy: 1.540634247794781
Energy: 1.5421468878982227
Energy: 1.545650527617691
Energy: 1.6136289748573298
Energy: 1.5531412321881728
Energy: 1.560402535346197
Energy: 1.5604241241004597
Energy: 1.5632865614055622
Energy: 1.6042356116959853
Energy: 1.5220878199048382
Energy: 1.5490143208656801
Energy: 1.521422669517183
Energy: 1.5373061386488343
Energy: 1.583957555444417
Energy: 1.5727675406066195
Energy: 1.5548939129716768
Energy: 1.545678710001469
Energy: 1.568364999790126
Energy: 1.6402411007138977
Energy: 1.5336757093963018
Energy: 1.6060777024163748
Energy: 1.5425283234943814
Energy: 1.5509637308597184
Energy: 1.629440387795663
Energy: 1.5441886866368393
Energy: 1.5587540075535569
Energy: 1.5442033410963296
Energy: 1.551590367651467
Energy: 1.6272879467257417
Energy: 1.5486007059461564
Energy: 1.6029557706585476
Energy: 1.539141938992411
Energy: 1.5389464848785392
Energy: 1.5513115941563054
Energy: 1.564605472755046
Energy: 1.584960043168165
Energy: 1.558287999721154
Energy: 1.547954717949677
Energy: 1.5859035049258448
Energy: 1.6856434234497313
Energy: 1.617388700469579
Energy: 1.5458242862761213
Energy: 1.5535943440082287
Energy: 1.5926325610196244
Energy: 1.5400453804576604
Energy: 1.6053878161285453
Energy: 1.5421131439798152
Energy: 1.5729683203993732
Energy: 1.5535356189980174
Energy: 1.60836920005384
Energy: 1.6022906320168706
Energy: 1.5390976833463446
Energy: 1.6328021525835528
Energy: 1.518791059073774
Energy: 1.6179007769108247
Energy: 1.5764025601026728
Energy: 1.5469996543961806
Energy: 1.5441211970808308
Energy: 1.5429901627595048
Energy: 1.5443507415651476
Energy: 1.5537596980818849
Energy: 1.5481863498869781
Energy: 1.5450565877933935
Energy: 1.5481665878517636
Energy: 1.5462491177331386
Energy: 1.5464714603005738
Energy: 1.545881055574739
Energy: 1.559538199137763
Energy: 1.5993691514524315
Energy: 1.5323438255269541
Energy: 1.606423569904507
Energy: 1.5422038329795091
Energy: 1.5622177714412253
Energy: 1.6340484527826296
Energy: 1.542804716191898
Energy: 1.4996198984791893
Energy: 1.5723346971268344
Energy: 1.5576467749223648
Energy: 1.5407210878796758
Energy: 1.6116788773815034
Energy: 1.6092098828794652
Energy: 1.5485153413200659
Energy: 1.5242210975950883
Energy: 1.5490214418116701
Energy: 1.5405290514019443

minimum gb energy = 1.4979203073049543 eV
minimum distance =  2.29233681142622 Angstroms
sigma value = 293


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

Energy: 1.5101501918170395
Energy: 1.6391268970321948
Energy: 1.5549582324763835
Energy: 1.5108420052703648
Energy: 1.5390266463171978
Energy: 1.5667606308807067
Energy: 1.5292444663267828
Energy: 1.528030726641962
Energy: 1.5582779903611512
Energy: 1.5541869663388304
Energy: 1.525338407904842
Energy: 1.6168606566008914
Energy: 1.5160190520527277
Energy: 1.4689333991612576
Energy: 1.5453245696930489
Energy: 1.5945265020289296
Energy: 1.5314716510944637
Energy: 1.5102234905098786
Energy: 1.5111148975219841
Energy: 1.5842632516927315
Energy: 1.4835557241568234
Energy: 1.5940129001568524
Energy: 1.639248227586154
Energy: 1.4922728747559832
Energy: 1.5919670494681033
Energy: 1.6350889433613771
Energy: 1.5111471326615797
Energy: 1.5299200095131644
Energy: 1.5595372201711375
Energy: 1.6123085647794222
Energy: 1.5597779719844422
Energy: 1.5317891285976635
Energy: 1.5321125371402131
Energy: 1.4968834724721842
Energy: 1.4948774778037124
Energy: 1.637082657382009
Energy: 1.471976083953178
Energy: 1.5337706650636977
Energy: 1.550029418516454
Energy: 1.532566019816348
Energy: 1.506792667660008
Energy: 1.4520552817566652
Energy: 1.5470405462525512
Energy: 1.613269005062082
Energy: 1.5153713202691261
Energy: 1.4645417349444758
Energy: 1.5281773979971554
Energy: 1.5380617945725146
Energy: 1.5603781475698866
Energy: 1.543032569005479
Energy: 1.4981643274600696
Energy: 1.5064671457880008
Energy: 1.5940868528875625
Energy: 1.539088261104952
Energy: 1.5025792152827182
Energy: 1.4901993533824032
Energy: 1.6955095376331855
Energy: 1.5145532591969966
Energy: 1.5531955915437996
Energy: 1.6189761606261137
Energy: 1.5102440675177538
Energy: 1.633579261669914
Energy: 1.6393780025833775
Energy: 1.4939270400634392
Energy: 1.5939527337651906
Energy: 1.6249288291744592
Energy: 1.4805891290205804
Energy: 1.5201392391963673
Energy: 1.5208953192962298
Energy: 1.5390870753343018
Energy: 1.5288611274974362
Energy: 1.5382679237526073
Energy: 1.5602968260031285
Energy: 1.4836657601625944
Energy: 1.5188745113896098
Energy: 1.6164219812526004
Energy: 1.6665657895654822
Energy: 1.5813032404363243
Energy: 1.5231368160124619
Energy: 1.5125373265515472
Energy: 1.547225418166182
Energy: 1.5305810276586225
Energy: 1.5910436079005439
Energy: 1.497634875957291
Energy: 1.5932922305267183
Energy: 1.558455976726268
Energy: 1.5074347667971342
Energy: 1.4715006523086998
Energy: 1.5564475606959676
Energy: 1.5265052195525985
Energy: 1.5058681881030689
Energy: 1.5567154588194447
Energy: 1.5409226602239303
Energy: 1.4979287586567158
Energy: 1.4936371317126769
Energy: 1.498941695283823
Energy: 1.583686256785822
Energy: 1.5686733294469057
Energy: 1.5656622135325757
Energy: 1.551831974868776
Energy: 1.5108809434266908
Energy: 1.5471187776662694
Energy: 1.5614695696214576
Energy: 1.4990337564604121
Energy: 1.5150398760210262
Energy: 1.4998595428580654
Energy: 1.5151228953199225
Energy: 1.5166906610238937
Energy: 1.612617821086051
Energy: 1.528353710910339
Energy: 1.538671600538455
Energy: 1.5327528290769112
Energy: 1.5530589433912738
Energy: 1.4831481710111136
Energy: 1.4834128407147065
Energy: 1.4688595295412974
Energy: 1.4925978410690475
Energy: 1.6528685078994272
Energy: 1.554094502694679
Energy: 1.5347718676069704
Energy: 1.540296221139323
Energy: 1.556981390085223
Energy: 1.5738432676469987
Energy: 1.5779240434253827
Energy: 1.5834133576563374
Energy: 1.5354740019775415
Energy: 1.5107034548136153
Energy: 1.5405268724659884
Energy: 1.4798322456620039
Energy: 1.5527331956784989
Energy: 1.5644376751994324
Energy: 1.5259560747629526
Energy: 1.5311472808070616
Energy: 1.532063695368033
Energy: 1.579226069484237
Energy: 1.5578285177647706
Energy: 1.5890711953583412
Energy: 1.5910171395294705
Energy: 1.6149579608788198
Energy: 1.54326329168683
Energy: 1.532770870662591
Energy: 1.5314518443475669
Energy: 1.53191914770659
Energy: 1.6182753575689341
Energy: 1.5687112684411133
Energy: 1.5828139387200144
Energy: 1.580840519255202
Energy: 1.5294292629491657
Energy: 1.618693151889401
Energy: 1.6407449446230493
Energy: 1.4716914149709446
Energy: 1.567571368729892
Energy: 1.5691798067997278
Energy: 1.5784473695738088
Energy: 1.5886003363162302
Energy: 1.532294940042616
Energy: 1.529597199738311
Energy: 1.5803553677408513
Energy: 1.5778171060855264
Energy: 1.4965611312024898
Energy: 1.5219108537318202
Energy: 1.5402331196074939
Energy: 1.6342604066048976
Energy: 1.5402524966384912
Energy: 1.5599721437758645
Energy: 1.4967369770850893
Energy: 1.5192194222223472
Energy: 1.5254879308641218
Energy: 1.5881562040551829
Energy: 1.5275843574641172
Energy: 1.5588275337786295
Energy: 1.539486997025319
Energy: 1.5255568023796031
Energy: 1.6890947889890435
Energy: 1.5652936518157605
Energy: 1.550758021338804
Energy: 1.4839211908489445
Energy: 1.516502353601164
Energy: 1.4921500277701152
Energy: 1.5369644103616709
Energy: 1.5557504886726055
Energy: 1.570261961938303
Energy: 1.5422779396592352
Energy: 1.6170399717119746
Energy: 1.695907177593329
Energy: 1.52565587089859
Energy: 1.5215869332623135
Energy: 1.5202377853965159
Energy: 1.4936562354002743
Energy: 1.503419775520534
Energy: 1.5465313047516531
Energy: 1.5034787069909235
Energy: 1.5771424432105623
Energy: 1.5353074110726004
Energy: 1.6178958577354448
Energy: 1.6155236942519462
Energy: 1.5846699551196493
Energy: 1.5192968264839688
Energy: 1.4955732329485043
Energy: 1.5539294683057014
Energy: 1.5940240828379681
Energy: 1.5857536159196741
Energy: 1.5532747918975978
Energy: 1.5539294943382855
Energy: 1.5553666741084133
Energy: 1.520866911156589
Energy: 1.6213643326826985
Energy: 1.5544834546095803
Energy: 1.5079782756728162
Energy: 1.541408841222343
Energy: 1.6220599759835594
Energy: 1.5367323442837033
Energy: 1.509542368336701
Energy: 1.5557738695889938
Energy: 1.5811843748305126
Energy: 1.5252514678292795
Energy: 1.617865624506129
Energy: 1.56538901526879
Energy: 1.465090559836814
Energy: 1.5750906739044201
Energy: 1.6343769435143003
Energy: 1.5464593329890508
Energy: 1.5281810235985371
Energy: 1.556888597982364
Energy: 1.6082463760015735
Energy: 1.527732128150471
Energy: 1.5938547969411354
Energy: 1.5396371465868315
Energy: 1.4930101951677894
Energy: 1.6269891432035162
Energy: 1.5942159687334339
Energy: 1.4705044415919075
Energy: 1.5358239709838355
Energy: 1.5117600859384555
Energy: 1.5353743385601304
Energy: 1.5606667141528585
Energy: 1.6502230777915514
Energy: 1.5025905735304297
Energy: 1.5657239787042803
Energy: 1.4701295879849157
Energy: 1.489447352519709
Energy: 1.5614304360060058
Energy: 1.5324390849971643
Energy: 1.5629279224797217
Energy: 1.5520185084919802
Energy: 1.511949727469908
Energy: 1.5339085226923774
Energy: 1.5772316503521735
Energy: 1.6102990969557032
Energy: 1.490895031845332
Energy: 1.5404095329311853
Energy: 1.548698364269323
Energy: 1.5155999567379927
Energy: 1.5293327514043937
Energy: 1.5347531875846745
Energy: 1.4955711426820517
Energy: 1.540590333067085
Energy: 1.621325602011883
Energy: 1.4939580741949194
Energy: 1.5141048379360529
Energy: 1.6370486078228217
Energy: 1.4840611233552166
Energy: 1.4838591100423897
Energy: 1.5236660856178919
Energy: 1.5084491899296346
Energy: 1.5090770073779969
Energy: 1.6235768417027199
Energy: 1.6396949591422276
Energy: 1.511523735843649
Energy: 1.5393765783566506
Energy: 1.5179127637389007
Energy: 1.528859760916358
Energy: 1.5858612266609706
Energy: 1.5168483665341062
Energy: 1.5131252080276052
Energy: 1.5318731525535216
Energy: 1.565931878021887
Energy: 1.5432842586039215
Energy: 1.482495932532896
Energy: 1.560403603434159
Energy: 1.647861664543854
Energy: 1.5493411308007894
Energy: 1.4643937744529731
Energy: 1.5581139250668667
Energy: 1.5726244263528302
Energy: 1.513899709511903
Energy: 1.5667819713372502
Energy: 1.5102145183130644
Energy: 1.4928071135995398
Energy: 1.5462415397109248
Energy: 1.4983337824160752
Energy: 1.582737135847427
Energy: 1.6349337117878506
Energy: 1.616020512060373
Energy: 1.4939711234148523
Energy: 1.569021531029842
Energy: 1.558613979683885
Energy: 1.5236978780949002
Energy: 1.497443579765991
Energy: 1.4966721596337123
Energy: 1.5183106863252394
Energy: 1.616906323863372
Energy: 1.5282050705787824
Energy: 1.5783555418250268
Energy: 1.5825676137517537
Energy: 1.5458062462225386
Energy: 1.5636698288280193
Energy: 1.546081741387083
Energy: 1.5028208251160189
Energy: 1.5133666579222858
Energy: 1.5322541375260876
Energy: 1.514485197027962
Energy: 1.5566984724264326
Energy: 1.5236896516249916
Energy: 1.4723097206014013
Energy: 1.4954301559897616
Energy: 1.5321574601622951
Energy: 1.5253561130498887
Energy: 1.482631453976803
Energy: 1.48507227083722
Energy: 1.5379951881942857
Energy: 1.5188385522074184
Energy: 1.5322143294299768
Energy: 1.4793275686617189
Energy: 1.52808311929688
Energy: 1.5402688626038916
Energy: 1.5079893993748845
Energy: 1.51758862238764
Energy: 1.5773363064457147
Energy: 1.5830418371915156
Energy: 1.559398147275902
Energy: 1.5853523931377735
Energy: 1.587410203699382
Energy: 1.615808619589651
Energy: 1.6801071619296422
Energy: 1.5574947465190185
Energy: 1.5662128356730014
Energy: 1.5690248104204172
Energy: 1.6151115240764706
Energy: 1.58074919193928
Energy: 1.5626573171809681
Energy: 1.5799887228346383
Energy: 1.531118787058019
Energy: 1.6183680939342715
Energy: 1.6150689040632367
Energy: 1.5319484859673655
Energy: 1.5392476097726346
Energy: 1.5319525488260548
Energy: 1.6158713429519118
Energy: 1.5721654787155541
Energy: 1.559220599206091
Energy: 1.531076848121889
Energy: 1.5814305958337525
Energy: 1.554031558035421
Energy: 1.4985344491000518
Energy: 1.4194647919867198
Energy: 1.5509759686803202
Energy: 1.5679686672965367
Energy: 1.5776868461414244
Energy: 1.5661583519198439
Energy: 1.4965761760102656
Energy: 1.518344669351822
Energy: 1.5231460686547953
Energy: 1.579058602659711
Energy: 1.531686334697968
Energy: 1.523295827463372
Energy: 1.620104435069167
Energy: 1.6213614286588387
Energy: 1.5019413358861091
Energy: 1.5512988041730715
Energy: 1.5946656394339618
Energy: 1.4852752016764237
Energy: 1.5173403049856675
Energy: 1.4934602372601422
Energy: 1.5285405948516158
Energy: 1.5582846758165896
Energy: 1.5451014810048893
Energy: 1.5302523320729786
Energy: 1.680152572609288
Energy: 1.516941178663101
Energy: 1.5279572771020198
Energy: 1.5202091212967956
Energy: 1.5208664096051694
Energy: 1.4947080532762094
Energy: 1.4929457356844769
Energy: 1.5567665264512993
Energy: 1.5640470259185326
Energy: 1.531960126279443
Energy: 1.6170542850313256
Energy: 1.6321723999899176
Energy: 1.5445533539952006
Energy: 1.531702112347034
Energy: 1.4974236584939835
Energy: 1.495564623527046
Energy: 1.5867906029595773
Energy: 1.5467556280108552
Energy: 1.450048680041314
Energy: 1.539231849344393
Energy: 1.5582680978772314
Energy: 1.5282893956442014

minimum gb energy = 1.4194647919867198 eV
minimum distance =  2.29679109158047 Angstroms
sigma value = 293


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

Energy: 1.7522110201338754
Energy: 1.2243087208982466
Energy: 1.3818223620480967
Energy: 1.3845296780875227
Energy: 1.223311008838515
Energy: 1.438830798597989
Energy: 1.229027725584862
Energy: 1.22912993442786
Energy: 1.2253736583786843
Energy: 1.0814285189195085
Energy: 1.3439067121092416
Energy: 1.2279230695130363
Energy: 1.381962959665066
Energy: 1.1278129215095918
Energy: 1.2292542120143173
Energy: 1.2237628156060856
Energy: 1.2288413815487598
Energy: 1.2377025272153976
Energy: 1.4172953403054784
Energy: 1.220572238149984
Energy: 1.38060425013229
Energy: 1.4096736469695657
Energy: 1.2223945677747337
Energy: 1.2287192569153316
Energy: 1.3841391169397796
Energy: 1.3788653991703386
Energy: 1.2370307163319336
Energy: 1.230069323258685
Energy: 1.2251066648696034
Energy: 1.2224673710104765
Energy: 1.2211389790342395
Energy: 1.0767827513619872
Energy: 1.0719970894290942
Energy: 1.3787516767367332
Energy: 1.4024989272374937
Energy: 1.377921543739663
Energy: 1.220667937362065
Energy: 1.2269845347654043
Energy: 1.076385997400102
Energy: 1.2307537501247519
Energy: 1.2329936793431733
Energy: 1.6796871501948878
Energy: 1.0768072643629278
Energy: 1.2214575818915374
Energy: 1.2289837472108291
Energy: 1.1288447407689677
Energy: 1.4162652720434497
Energy: 1.224954867277614
Energy: 1.2303115977918162
Energy: 1.229079916956197
Energy: 1.2273987086233396
Energy: 1.2242450498744424
Energy: 1.383517598864593
Energy: 1.4157021114845174
Energy: 1.3839306107988067
Energy: 1.2312040871582646
Energy: 1.221238019817455
Energy: 1.2219198119582328
Energy: 1.2355851951124333
Energy: 1.2418499347337333
Energy: 1.2281716766649364
Energy: 1.3865794900507655
Energy: 1.3802147991197202
Energy: 1.4129370036256592
Energy: 1.2210887734185352
Energy: 1.3827420252459415
Energy: 1.382826546471525
Energy: 1.3801418515137032
Energy: 1.228627731060788
Energy: 1.2295710433393452
Energy: 1.0704316233457873
Energy: 1.2284417372852072
Energy: 1.217921993880712
Energy: 1.0773070673203302
Energy: 1.6732881048188417
Energy: 1.3764454378035063
Energy: 1.4071291658467728
Energy: 1.221142270777069
Energy: 1.2342329354144654
Energy: 1.412163312735252
Energy: 1.2280950645675894
Energy: 1.2413041281598194
Energy: 1.4181583417654555
Energy: 1.0758425851029303
Energy: 1.232480384547703
Energy: 1.2193741523310058
Energy: 1.2211756497020885
Energy: 1.389347735374728
Energy: 1.2202387133202388
Energy: 1.228979485817902
Energy: 1.2298634844367755
Energy: 1.2298134409476162
Energy: 1.2358491413238553
Energy: 1.3809459345418482
Energy: 1.3841072967766164
Energy: 1.4164427025582655
Energy: 1.2211113775163336
Energy: 1.3861229254393108
Energy: 1.375849140351818
Energy: 1.4373727216576953
Energy: 1.2299987980508933
Energy: 1.227570629184396
Energy: 1.0795562821359637
Energy: 1.3741412632712104
Energy: 1.2291554039300014
Energy: 1.0737120864612466
Energy: 1.3835272942217363
Energy: 1.4130155566802098
Energy: 1.3808503644027181
Energy: 1.2217284262080184
Energy: 1.437991854790876
Energy: 1.2295910147855833
Energy: 1.2374708719311194
Energy: 1.2198502666468356
Energy: 1.0842104076244312
Energy: 1.083083924030844
Energy: 1.222563930571507
Energy: 1.385660647989535
Energy: 1.230626825572344
Energy: 1.2372969355888097
Energy: 1.2225027634496755
Energy: 1.2280727645120404
Energy: 1.2350357445339477
Energy: 1.4164277044381879
Energy: 1.2189370676628228
Energy: 1.2329691312608535
Energy: 1.377233021251719
Energy: 1.3755127325360479
Energy: 1.1282951049486745
Energy: 1.22867132935055
Energy: 1.378476297572598
Energy: 1.2395299527599961
Energy: 1.2335667408699846
Energy: 1.234398813497083
Energy: 1.2227018883175707
Energy: 1.3759709577310264
Energy: 1.4095094065290785
Energy: 1.222712460111488
Energy: 1.375463443772329
Energy: 1.3833604772245667
Energy: 1.3788478738332428
Energy: 1.2237013190539825
Energy: 1.2338089487016466
Energy: 1.0779418656811102
Energy: 1.2294675524751684
Energy: 1.2222356166321424
Energy: 1.0769624889732587
Energy: 1.078605734839001
Energy: 1.3873189387383393
Energy: 1.4091513524151973
Energy: 1.129513437195576
Energy: 1.4182543704854145
Energy: 1.2285964408009875
Energy: 1.230931977397004
Energy: 1.2372975050444062
Energy: 1.2269631479043621
Energy: 1.0798953964795381
Energy: 1.076753853535143
Energy: 1.2208139798947713
Energy: 1.229599990482164
Energy: 1.3842045649856491
Energy: 1.3761096371977544
Energy: 1.2202156445503793
Energy: 1.235803952215986
Energy: 1.2394885238379807
Energy: 1.231107643483189
Energy: 1.2205591602028683
Energy: 1.3821787524721583
Energy: 1.4156998095918747
Energy: 1.3836909365635013
Energy: 1.3808236264773628
Energy: 1.3837990711920125
Energy: 1.3744511704786828
Energy: 1.2293512807979547
Energy: 1.2302507301264254
Energy: 1.227705730550461
Energy: 1.3866163298165908
Energy: 1.378660948971801
Energy: 1.2304298623513361
Energy: 1.220681868609126
Energy: 1.3770710265623354
Energy: 1.3859007791149383
Energy: 1.2282571860226263
Energy: 1.241553880082765
Energy: 1.4130539916307912
Energy: 1.2318904514268567
Energy: 1.2296738329293257
Energy: 1.2245689677568372
Energy: 1.077395354903449
Energy: 1.0790936341537214
Energy: 1.2199841478451559
Energy: 1.2281739348334144
Energy: 1.128900392507598
Energy: 1.2185953533807306
Energy: 1.2311624641612193
Energy: 1.227838422743333
Energy: 1.228033274961388
Energy: 1.2339209332134755
Energy: 1.0765096756303598
Energy: 1.2319119646417993
Energy: 1.4157752714858916
Energy: 1.2224786867679986
Energy: 1.4120506494336433
Energy: 1.3761938511655565
Energy: 1.3830254644539537
Energy: 1.2369441785885429
Energy: 1.2320211539048553
Energy: 1.227922294555908
Energy: 1.3767258048395399
Energy: 1.4073897537820148
Energy: 1.076679174554121
Energy: 1.241958319053577
Energy: 1.4145793291752506
Energy: 1.382703777095691
Energy: 1.21948496095109
Energy: 1.227051528864675
Energy: 1.2266899155805224
Energy: 1.4154252653017478
Energy: 1.3794012153476711
Energy: 1.2308750459293967

minimum gb energy = 1.0704316233457873 eV
minimum distance =  2.39923590395229 Angstroms
sigma value = 15


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

Energy: 1.3202935058062848
Energy: 1.2318197594508282
Energy: 1.2289166244224543
Energy: 1.2304125682910625
Energy: 1.218660446650391
Energy: 1.2601943011878716
Energy: 1.2139690436420891
Energy: 1.2196726871460801
Energy: 1.2220447561901095
Energy: 1.2584731924010293
Energy: 1.370434190075949
Energy: 1.2882887364707682
Energy: 1.2613584917423317
Energy: 1.214470178595962
Energy: 1.2224788766283068
Energy: 1.2973410375238144
Energy: 1.2113194366492313
Energy: 1.2108491399377415
Energy: 1.2198284848033132
Energy: 1.4715667699072124
Energy: 1.3644872650084643
Energy: 1.242866513400034
Energy: 1.3829129916849958
Energy: 1.229837939787443
Energy: 1.2230064286811597
Energy: 1.2252460445517137
Energy: 1.2173492058531792
Energy: 1.2117684993340103
Energy: 1.2346093599257733
Energy: 1.2282871572709726
Energy: 1.2499166558395216
Energy: 1.3951181467427964
Energy: 1.3435234501066633
Energy: 1.2498242406444535
Energy: 1.2292874662395152
Energy: 1.220283629603155
Energy: 1.2247427068165582
Energy: 1.2462727993425777
Energy: 1.1977695814751315
Energy: 1.341451237087592
Energy: 1.2104177055588092
Energy: 1.311324554625704
Energy: 1.2263899122127204
Energy: 1.2156460944292595
Energy: 1.3143209034395842
Energy: 1.222810277127339
Energy: 1.314039327741112
Energy: 1.2343246775544672
Energy: 1.3783930125066857
Energy: 1.2168322664420792
Energy: 1.2292326458593692
Energy: 1.3814546276667128
Energy: 1.2899453385258854
Energy: 1.3750019512587388
Energy: 1.4128333676037734
Energy: 1.296168814831579
Energy: 1.3230558429577008
Energy: 1.3043708976100186
Energy: 1.3776211477720017
Energy: 1.3847470454422692
Energy: 1.2178896618135722
Energy: 1.385599571370788
Energy: 1.3806481964987418
Energy: 1.3621554075092837
Energy: 1.3708683514419182
Energy: 1.2247221613050676
Energy: 1.3133365137790138
Energy: 1.3113362863670146
Energy: 1.3849205587333584
Energy: 1.383267070934821
Energy: 1.2187907137337042
Energy: 1.4193820788063445
Energy: 1.4401369620989095
Energy: 1.1835191849983715
Energy: 1.3824832414599333
Energy: 1.3821738079672798
Energy: 1.3232029229306017
Energy: 1.3254026574807471
Energy: 1.3819538836604
Energy: 1.4221356130401415
Energy: 1.4068745744045021
Energy: 1.381939935694823
Energy: 1.3784419316333887
Energy: 1.33989419211464
Energy: 1.3817678139789382
Energy: 1.3798095082252477
Energy: 1.4528294253505414
Energy: 1.315701364961621
Energy: 1.1880561732361845
Energy: 1.37799613236313
Energy: 1.3670452569456488
Energy: 1.3658187611912007
Energy: 1.3711453272860494
Energy: 1.274421774642818
Energy: 1.2413656580552326
Energy: 1.3769085823130975
Energy: 1.3139906400871855
Energy: 1.320483439267113
Energy: 1.295737145140939
Energy: 1.364943244142827
Energy: 1.202216290498358
Energy: 1.3308382151149956
Energy: 1.38010355046279
Energy: 1.2010195140230064
Energy: 1.1940483697804118
Energy: 1.3790005448437028
Energy: 1.1913203469949334
Energy: 1.4222776562974266
Energy: 1.1895219176997207
Energy: 1.313824267836625
Energy: 1.3156277701078558
Energy: 1.3599873395155617
Energy: 1.3060169435271045
Energy: 1.383405292117523
Energy: 1.3757807116929959
Energy: 1.2635772341544875
Energy: 1.2048325742197945
Energy: 1.2137774977665043
Energy: 1.190244827502859
Energy: 1.1906387350294985
Energy: 1.1823713670898008
Energy: 1.3690475245997438
Energy: 1.3770574708696925
Energy: 1.4649273682915371
Energy: 1.241255481527394
Energy: 1.1868365587483178
Energy: 1.1981136645882207
Energy: 1.204252764998905
Energy: 1.188067018525518
Energy: 1.1913524228518573
Energy: 1.1954931618745253
Energy: 1.238561179361629
Energy: 1.3130239563331234
Energy: 1.285319471462963
Energy: 1.4152888972487874
Energy: 1.2147681225145979
Energy: 1.206301748413729
Energy: 1.196446372944435
Energy: 1.2968180356216203
Energy: 1.197559782954672
Energy: 1.2325659804514064
Energy: 1.1960315963321253
Energy: 1.1912538626984726
Energy: 1.3839325744333912
Energy: 1.1785433414787954
Energy: 1.1902935053369805
Energy: 1.2068919216432872
Energy: 1.2016595312319014
Energy: 1.2162851407455435
Energy: 1.1911235092665244
Energy: 1.2247530148221233
Energy: 1.1935454651508146
Energy: 1.2922662836883998
Energy: 1.2365648407804295
Energy: 1.2450822436960063
Energy: 1.2400203342414755
Energy: 1.2451705344707222
Energy: 1.2073028007440105
Energy: 1.2063177863873233
Energy: 1.2385337200147652
Energy: 1.2311202719347667
Energy: 1.2267438771453303
Energy: 1.4241410297236727
Energy: 1.416520419793999
Energy: 1.3966089815393392
Energy: 1.3709528707579777
Energy: 1.2164440149985922
Energy: 1.207427108100273
Energy: 1.2079170182103096
Energy: 1.259552073951722
Energy: 1.3831439062451736
Energy: 1.4028010401997157
Energy: 1.2374619586430256
Energy: 1.3142309067802815
Energy: 1.4459125144273226
Energy: 1.3326492624951014
Energy: 1.3125764398669577
Energy: 1.3005206516295846
Energy: 1.2044816149706374
Energy: 1.2062968898443558
Energy: 1.2559332991001841
Energy: 1.3123735474432798
Energy: 1.1911042200766762
Energy: 1.2304183302959828
Energy: 1.3984709504911788
Energy: 1.239474534691206
Energy: 1.2381367778393297
Energy: 1.2531599131345605
Energy: 1.3281203092444602
Energy: 1.4535591089157944
Energy: 1.3129052545504958
Energy: 1.4224438573498166
Energy: 1.4301831511959862
Energy: 1.2406905552992684
Energy: 1.3467327849437636
Energy: 1.291080433055412
Energy: 1.3951080237726232
Energy: 1.4420316564260214
Energy: 1.206351504917203
Energy: 1.322185092438205
Energy: 1.3185023954541253
Energy: 1.3045218034088941
Energy: 1.4538342131616608
Energy: 1.2516552175873148
Energy: 1.2764833792727386
Energy: 1.2946218104963374
Energy: 1.2985977296342714
Energy: 1.3892344730069124
Energy: 1.3105733673407178
Energy: 1.3399038297335566
Energy: 1.3080412340807468
Energy: 1.3219487053365293
Energy: 1.2971587944198026
Energy: 1.3781764617783279
Energy: 1.4685624625883027
Energy: 1.3360852054759227
Energy: 1.1812224673336826
Energy: 1.455220553692741
Energy: 1.4305977789796571
Energy: 1.28095689938872
Energy: 1.310745256366956
Energy: 1.2766818284803743
Energy: 1.2742565637304846
Energy: 1.3470609612509123
Energy: 1.3672732426328404
Energy: 1.4697837951722648
Energy: 1.3775168838424607
Energy: 1.2995631684968636
Energy: 1.2943831699716195
Energy: 1.3298207738506223
Energy: 1.3132772961936234
Energy: 1.2760386827203116
Energy: 1.2651284239618465
Energy: 1.3378315354391894
Energy: 1.333782903185469
Energy: 1.421419186808542
Energy: 1.4379813637257002
Energy: 1.304764819712971
Energy: 1.2921492597197828
Energy: 1.30776790186359
Energy: 1.2712400481614534
Energy: 1.3170136768952148
Energy: 1.2747739692713758
Energy: 1.2616901579457642
Energy: 1.1546451468092158
Energy: 1.2859789650912679
Energy: 1.26092002252672
Energy: 1.275433735135312
Energy: 1.285115854563163
Energy: 1.2716564739526799
Energy: 1.2815249270661166
Energy: 1.278659554236611
Energy: 1.2688501709818545
Energy: 1.275979335043067
Energy: 1.3538205769544271
Energy: 1.1384705314784407
Energy: 1.5264693395597222
Energy: 1.3396352019778783
Energy: 1.1814838650720343
Energy: 1.276893471806389
Energy: 1.2752426698622366
Energy: 1.2805779142273204
Energy: 1.2719013847395104
Energy: 1.2941146213572636
Energy: 1.3057460584554483
Energy: 1.3159290479415993
Energy: 1.3115085818842012
Energy: 1.3951932885877427
Energy: 1.2947720687982962
Energy: 1.2756123030991828
Energy: 1.2744656313846312
Energy: 1.2808529577481158
Energy: 1.2778291207303345
Energy: 1.1920491428171607
Energy: 1.312629703176788
Energy: 1.3387249796212846
Energy: 1.1626299368986022
Energy: 1.3707124639408477
Energy: 1.3115143435109398
Energy: 1.2861652233756065
Energy: 1.2809908464683641
Energy: 1.3552322815984508
Energy: 1.289062717056134
Energy: 1.3474674788590433
Energy: 1.283908240179654
Energy: 1.2729785040113555
Energy: 1.2303762967972431
Energy: 1.2506970118103977
Energy: 1.2753029495403858
Energy: 1.2900189334193768
Energy: 1.280944470481856
Energy: 1.2808605462168148
Energy: 1.326307828453666
Energy: 1.347156209576611
Energy: 1.3573750101243087
Energy: 1.2916926028873597
Energy: 1.3955734515408451
Energy: 1.2909443532895148
Energy: 1.5328227161948105
Energy: 1.3624075563290765
Energy: 1.2766209249317915
Energy: 1.289313924454521
Energy: 1.3807048360260115
Energy: 1.3563991166114922
Energy: 1.3488944049789136
Energy: 1.2665878573740508
Energy: 1.3165171398165836
Energy: 1.3825117292981857
Energy: 1.364745900776028
Energy: 1.315092647295724
Energy: 1.356433834441711
Energy: 1.322077544236953
Energy: 1.322568498195821
Energy: 1.2713392116078512
Energy: 1.2489648455231988
Energy: 1.227017372020319
Energy: 1.1948799584290886
Energy: 1.2651180878003287
Energy: 1.185022899235416
Energy: 1.2744038817762096
Energy: 1.2682962980717514
Energy: 1.3065694577080778
Energy: 1.293793654678964
Energy: 1.205169381205785
Energy: 1.3912815146046091
Energy: 1.3142180423392442
Energy: 1.3489182560141069
Energy: 1.3563222765881122
Energy: 1.4066790447874888
Energy: 1.3849668951812584
Energy: 1.3791158016065364
Energy: 1.3776880266940605
Energy: 1.3211980704720545
Energy: 1.2887979909806309
Energy: 1.3580978798227812
Energy: 1.3964706665168019
Energy: 1.357170239787006
Energy: 1.315582780810111
Energy: 1.2312861784672522
Energy: 1.3848328098839482
Energy: 1.3799939055625268
Energy: 1.1889106649099466
Energy: 1.3426805627281475
Energy: 1.3421462713324428
Energy: 1.3052363978998882
Energy: 1.2123791970142916
Energy: 1.333580624647028
Energy: 1.3796979009895665
Energy: 1.2069954292669767
Energy: 1.1876682611584906
Energy: 1.2626541014940607
Energy: 1.4112917243509802
Energy: 1.1897238170049032
Energy: 1.2058453782295184
Energy: 1.2134782664974444
Energy: 1.1960926043793925
Energy: 1.271163081487091
Energy: 1.2340359582034484
Energy: 1.2167258562786436
Energy: 1.1627066138961595
Energy: 1.1903720705240308
Energy: 1.2038151926721163
Energy: 1.2124538371370388
Energy: 1.2076688908290583
Energy: 1.212248303814622
Energy: 1.188086636199152
Energy: 1.368299923417341
Energy: 1.4054928390920693
Energy: 1.402292890740496
Energy: 1.187589712645764
Energy: 1.194373932107671
Energy: 1.2168855137775747
Energy: 1.2072603656668315
Energy: 1.2900304082134744
Energy: 1.2112271027150026
Energy: 1.1925559544151945
Energy: 1.2399482819497587
Energy: 1.2603798928390275
Energy: 1.4487332127016899
Energy: 1.4295024571583679
Energy: 1.1966670451920247
Energy: 1.2169491064748927
Energy: 1.2058513149494074
Energy: 1.231639190140448
Energy: 1.2300361491032146
Energy: 1.18451122234351
Energy: 1.2132045307774948
Energy: 1.210484335419508
Energy: 1.2440872591176488
Energy: 1.184852768689531
Energy: 1.2385568901002064
Energy: 1.2620700350952383
Energy: 1.2180305617621097
Energy: 1.2134106537113485
Energy: 1.2391738739312326
Energy: 1.2279409687977854
Energy: 1.1923523744145816
Energy: 1.2453509615900151
Energy: 1.3985909605798326
Energy: 1.3989595044210936
Energy: 1.3349265984907128
Energy: 1.2503875737798615
Energy: 1.2145590713487646
Energy: 1.2197721167593705
Energy: 1.225464258515221
Energy: 1.2285690995980232
Energy: 1.2340857353244543
Energy: 1.4787432864766314
Energy: 1.3614434255497077
Energy: 1.349880195633885
Energy: 1.33278706747583
Energy: 1.2547074959109885
Energy: 1.2757215774728663
Energy: 1.2086604010576354
Energy: 1.218648357132427
Energy: 1.2322029066425984
Energy: 1.2509884665672446
Energy: 1.3292176729650482
Energy: 1.4808736079762406
Energy: 1.470989246958964
Energy: 1.186072159572611
Energy: 1.2346775492808115
Energy: 1.2389919239592355
Energy: 1.3309542056805737
Energy: 1.4088401474689147
Energy: 1.2286487656529381
Energy: 1.4076469267639165
Energy: 1.1872475374312756
Energy: 1.229039949597922
Energy: 1.343462215293478
Energy: 1.2535200619418996
Energy: 1.4707006458074907
Energy: 1.4752298778410204
Energy: 1.2100225167163576
Energy: 1.3311467043745282
Energy: 1.2169411524882832
Energy: 1.4761191100171143
Energy: 1.4781350207833939
Energy: 1.2089932319362748
Energy: 1.3404948705413549
Energy: 1.2292849933178562
Energy: 1.272878940612498
Energy: 1.4742817800467802
Energy: 1.2165035090175893
Energy: 1.3366523450846353
Energy: 1.3390401564377374
Energy: 1.2282710558701428
Energy: 1.481369652638469
Energy: 1.2549278251469445
Energy: 1.3345235869238357
Energy: 1.2347368096831335
Energy: 1.180822581149348
Energy: 1.1825896098300934
Energy: 1.4797875595103316
Energy: 1.21825021077606
Energy: 1.2133601135509275
Energy: 1.3358657098295308
Energy: 1.2337957224701694
Energy: 1.4036207119401884
Energy: 1.2705090609243348
Energy: 1.478603432898086
Energy: 1.2981346732576278
Energy: 1.2378313759930395
Energy: 1.2299414827961122
Energy: 1.283035804525582
Energy: 1.217923756586777
Energy: 1.218551356704953
Energy: 1.2493895114499034
Energy: 1.3334754128845316
Energy: 1.4411109376106468
Energy: 1.4128092835893873
Energy: 1.4739702839696054
Energy: 1.2333675682995853
Energy: 1.2242167649991338
Energy: 1.2363998047068343
Energy: 1.2166023527675167
Energy: 1.2175651470849067
Energy: 1.253104724286148
Energy: 1.2956833575237434
Energy: 1.3286211225006048
Energy: 1.2410742304724467
Energy: 1.2224122003331854
Energy: 1.2242532304990332
Energy: 1.2284796872363897
Energy: 1.217105133815073
Energy: 1.3328186998094576
Energy: 1.2566895450849969
Energy: 1.218260715692469
Energy: 1.22272694031618
Energy: 1.1829623127222488

minimum gb energy = 1.1384705314784407 eV
minimum distance =  2.29033237716937 Angstroms
sigma value = 437


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

Energy: 1.4717764045726998
Energy: 1.2774759577078076
Energy: 1.272218096479282
Energy: 1.2782657020918706
Energy: 1.2903506464631878
Energy: 1.5231636966259838
Energy: 1.286416357319716
Energy: 1.2735732788190222
Energy: 1.2780202010706507
Energy: 1.2545166989331669
Energy: 1.2918048310198484
Energy: 1.264541368846344
Energy: 1.2910725558594676
Energy: 1.2894384270967765
Energy: 1.2683085129044347
Energy: 1.3330407719621964
Energy: 1.2710383647354342
Energy: 1.2628743008697176
Energy: 1.4102644836715095
Energy: 1.2847798258862333
Energy: 1.2976473084353508
Energy: 1.263201536128308
Energy: 1.2847421344170276
Energy: 1.2917651861994484
Energy: 1.265005633947402
Energy: 1.270062794042473
Energy: 1.2624700163277418
Energy: 1.2687342052591024
Energy: 1.2670859571870825
Energy: 1.2840551582490853
Energy: 1.298285525974651
Energy: 1.2672742706888467
Energy: 1.2718341567438127
Energy: 1.4223957571502006
Energy: 1.259452943875654
Energy: 1.3289157689293143
Energy: 1.270454617384729
Energy: 1.3225751362445766
Energy: 1.2485239871246299
Energy: 1.2535026106710039
Energy: 1.2730579260636727
Energy: 1.399885388355751
Energy: 1.246606164822852
Energy: 1.3287324029746237
Energy: 1.3220730448189804
Energy: 1.294200591136681
Energy: 1.2923785093740834
Energy: 1.2916728180999941
Energy: 1.291199573491828
Energy: 1.26611995681433
Energy: 1.269345430309118
Energy: 1.2857771743893325
Energy: 1.264829314773936
Energy: 1.2854454507240627
Energy: 1.2935714775682319
Energy: 1.330766101612609
Energy: 1.2709670453826605
Energy: 1.2848477062719863
Energy: 1.2955662768227643
Energy: 1.262596928758134
Energy: 1.2509690286628092
Energy: 1.4225493462456935
Energy: 1.2679813278901182
Energy: 1.2674864821864975
Energy: 1.2828605618123312
Energy: 1.3293684365702592
Energy: 1.2878220372209184
Energy: 1.291812092953937
Energy: 1.2912569577709874
Energy: 1.2680282026060266
Energy: 1.2477578341516151
Energy: 1.383456005297676
Energy: 1.3237688836099846
Energy: 1.2718497233927835
Energy: 1.4252921551450364
Energy: 1.5030594915579734
Energy: 1.2754259521061746
Energy: 1.2758145608925882
Energy: 1.4162603437337549
Energy: 1.5218348695566193
Energy: 1.2946751372044738
Energy: 1.26436003697354
Energy: 1.2947299928527058
Energy: 1.2900804780932167
Energy: 1.2669479891220654
Energy: 1.331352970398547
Energy: 1.2630461856863795
Energy: 1.2689257218547376
Energy: 1.2655519714215862
Energy: 1.2845457804661593
Energy: 1.2925306216456887
Energy: 1.2650482353810555
Energy: 1.286409459268236
Energy: 1.272942491383381
Energy: 1.2674053298705914
Energy: 1.2670456986807692
Energy: 1.2632071314219477
Energy: 1.2708875583140962
Energy: 1.245225674270713
Energy: 1.4298143693658876
Energy: 1.280051770179123
Energy: 1.2480791424039372
Energy: 1.3942785544772525
Energy: 1.2778187998174901
Energy: 1.26499190152646
Energy: 1.330080738570417
Energy: 1.2914783009016757
Energy: 1.2918910574018576
Energy: 1.2438202106864904
Energy: 1.330318827383951
Energy: 1.2703025121761171
Energy: 1.2871932170950922
Energy: 1.2461831750702643
Energy: 1.2917630816550203
Energy: 1.292863556133701
Energy: 1.2848864691553699
Energy: 1.2733462786256085
Energy: 1.28439241804362
Energy: 1.2990928957785073
Energy: 1.264802964954708
Energy: 1.4155873331175344
Energy: 1.2845894675764233
Energy: 1.264142914607238
Energy: 1.2919790040114314
Energy: 1.2831583758435605
Energy: 1.3286080931478284
Energy: 1.2709805185675758
Energy: 1.2858656550517886
Energy: 1.2915859627823063
Energy: 1.2649547614614616
Energy: 1.247109988270477
Energy: 1.2751364069912714
Energy: 1.2700236253530492
Energy: 1.2698963721928758
Energy: 1.28294559180852
Energy: 1.424298790646752
Energy: 1.297477984025937
Energy: 1.2738007365342114
Energy: 1.3234812590114717
Energy: 1.2434836656657027

minimum gb energy = 1.2434836656657027 eV
minimum distance =  2.3543563184795 Angstroms
sigma value = 33