Model name: model_name=EAM_Dynamo_VailheFarkas_1997_CoAl__MO_284963179498_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049696564674378
cohesive_energy=3.3687229668997767
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.5504119091320937e-19, 2.2559768530363795e-19, 2.7727268828003996e-19, 3.18145816390014e-19, 3.51743460404994e-19, 3.79997845345584e-19, 4.04110603687284e-19, 4.24882823747094e-19, 4.428880847599859e-19, 4.58555770063872e-19, 4.72206314985552e-19, 4.8410568084627e-19, 4.94460548431812e-19, 5.03429533228944e-19, 5.11153626781458e-19, 5.177513901602699e-19, 5.233253626699559e-19, 5.279604596721179e-19, 5.317303812919199e-19, 5.347040211246239e-19, 5.3693745535242e-19, 5.384835558042299e-19, 5.393855812491719e-19, 5.396867904563639e-19, 5.39390387779074e-19, 5.384162643856019e-19, 5.366490635583e-19, 5.339558046365459e-19, 5.30187485193378e-19, 5.25155048385984e-19, 5.1863739383887195e-19, 5.10371764584066e-19, 5.00037725294766e-19, 4.87255560108714e-19, 4.7155422909551395e-19, 4.52360153020194e-19, 4.2896196545725796e-19, 4.0047526490473795e-19, 3.6579615166180794e-19, 3.2351150593728e-19, 2.71794846368394e-19, 2.0827975806673198e-19, 1.2986234423924578e-19, 3.23626862654928e-20, -8.98849930853412e-20, -2.4479977226212796e-19, -4.43631494718162e-19, -7.02721080378936e-19, -1.0470656890881179e-18, -1.515729591535896e-18, -6.4003752175032e-18]
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: 0.0103523273477852
Energy: 0.010658651583403093
Energy: 0.010634805818882985
Energy: 0.011764499493024428
Energy: 0.11184158715379022
Energy: 0.010687611638388148
Energy: 0.010658651584402675
Energy: 0.05067073005795518
Energy: 0.0505903731347496
Energy: 0.05066887675272717
Energy: 0.05065289847479263
Energy: 0.05082611510819084
Energy: 0.010634805818660857
Energy: 0.050590373135221633
Energy: 0.05060609031786298
Energy: 0.010662274640848573
Energy: 0.05056265598919569
Energy: 0.05162380800391095
Energy: 0.011764499493024428
Energy: 0.050668876752977064
Energy: 0.01066227464159826
Energy: 0.01049637353099688
Energy: 0.050557914417835255
Energy: 0.010800865888067772
Energy: 0.11184158715451215
Energy: 0.05065289847479263
Energy: 0.05056265598919569
Energy: 0.050557914417613134
Energy: 0.05071316357792874
Energy: 0.05066877428870937
Energy: 0.010687611638138252
Energy: 0.05082611510844074
Energy: 0.05162380800391095
Energy: 0.0108008658882899
Energy: 0.05066877428795968
Energy: 0.010704879289833208

minimum gb energy = 0.0103523273477852 eV
minimum distance =  2.8555695538891 Angstroms
sigma value = 1


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

Energy: 0.46039533281849343
Energy: 0.33583649012695643
Energy: 0.35578747447053
Energy: 0.3430339389001662
Energy: 0.3407761315853076
Energy: 0.355964442906092
Energy: 0.41467212045479224
Energy: 0.31713689665673483
Energy: 0.3138255273534309
Energy: 0.3479856201468468
Energy: 0.32755363082588823
Energy: 0.32234489287275586
Energy: 0.4143333321331995
Energy: 0.33064880235150185
Energy: 0.32634670278756067
Energy: 0.33960159926261646
Energy: 0.328623199489907
Energy: 0.3265389661494371
Energy: 0.42481054087064163
Energy: 0.32601030822866506
Energy: 0.3651581683080899
Energy: 0.337195342641631
Energy: 0.3527254666763189
Energy: 0.34167545084929857
Energy: 0.4077284713837207
Energy: 0.3493055148905749
Energy: 0.35415793366875736
Energy: 0.360122420808357
Energy: 0.3467557775163058
Energy: 0.3424681389698216
Energy: 0.40355824658673045
Energy: 0.34071996754075246
Energy: 0.3412823705787311
Energy: 0.3431198992619231
Energy: 0.3410935813527166
Energy: 0.34000505523399477
Energy: 0.40720217685647825
Energy: 0.3551438229667343
Energy: 0.35747452343136277
Energy: 0.3447471545907661
Energy: 0.3716206918213581
Energy: 0.35162600686010587
Energy: 0.36361900589540314
Energy: 0.34719095727526017
Energy: 0.36441030141368014
Energy: 0.3697412325974138
Energy: 0.34472860688651474
Energy: 0.35457136022216584
Energy: 0.3645512211683398
Energy: 0.3400233752869238
Energy: 0.3398107500940796
Energy: 0.3416073092812409
Energy: 0.34005531358097163
Energy: 0.340993734489015
Energy: 0.3658976950450611
Energy: 0.349652916090339
Energy: 0.3389686494374175
Energy: 0.34664747447316846
Energy: 0.3502536480540617
Energy: 0.3395415519985436
Energy: 0.3765160764019126
Energy: 0.3375332605685416
Energy: 0.3490836253194825
Energy: 0.3486471803098221
Energy: 0.3429383095315726
Energy: 0.3670622554624383
Energy: 0.35049734945206
Energy: 0.3373106103919575
Energy: 0.33532647357211676
Energy: 0.35240372906236217
Energy: 0.3443982749632325
Energy: 0.32586778506647385
Energy: 0.3463125631191195
Energy: 0.34299285198393653
Energy: 0.3393815501125077
Energy: 0.3229224624680484
Energy: 0.346108221742945
Energy: 0.31458508114667366
Energy: 0.36460628029438386
Energy: 0.33728967899142076
Energy: 0.3514579835095893
Energy: 0.33009642160834235
Energy: 0.34631366482699205
Energy: 0.34141331674034797
Energy: 0.3562509909661341
Energy: 0.34958844215120627
Energy: 0.3231329247909164
Energy: 0.33595622446784495
Energy: 0.3479352684682374
Energy: 0.3406487563743442
Energy: 0.35427578081995714
Energy: 0.3384715754534367
Energy: 0.33596772245771056
Energy: 0.33524154707686776
Energy: 0.33573091420767165
Energy: 0.3361415155748355
Energy: 0.38975889735363306
Energy: 0.3429644502188674
Energy: 0.3516203293340366
Energy: 0.37467029181812495
Energy: 0.3412128924244794
Energy: 0.33494671523920083
Energy: 0.3857035283752334
Energy: 0.3530051852297747
Energy: 0.3531082935488107
Energy: 0.347198750157715
Energy: 0.35072362335140805
Energy: 0.3497823689801231
Energy: 0.3845454635327904
Energy: 0.34340591684527866
Energy: 0.3427391157758242
Energy: 0.3429337385935607
Energy: 0.34462011375770785
Energy: 0.34671493641153217
Energy: 0.38413188657527414
Energy: 0.34365995497995994
Energy: 0.3469524412083643
Energy: 0.352570714801683
Energy: 0.3515035129878308
Energy: 0.34497656074969973
Energy: 0.4166317541874163
Energy: 0.353255448119723
Energy: 0.35702909741205946
Energy: 0.3446686325220169
Energy: 0.3382658014451959
Energy: 0.3601808564438436
Energy: 0.4143740194896325
Energy: 0.3367317831994701
Energy: 0.33770384094091294
Energy: 0.33702280143735236
Energy: 0.3343800031313044
Energy: 0.3359159127509612
Energy: 0.4150175010187359
Energy: 0.33615150851480324
Energy: 0.3235279855058366
Energy: 0.34878512259585226
Energy: 0.3315385488914764
Energy: 0.3322777007008364

minimum gb energy = 0.3138255273534309 eV
minimum distance =  2.60059917089615 Angstroms
sigma value = 33


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

Energy: 0.5023000882254591
Energy: 0.33512763142513946
Energy: 0.33575874439884085
Energy: 0.3346881503927993
Energy: 0.4844283428624538
Energy: 0.3355442498501974
Energy: 0.36714133264520804
Energy: 0.3271574214403086
Energy: 0.3097096344347588
Energy: 0.34087292589796286
Energy: 0.32886044820591387
Energy: 0.3068681386286117
Energy: 0.37852403723183103
Energy: 0.3072793513067182
Energy: 0.3272762021481073
Energy: 0.3354679668351325
Energy: 0.32720296549032174
Energy: 0.30778306467679595
Energy: 0.3891920407630516
Energy: 0.3177276963121147
Energy: 0.3306401914140903
Energy: 0.32081008679254397
Energy: 0.3323165703353571
Energy: 0.33185792624432175
Energy: 0.3775518605569721
Energy: 0.34213552931473873
Energy: 0.3428067092473423
Energy: 0.34002905848126236
Energy: 0.34233563224746505
Energy: 0.34212064367060563
Energy: 0.3914224996916702
Energy: 0.3307305731391233
Energy: 0.33211302393303893
Energy: 0.32212270787504615
Energy: 0.32978183781643783
Energy: 0.33299799907930067
Energy: 0.3913943374048059
Energy: 0.3360337616833599
Energy: 0.3373170586790822
Energy: 0.32095729433586007
Energy: 0.34148235360503704
Energy: 0.3381350479754359
Energy: 0.3955091792620584
Energy: 0.3344867587746943
Energy: 0.3434396324578704
Energy: 0.3321916288296672
Energy: 0.36195118929883774
Energy: 0.34266758553277604
Energy: 0.3542039135305757
Energy: 0.3349741271642976
Energy: 0.3300259310998861
Energy: 0.3303743638296215
Energy: 0.33593392900261215
Energy: 0.32982613616961554
Energy: 0.35430764825923006
Energy: 0.3450173025709095
Energy: 0.345024430555568
Energy: 0.3440750015049268
Energy: 0.3456536071232821
Energy: 0.32604178386214816
Energy: 0.35987154723138803
Energy: 0.31326655696329064
Energy: 0.3374660408383431
Energy: 0.3317212262572031
Energy: 0.3133511255353166
Energy: 0.3369772118258284
Energy: 0.3420882486926001
Energy: 0.32796350304109295
Energy: 0.32873900595933236
Energy: 0.3298478437665688
Energy: 0.33970265419256246
Energy: 0.3063260578417852
Energy: 0.3420210749496431
Energy: 0.3368002586030662
Energy: 0.30700793544986826
Energy: 0.3290314567308643
Energy: 0.3443279173111155
Energy: 0.30679647495389456
Energy: 0.34651478797261215
Energy: 0.33129382770731225
Energy: 0.3310071627621971
Energy: 0.33605975593604626
Energy: 0.3587416503482158
Energy: 0.3326321611037044
Energy: 0.3538841839522613
Energy: 0.3247778327687175
Energy: 0.3214823284142121
Energy: 0.3439210349715662
Energy: 0.34103463541332946
Energy: 0.34371961735698725
Energy: 0.3555377868008474
Energy: 0.3300490853266404
Energy: 0.3308435410868875
Energy: 0.32813871662832217
Energy: 0.3300003630541373
Energy: 0.3320874060375889
Energy: 0.3950864864622016
Energy: 0.3307601530059851
Energy: 0.33598972858207415
Energy: 0.3349124355674407
Energy: 0.3433601977631689
Energy: 0.3364357317798474
Energy: 0.36595124537752244
Energy: 0.33442852410912155
Energy: 0.3361778539630112
Energy: 0.34172920362365966
Energy: 0.32977401304943665
Energy: 0.3431089528594412
Energy: 0.3661438618181575
Energy: 0.32843090275742126
Energy: 0.32992635978761836
Energy: 0.33620057589504926
Energy: 0.32879732920356164
Energy: 0.3324285628262305
Energy: 0.37769709223383297
Energy: 0.3480791476414884
Energy: 0.34746955188023115
Energy: 0.3355930711144785
Energy: 0.34118113172131437
Energy: 0.34503730848513764
Energy: 0.41091371432437906
Energy: 0.3404345614373247
Energy: 0.3490061966240727
Energy: 0.2936149077568473
Energy: 0.34065345524979124
Energy: 0.31268840306370754
Energy: 0.40658752917594015
Energy: 0.32723977344547683
Energy: 0.3065673264799156
Energy: 0.3278459434522327
Energy: 0.3272669499888924
Energy: 0.30668139643413755
Energy: 0.3796600016594689
Energy: 0.3066676045143012
Energy: 0.32735436444626076
Energy: 0.3405632431110804
Energy: 0.3290471199320653
Energy: 0.306413288935181
Energy: 0.3890815722588316
Energy: 0.3362581559958698
Energy: 0.32145297197586853
Energy: 0.3316621608509392
Energy: 0.3393170491667387
Energy: 0.33149329663484045
Energy: 0.37820902773321036
Energy: 0.34349612149170283
Energy: 0.3441693046012707
Energy: 0.3421336520422989
Energy: 0.3444731364073157
Energy: 0.3212509026010007
Energy: 0.39353080800635465
Energy: 0.3287335145549849
Energy: 0.33040912566782277
Energy: 0.33032271939362323
Energy: 0.32787733858142354
Energy: 0.3320850555542492
Energy: 0.3910443221834578
Energy: 0.38196785040518877
Energy: 0.33253482580922666
Energy: 0.3192306047520622
Energy: 0.34371150553924845
Energy: 0.33222554827448436
Energy: 0.37783975813359344
Energy: 0.3429966513298699
Energy: 0.34279151112135053
Energy: 0.33587874888210895
Energy: 0.33700429627408274
Energy: 0.3360716059618711
Energy: 0.3564371305706126
Energy: 0.3421954228020212
Energy: 0.34385448817165304
Energy: 0.3314281660200493
Energy: 0.3371631591401214
Energy: 0.3320800320670242
Energy: 0.35248498741337647
Energy: 0.3446462881403031
Energy: 0.33945769075482957
Energy: 0.3410596689659099
Energy: 0.3357385823024396
Energy: 0.3464399184992022
Energy: 0.36347860445509816
Energy: 0.31240126533282714
Energy: 0.3121540685844732
Energy: 0.3554895545684822
Energy: 0.29364770010125707
Energy: 0.3125147172363098
Energy: 0.3402396708534003
Energy: 0.33414730487531635
Energy: 0.312346153412578
Energy: 0.3269263293134592
Energy: 0.333907072532486
Energy: 0.3066971219521385
Energy: 0.3396571796870722
Energy: 0.33584292477505767
Energy: 0.3064455658338687
Energy: 0.32678924497232575
Energy: 0.34126822547587654
Energy: 0.327184197410086
Energy: 0.3385745134856059
Energy: 0.3329934638413482
Energy: 0.33276443494909036
Energy: 0.3279118439344378
Energy: 0.33100154905969037
Energy: 0.3333196876012702
Energy: 0.3556511571177186
Energy: 0.34167817072909556
Energy: 0.3215603291537395
Energy: 0.3419193721068527
Energy: 0.34168527390845305
Energy: 0.3213563792188242
Energy: 0.353257129075513
Energy: 0.33012420066489856
Energy: 0.3298490774387962
Energy: 0.3309506285648792
Energy: 0.33026973253471625
Energy: 0.3298979589399279
Energy: 0.35375158922142425
Energy: 0.33194710288412893
Energy: 0.33317994930292005
Energy: 0.3324257322548144
Energy: 0.33226911644494733
Energy: 0.36388785166472326
Energy: 0.36591763673884686
Energy: 0.3342155257811298
Energy: 0.3355780522710369
Energy: 0.33634090027621644
Energy: 0.34588917482184306
Energy: 0.33779693936352373
Energy: 0.3662769120307758
Energy: 0.33191542543632624
Energy: 0.33263777146308215
Energy: 0.3352527300876579
Energy: 0.33280734379832055
Energy: 0.34262121596004796
Energy: 0.37732564912159405
Energy: 0.34415846853255044
Energy: 0.34457496832152223
Energy: 0.3401848345790044
Energy: 0.3473836827702257
Energy: 0.339547063834265
Energy: 0.41307661998227346
Energy: 0.3067393418334395
Energy: 0.31237590963317124
Energy: 0.29375325661212115
Energy: 0.37051338768491066
Energy: 0.3125170637018666

minimum gb energy = 0.2936149077568473 eV
minimum distance =  2.70929300340458 Angstroms
sigma value = 51


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

Energy: 0.48463548935484363
Energy: 0.3260002711932173
Energy: 0.32498231070062444
Energy: 0.3371970703325462
Energy: 0.312752133517461
Energy: 0.3375221042171204
Energy: 0.39744924966865375
Energy: 0.31007717735503315
Energy: 0.3075283000878221
Energy: 0.3215090174978494
Energy: 0.32820464023221757
Energy: 0.31061429348791975
Energy: 0.39371741159364515
Energy: 0.3185149599296378
Energy: 0.31840976791377446
Energy: 0.32450879797326554
Energy: 0.31865915872290984
Energy: 0.3186146660119715
Energy: 0.39996854905544826
Energy: 0.3183753932667265
Energy: 0.32219119630575876
Energy: 0.3075971233913086
Energy: 0.3545813733779141
Energy: 0.3243931683708485
Energy: 0.3882630151094418
Energy: 0.3380925084681372
Energy: 0.3352034449766151
Energy: 0.3169208614830894
Energy: 0.3359830650556779
Energy: 0.3344019649215853
Energy: 0.371815424338069
Energy: 0.33712269672877965
Energy: 0.3353416520900991
Energy: 0.3214494405302385
Energy: 0.33382959183980043
Energy: 0.3352260787179131
Energy: 0.3726145460130272
Energy: 0.33452583963613136
Energy: 0.33398741142017396
Energy: 0.32268311756843054
Energy: 0.33325353385565026
Energy: 0.3344149602482485
Energy: 0.3933549436652649
Energy: 0.31382675015037115
Energy: 0.3138923962659922
Energy: 0.36361116712031083
Energy: 0.31425298655701384
Energy: 0.3171940138352592
Energy: 0.3453865302168511
Energy: 0.3140119482721701
Energy: 0.3140277456541149
Energy: 0.3183183611183387
Energy: 0.3141093105743135
Energy: 0.31843979408195716
Energy: 0.34538072973449296
Energy: 0.3452648872877931
Energy: 0.30712748683815544
Energy: 0.3280343691921853
Energy: 0.32945759379771283
Energy: 0.31920979072594063
Energy: 0.34488655911325306
Energy: 0.31050677644011104
Energy: 0.33199882554785803
Energy: 0.3177411619013037
Energy: 0.32910298072208644
Energy: 0.31821307618092026
Energy: 0.35357731282868954
Energy: 0.3320836103154624
Energy: 0.3212342773715515
Energy: 0.3251713550066909
Energy: 0.3262861737557843
Energy: 0.30782790550711614
Energy: 0.3521113799307633
Energy: 0.3242963384331468
Energy: 0.3241040608729933
Energy: 0.32552313017100215
Energy: 0.32455368362828796
Energy: 0.324740021060602
Energy: 0.352935448356663
Energy: 0.326237091342722
Energy: 0.32401929108325084
Energy: 0.3261700796744322
Energy: 0.3247391312697306
Energy: 0.32388560519108134
Energy: 0.3867878751074642
Energy: 0.32399319370707774
Energy: 0.3282823922489271
Energy: 0.3055340504847237
Energy: 0.3194306410442615
Energy: 0.32223069068732996
Energy: 0.38355177796965645
Energy: 0.3251852758828587
Energy: 0.32527047168752843
Energy: 0.30510521377739913
Energy: 0.32519732106711746
Energy: 0.33319212397460135
Energy: 0.3924199460848114
Energy: 0.32565467562636446
Energy: 0.32547285896284756
Energy: 0.33466170101613796
Energy: 0.3265242450155253
Energy: 0.3246040031031184
Energy: 0.4185695937002319
Energy: 0.3154752970565296
Energy: 0.3116003539064554
Energy: 0.3056933952120072
Energy: 0.3186880585228142
Energy: 0.31166066869289993

minimum gb energy = 0.30510521377739913 eV
minimum distance =  2.68817444288389 Angstroms
sigma value = 19


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

Energy: 0.4052305245672388
Energy: 0.28534281905923775
Energy: 0.2855380092973261
Energy: 0.4021522919233397
Energy: 0.2940916690204699
Energy: 0.28537667265669797
Energy: 0.4014444858715372
Energy: 0.2756415472335633
Energy: 0.2763890094729138
Energy: 0.2881654770098604
Energy: 0.2755941175462102
Energy: 0.27593492032692224
Energy: 0.3467245406460261
Energy: 0.27561237751957757
Energy: 0.27559244473911126
Energy: 0.27539385423797347
Energy: 0.2747265355825325
Energy: 0.2757806339871149
Energy: 0.3505692172146294
Energy: 0.2751967855236979
Energy: 0.2750948410270362
Energy: 0.2840190191638498
Energy: 0.346173383179857
Energy: 0.2754202410219209
Energy: 0.3610797580496585
Energy: 0.2755222911848119
Energy: 0.2889808910133018
Energy: 0.28830830332283147
Energy: 0.2885035627049727
Energy: 0.28855611794026015
Energy: 0.3529271958511325
Energy: 0.2640263506663026
Energy: 0.28671460807354787
Energy: 0.2874303363403733
Energy: 0.2642993966447664
Energy: 0.2864827529764894
Energy: 0.3536529722605315
Energy: 0.2883062477181764
Energy: 0.2874722526792501
Energy: 0.28785867426833445
Energy: 0.2686028450529851
Energy: 0.2872707666508208
Energy: 0.3477411360870258
Energy: 0.2629659272445113
Energy: 0.26379896516661233
Energy: 0.34695053700051803
Energy: 0.26372762160892077
Energy: 0.2646480851126821
Energy: 0.3126293289849007
Energy: 0.26308000000746473
Energy: 0.26383168367932
Energy: 0.27578860598757854
Energy: 0.2648601370994002
Energy: 0.26471051050051464
Energy: 0.3126206537846777
Energy: 0.27568227018626573
Energy: 0.2757091453075688
Energy: 0.2748607031519498
Energy: 0.289124169824408
Energy: 0.27540021836911593
Energy: 0.31106409503535776
Energy: 0.28410947354430605
Energy: 0.2840709774982692
Energy: 0.27519686883630795
Energy: 0.2841183164183788
Energy: 0.2758203163524463
Energy: 0.35442893280077875
Energy: 0.28801317620798494
Energy: 0.2879048137064303
Energy: 0.28839017743949863
Energy: 0.28771086945075963
Energy: 0.27580132571415394
Energy: 0.30339669507523903
Energy: 0.28780569742002987
Energy: 0.2885829581172689
Energy: 0.26510331857575004
Energy: 0.28860334936194537
Energy: 0.28782830201621823
Energy: 0.3410007297946814
Energy: 0.2882139846086228
Energy: 0.2885526324671066
Energy: 0.28892641588524703
Energy: 0.28827791673344966
Energy: 0.2887860183158715
Energy: 0.39742977399231194
Energy: 0.2752899471196383
Energy: 0.27552111076201846
Energy: 0.2644183089440621
Energy: 0.2755445768269791
Energy: 0.2641351620336207
Energy: 0.4009619259481241
Energy: 0.2934842354107974
Energy: 0.26363339903016625
Energy: 0.2636237809404336
Energy: 0.2752566376143198
Energy: 0.26408957278818673
Energy: 0.3545574488755617
Energy: 0.2756751315350944
Energy: 0.2752828734532257
Energy: 0.2885006002953855
Energy: 0.27536027466540786
Energy: 0.2755872182069106
Energy: 0.3368965356886547
Energy: 0.27501831338781924
Energy: 0.27542761148330686
Energy: 0.2844184942972058
Energy: 0.2750010289723701
Energy: 0.2756642417805559
Energy: 0.33731020526441113
Energy: 0.27583726573512657
Energy: 0.2754821102533463
Energy: 0.28403448581625373
Energy: 0.2756845755698747
Energy: 0.27555414739257933
Energy: 0.35382248417168766
Energy: 0.2642264869342171
Energy: 0.2872121017391734
Energy: 0.28867730150753607
Energy: 0.2642771473527542
Energy: 0.28745727014570044
Energy: 0.3557099248969791
Energy: 0.2888960489012237
Energy: 0.2882319769405491
Energy: 0.2879940338439285
Energy: 0.28892285948427987
Energy: 0.2882129896902116
Energy: 0.3410755140416394
Energy: 0.2769119540481521
Energy: 0.2898237380392058
Energy: 0.28814066896756485
Energy: 0.2773163638028151
Energy: 0.2879535248173013
Energy: 0.34681066445002084
Energy: 0.26482797352193543
Energy: 0.2855812948145797
Energy: 0.33416950743987245
Energy: 0.2643548184267965
Energy: 0.2852773083516351
Energy: 0.31374501623885065
Energy: 0.2894686196408092
Energy: 0.27500209472082826
Energy: 0.2756526063789386
Energy: 0.2640627208294398
Energy: 0.2757873236207
Energy: 0.31240986074895233
Energy: 0.2758087446148188
Energy: 0.2760730588645618
Energy: 0.2758794197501966
Energy: 0.2755996700203332
Energy: 0.2757419959275153
Energy: 0.34774719083816275
Energy: 0.28541978284955016
Energy: 0.2853800402993672
Energy: 0.3333446716377746
Energy: 0.2839456773252797
Energy: 0.2750741308776923
Energy: 0.3553301959750894
Energy: 0.28809881507999907
Energy: 0.28940566976382087
Energy: 0.2879609832459866
Energy: 0.2882490506167016
Energy: 0.28884254020170264
Energy: 0.30292924127049903
Energy: 0.287743995825327
Energy: 0.28714267812362404
Energy: 0.2645167716695155
Energy: 0.288222405511037
Energy: 0.28656889141485437
Energy: 0.34731131168642404
Energy: 0.2876378852378216
Energy: 0.28737555708206647
Energy: 0.27571206143107335
Energy: 0.28875755331087244
Energy: 0.2869688205725229
Energy: 0.3987798403871427
Energy: 0.27536494865337396
Energy: 0.2647272899992712
Energy: 0.26397053977986884
Energy: 0.33365435608496324
Energy: 0.2636609507311225

minimum gb energy = 0.2629659272445113 eV
minimum distance =  2.72839852410395 Angstroms
sigma value = 27


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

Energy: 0.35657277423356054
Energy: 0.31561276779303077
Energy: 0.3163276433929956
Energy: 0.3537374497142434
Energy: 0.2943064443130925
Energy: 0.3287256943592687
Energy: 0.29443834284139625
Energy: 0.31130741148383245
Energy: 0.3103383633097147
Energy: 0.3027552979917483
Energy: 0.3116600825156122
Energy: 0.288131302715891
Energy: 0.3295496506508408
Energy: 0.2942385514415444
Energy: 0.299595708187189
Energy: 0.28524188932435335
Energy: 0.29634748574699077
Energy: 0.28483513080080963
Energy: 0.33464100611045583
Energy: 0.29490812152622053
Energy: 0.29422144768577146
Energy: 0.29990663225624464
Energy: 0.3172590399026776
Energy: 0.2835557865843596
Energy: 0.35520164045899677
Energy: 0.26469760074149656
Energy: 0.28378483127933635
Energy: 0.2990429709836237
Energy: 0.2641496114692223
Energy: 0.2836814966455435
Energy: 0.3093619125350147
Energy: 0.2648668564225821
Energy: 0.2652177476179701
Energy: 0.29454799295122575
Energy: 0.26454498968158124
Energy: 0.2646975782928531
Energy: 0.31063900377226394
Energy: 0.2886670999485361
Energy: 0.2874856479553449
Energy: 0.2971437831384606
Energy: 0.2858575166061731
Energy: 0.2939614615972711
Energy: 0.31175758391274594
Energy: 0.29734752879751436
Energy: 0.29758858398683086
Energy: 0.3118054124103859
Energy: 0.29810263162551787
Energy: 0.29249901179578286
Energy: 0.3337804068847249
Energy: 0.2821666957719845
Energy: 0.2864971860358285
Energy: 0.30344526173094244
Energy: 0.28425203838428226
Energy: 0.28596940939315374
Energy: 0.2980866880437764
Energy: 0.280921259259309
Energy: 0.2801255170590837
Energy: 0.2819850668501456
Energy: 0.2807556974915548
Energy: 0.28015516746433927
Energy: 0.331693871766685
Energy: 0.29144851687725504
Energy: 0.29131424833128383
Energy: 0.2807248279537113
Energy: 0.29294795910048754
Energy: 0.28149546951522414
Energy: 0.2944394376924203
Energy: 0.3037557285950712
Energy: 0.30490318008135503
Energy: 0.28262214295340554
Energy: 0.2975702035560248
Energy: 0.2876565053827188

minimum gb energy = 0.2641496114692223 eV
minimum distance =  2.68245712301113 Angstroms
sigma value = 9


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

Energy: 0.3361645689730139
Energy: 0.27594382345732904
Energy: 0.2608167505168598
Energy: 0.2815591381756315
Energy: 0.5355062871372266
Energy: 0.2825381057334503
Energy: 0.2535816264987295
Energy: 0.2647105027339974
Energy: 0.2653720091130853
Energy: 0.27121956943014724
Energy: 0.2645642198397903
Energy: 0.26987916385852445
Energy: 0.28418375854078143
Energy: 0.26734338294629056
Energy: 0.26411954328221526
Energy: 0.2752535825563955
Energy: 0.2651089728935745
Energy: 0.26444823015557806
Energy: 0.3227252121384448
Energy: 0.2788303220111285
Energy: 0.26523001081637515
Energy: 0.2774614203199833
Energy: 0.2664146312790782
Energy: 0.2649181945749684
Energy: 0.27142725189621786
Energy: 0.2702582467260107
Energy: 0.2619287275926576
Energy: 0.2854639643509912
Energy: 0.2840642022953886
Energy: 0.2695508594761417
Energy: 0.27665080864757935
Energy: 0.2673587723173335
Energy: 0.2588364267225034
Energy: 0.2769683104460631
Energy: 0.2687659128742332
Energy: 0.260093272298174
Energy: 0.2764558713501629
Energy: 0.25315417730575457
Energy: 0.2532888395632835
Energy: 0.2771492061574857
Energy: 0.26147453966121953
Energy: 0.27502565077417745
Energy: 0.27144755243729063
Energy: 0.2839404148254502
Energy: 0.27140529135288527
Energy: 0.2718643993162551
Energy: 0.27715290688711924
Energy: 0.2693401721795931
Energy: 0.27123018252624337
Energy: 0.27195807365220626
Energy: 0.27973473751557965
Energy: 0.26305648032538914
Energy: 0.2783295593281179
Energy: 0.25469376322957643
Energy: 0.34630464054937377
Energy: 0.29520062031685723
Energy: 0.26656557371168976
Energy: 0.2734678151607533
Energy: 0.2650359778371621
Energy: 0.27843396037293733
Energy: 0.2648033207964104
Energy: 0.27217111718949194
Energy: 0.2703175341222725
Energy: 0.2688897132629561
Energy: 0.2704327279749244
Energy: 0.27107647482487235
Energy: 0.27133216936148474
Energy: 0.27484791487112953
Energy: 0.2753544958355013
Energy: 0.28205373752891216
Energy: 0.2743625618762614
Energy: 0.2734191900248697
Energy: 0.33836616471073266
Energy: 0.2727919383373784
Energy: 0.2871702118987943
Energy: 0.27029031882312815
Energy: 0.27302937993416343
Energy: 0.2886449399532568
Energy: 0.270596293863099
Energy: 0.27698316994417066
Energy: 0.288951915936444
Energy: 0.28099936662829766
Energy: 0.27908099230571154
Energy: 0.25453903352087043
Energy: 0.27600615561670516
Energy: 0.2753231819461239
Energy: 0.27502324212419976
Energy: 0.2670059213735262
Energy: 0.2769072293531324
Energy: 0.267313465457469
Energy: 0.2750062064565082
Energy: 0.2644132132394608
Energy: 0.26598450589037176
Energy: 0.2652296115873682
Energy: 0.2792388017005789
Energy: 0.2644965488068219
Energy: 0.2743626251886291
Energy: 0.26381844361913653
Energy: 0.25398864724554837
Energy: 0.2650500014383807
Energy: 0.26810141683983835
Energy: 0.27080884249483483
Energy: 0.30009938779663203
Energy: 0.24926771776872952
Energy: 0.2755120153683048
Energy: 0.2650374792293466
Energy: 0.2672256182114983
Energy: 0.27814548897870883
Energy: 0.2824545095712333
Energy: 0.2705044485567387
Energy: 0.2629582403790688
Energy: 0.2638055270389566
Energy: 0.27643416217551303
Energy: 0.26343476218799344
Energy: 0.2829746604366086
Energy: 0.2638597448115783
Energy: 0.25903791138459714
Energy: 0.26389838985347175
Energy: 0.26383852704546307
Energy: 0.25814384706740895
Energy: 0.28228783022780246
Energy: 0.261051225367644
Energy: 0.26260132622529
Energy: 0.26850868599459576
Energy: 0.26156039082761856
Energy: 0.2632783567683512
Energy: 0.2890176770584378
Energy: 0.26389519964747454
Energy: 0.2822748953242318
Energy: 0.2778219770285138
Energy: 0.26397744002300416
Energy: 0.2595778841134368
Energy: 0.28646310481006615
Energy: 0.26534766089168577
Energy: 0.2654250269455652
Energy: 0.27477585728612913
Energy: 0.26502266973530725
Energy: 0.2552987107530588
Energy: 0.2835032557740672
Energy: 0.26706153885871464
Energy: 0.2701510694381628
Energy: 0.2790856386471191
Energy: 0.2653149394488639
Energy: 0.26299273647730664
Energy: 0.37495583665085996
Energy: 0.26779991350994625
Energy: 0.2680927112052057
Energy: 0.29569797781688234
Energy: 0.26640872772933843
Energy: 0.2834289008830882
Energy: 0.2861063442718374
Energy: 0.26512775641502
Energy: 0.25480869341679674
Energy: 0.2787596881303405
Energy: 0.2669429265859491
Energy: 0.25370678826477994
Energy: 0.2670224500695859
Energy: 0.2689386361873105
Energy: 0.2768372076675663
Energy: 0.25828305184220285
Energy: 0.28719056607258336
Energy: 0.27040783637275145
Energy: 0.2747601491405232
Energy: 0.26476271969678855
Energy: 0.25485323616576266
Energy: 0.274615159711444
Energy: 0.267832941862494
Energy: 0.27690448260709616
Energy: 0.27051913842678116
Energy: 0.27271773388401366
Energy: 0.2863780907881576
Energy: 0.27010691887021415
Energy: 0.2776713742879752
Energy: 0.27077170721624294
Energy: 0.27236840983931326
Energy: 0.27331299760546657
Energy: 0.27000913598622495
Energy: 0.2655333002838017
Energy: 0.27389538180027734
Energy: 0.2686282836048189
Energy: 0.2648993596028147
Energy: 0.26612293456880065
Energy: 0.2760531804502303
Energy: 0.2711453943725637
Energy: 0.2738605111864829
Energy: 0.291195753701751
Energy: 0.34445848757494285
Energy: 0.2710954378293587
Energy: 0.26962458138702233
Energy: 0.26515949809037054
Energy: 0.273595405129856
Energy: 0.27795166049388265
Energy: 0.359469975774507
Energy: 0.27748135929958995
Energy: 0.2757321114434926
Energy: 0.2795257743653833
Energy: 0.27684108970074334
Energy: 0.2733055603058106
Energy: 0.3172718981289853
Energy: 0.2777521176527545
Energy: 0.2746647540335759
Energy: 0.2750620634345681
Energy: 0.2768095665922514
Energy: 0.2695071290525622
Energy: 0.27592149142900196
Energy: 0.27083055968021424
Energy: 0.2912059456746444
Energy: 0.27806259281077816
Energy: 0.2755839650230575
Energy: 0.2547680371808579
Energy: 0.2778065193208912
Energy: 0.27819445616949995
Energy: 0.27821345918038315
Energy: 0.26700287491203906
Energy: 0.2819692153976437
Energy: 0.25371877375678187
Energy: 0.2748969833100678
Energy: 0.2713404902147098
Energy: 0.26359206173113
Energy: 0.2650177596417914
Energy: 0.275118965957101
Energy: 0.26385355593967436
Energy: 0.2745534990579115
Energy: 0.2717091647454595
Energy: 0.26753902245551364
Energy: 0.26570625834854655
Energy: 0.2728243566343452
Energy: 0.26530426610226693
Energy: 0.2916893987396447
Energy: 0.2692446844183387
Energy: 0.3482912374650478
Energy: 0.2623821071121016
Energy: 0.27847288693958333
Energy: 0.3204464527356925
Energy: 0.2824478642826887
Energy: 0.26858259771059334
Energy: 0.26800069235941815
Energy: 0.265845219319912
Energy: 0.2695109623313321
Energy: 0.2641047650880178
Energy: 0.28202073488944956
Energy: 0.26536765927647576
Energy: 0.2591776966975611
Energy: 0.2639859650776045
Energy: 0.2683819704122033
Energy: 0.2658647750897349
Energy: 0.2822366190380205
Energy: 0.2647325888015433
Energy: 0.2654680555992828
Energy: 0.268869157182044
Energy: 0.26403306985795966
Energy: 0.26095804934299144
Energy: 0.2865004698756339
Energy: 0.26525376817523366
Energy: 0.26521903419261367
Energy: 0.2757240430220184
Energy: 0.2652025517868861
Energy: 0.2553092401232137

minimum gb energy = 0.24926771776872952 eV
minimum distance =  2.66060878833785 Angstroms
sigma value = 57


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

Energy: 0.10970694941651346
Energy: 0.11811230564776126
Energy: 0.13577708816809075
Energy: 0.11072741210151815
Energy: 0.1163130078544168
Energy: 0.11138742752215533
Energy: 0.11041186209067672
Energy: 0.13083405751057622
Energy: 0.11679715714524778
Energy: 0.1298938584531099
Energy: 0.13038019637198392
Energy: 0.13198169149744676
Energy: 0.15204263260919051
Energy: 0.12973927132798804
Energy: 0.12989937410744468
Energy: 0.13043592074400492
Energy: 0.12953447296670037
Energy: 0.13229278362960936
Energy: 0.1519418112162709
Energy: 0.12968370320765987
Energy: 0.12980569252988616
Energy: 0.1310096622685267
Energy: 0.15323437620007135
Energy: 0.13245870031753665
Energy: 0.15165801212770516
Energy: 0.11110112889501816
Energy: 0.126716025707438
Energy: 0.15239388926021294
Energy: 0.11039485457755283
Energy: 0.11667584894587404
Energy: 0.12957592504844964
Energy: 0.11061491043392967
Energy: 0.11113329955797667
Energy: 0.12982537546035056
Energy: 0.11342731777093774
Energy: 0.12143296316931733
Energy: 0.12900309539128196
Energy: 0.1179453214665978
Energy: 0.11678337346092624
Energy: 0.12948616243460515
Energy: 0.12997300537735026
Energy: 0.1174597622471548
Energy: 0.1296058131136037
Energy: 0.13102330415290284
Energy: 0.13312898071444107
Energy: 0.12958859848683
Energy: 0.13027624220090162
Energy: 0.12990674844795697
Energy: 0.15166265706140672
Energy: 0.13078544108572368
Energy: 0.13253758565563606
Energy: 0.15217980056464214
Energy: 0.13049915435501813
Energy: 0.13231857672559794
Energy: 0.1134660910176993
Energy: 0.1303927460491588
Energy: 0.12215460774879361
Energy: 0.11023932162258816
Energy: 0.15289486227944826
Energy: 0.12698012521565188
Energy: 0.11032803132464017
Energy: 0.11666451776298634
Energy: 0.11663713168563164
Energy: 0.11015722588382733
Energy: 0.1294975226468329
Energy: 0.12192277231945317
Energy: 0.15286053679850117
Energy: 0.1304129617824853
Energy: 0.13017072783784822
Energy: 0.15286202500281523
Energy: 0.13024170003097857
Energy: 0.11723536272453386
Energy: 0.19977298177320532
Energy: 0.15207945195629463
Energy: 0.14978792518819112
Energy: 0.13090687667676199
Energy: 0.1520752477283708
Energy: 0.1497141339419674
Energy: 0.15209411038488294
Energy: 0.1305619760664343
Energy: 0.12975562302665763
Energy: 0.15283197799077622
Energy: 0.13067846585471204
Energy: 0.1166690919344317
Energy: 0.15217007885689016
Energy: 0.11362992468009761
Energy: 0.11089594661270873
Energy: 0.15235530872913441
Energy: 0.11193340684451342
Energy: 0.1354106045042663
Energy: 0.13080945443693093
Energy: 0.13029508144081375
Energy: 0.13193350310948862
Energy: 0.13045498611493972
Energy: 0.110624276775083
Energy: 0.11646915208528633
Energy: 0.1295479084340631
Energy: 0.1301285956333112
Energy: 0.1172072883651094
Energy: 0.1295376794188403
Energy: 0.13109433572143403
Energy: 0.1338791685777319
Energy: 0.15333475791446977
Energy: 0.13036275764887612
Energy: 0.13022015730604092
Energy: 0.15349686180596048
Energy: 0.13014287775153732
Energy: 0.1299630459028426
Energy: 0.110222529852156
Energy: 0.13290588740606615
Energy: 0.11677751630038787
Energy: 0.11018209080722567
Energy: 0.15275781194520446
Energy: 0.13020966535192405

minimum gb energy = 0.10970694941651346 eV
minimum distance =  2.70864316108251 Angstroms
sigma value = 11


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

Energy: 0.32578351036582637
Energy: 0.25194413431690815
Energy: 0.21610340531391495
Energy: 0.22056117312454007
Energy: 0.24217196270429137
Energy: 0.21838677658235703
Energy: 0.24933195629232882
Energy: 0.250998500546285
Energy: 0.23967892945168234
Energy: 0.2399003610058186
Energy: 0.24376282361771684
Energy: 0.23282148304464348
Energy: 0.23822959232145613
Energy: 0.2399881422620713
Energy: 0.23997228374152416
Energy: 0.23885467799671423
Energy: 0.23719564210122795
Energy: 0.2423450127314325
Energy: 0.23869792798726178
Energy: 0.23968411413151772
Energy: 0.24077609575118417
Energy: 0.23919670474376392
Energy: 0.24221253039374335
Energy: 0.2423870133348312
Energy: 0.242908598894227
Energy: 0.21531209648245825
Energy: 0.22864255840424666
Energy: 0.24959247185042005
Energy: 0.22983977075650355
Energy: 0.2229711973729056
Energy: 0.27467476999292034
Energy: 0.23810242067878004
Energy: 0.21551608168799372
Energy: 0.22766173176792237
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Energy: 0.2393778718784865
Energy: 0.2419511921115196
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Energy: 0.2715964019559655
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Energy: 0.23645949159855403
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Energy: 0.2304851225129799
Energy: 0.22793498148675187
Energy: 0.22021575880826558
Energy: 0.22122809150446576
Energy: 0.22379527386064263
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Energy: 0.2146568357270625
Energy: 0.21541315985552628
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Energy: 0.22701529250615504
Energy: 0.28571180826396464
Energy: 0.21923612063018708
Energy: 0.22491634430447455
Energy: 0.22540535140479018
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Energy: 0.21682324986948065
Energy: 0.2970334336348639
Energy: 0.21781629395923324
Energy: 0.21945641842627292
Energy: 0.24568289157088327
Energy: 0.21506893125895546
Energy: 0.2286689998792196
Energy: 0.2927676772396261
Energy: 0.23317398498669487
Energy: 0.23849635247692827
Energy: 0.24017107567412851
Energy: 0.2308339210364796
Energy: 0.22597583368532637
Energy: 0.27208754903285387
Energy: 0.23694758511808361
Energy: 0.2313143973883243
Energy: 0.23742215330421115
Energy: 0.23097692912338377
Energy: 0.23806608156615794
Energy: 0.29565691638482355
Energy: 0.24610879400422703
Energy: 0.22306712899486678
Energy: 0.22615274247508985
Energy: 0.22185867939469375
Energy: 0.21447286242350272
Energy: 0.27410991932891415
Energy: 0.23513491775862955
Energy: 0.2269886868453784
Energy: 0.23938254156532357
Energy: 0.21177945722047728
Energy: 0.2779706466489877
Energy: 0.24060584191456894
Energy: 0.2351457483545315
Energy: 0.23982469676296406
Energy: 0.240914582538385
Energy: 0.23284211012232667
Energy: 0.22133708070467048
Energy: 0.2350516215020717
Energy: 0.24097421414411668
Energy: 0.2422482521911903
Energy: 0.23583373680473585
Energy: 0.23901465243643494
Energy: 0.24058924967304737
Energy: 0.24195827702735653
Energy: 0.24173837794847935
Energy: 0.24826748859869618
Energy: 0.2514015219280875
Energy: 0.23977535739829167
Energy: 0.24041634089757277
Energy: 0.30224886779466553
Energy: 0.2270571880768973
Energy: 0.2293401849081373
Energy: 0.21515661376471434
Energy: 0.2385471842171854
Energy: 0.23131302294136838

minimum gb energy = 0.21177945722047728 eV
minimum distance =  2.64844482310776 Angstroms
sigma value = 41


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

Energy: 0.3499709908855592
Energy: 0.2758226945637677
Energy: 0.30021746476649624
Energy: 0.2476018816722216
Energy: 0.25568346993184404
Energy: 0.27190708921662676
Energy: 0.2762206935949986
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Energy: 0.26239757351502035
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Energy: 0.2575848026137849
Energy: 0.2574382655555328
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Energy: 0.2591599805370658
Energy: 0.2560537720195149
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Energy: 0.25579831600180525
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Energy: 0.23940520101108922
Energy: 0.3066842467493801
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Energy: 0.24902652182390814
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Energy: 0.26253233582514734
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Energy: 0.2696570602586746
Energy: 0.2578494273565276
Energy: 0.2569247141375496
Energy: 0.2705590985924027
Energy: 0.25824039595092774
Energy: 0.23777958827667978
Energy: 0.3066629873726448
Energy: 0.25857536159609595
Energy: 0.2596612672266376
Energy: 0.26020159048895264
Energy: 0.257744076456137
Energy: 0.2438724303394734
Energy: 0.30043845013155196
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Energy: 0.25125536202566967
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Energy: 0.24995418236494746
Energy: 0.25077814240617535
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Energy: 0.2545568067817743
Energy: 0.2506250624331696
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Energy: 0.3388707439399601
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Energy: 0.23860536105831748
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Energy: 0.2263220193701144
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Energy: 0.26366368562509584
Energy: 0.25653538192846553
Energy: 0.23937816441301443
Energy: 0.2635696562864326
Energy: 0.2543236366246808
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Energy: 0.3067906654520988
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Energy: 0.24956602469717556
Energy: 0.2538898861512717
Energy: 0.25726799888498986
Energy: 0.25031557673528787
Energy: 0.2698939609830256
Energy: 0.2562206776454992
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Energy: 0.2708092370153714
Energy: 0.255748537957959
Energy: 0.24007755606860062
Energy: 0.30619435555595004
Energy: 0.25889383376823644
Energy: 0.2514249444786536
Energy: 0.2543459728977746
Energy: 0.2578759537696325
Energy: 0.24859973988531234
Energy: 0.30562466650926307
Energy: 0.25058668113963617
Energy: 0.2483778059758084
Energy: 0.25871704457438893
Energy: 0.24915784217268055
Energy: 0.24287642388204983
Energy: 0.35974156629315573
Energy: 0.2520544066087223
Energy: 0.25125214347673896
Energy: 0.25660752213671245
Energy: 0.25254161442221607
Energy: 0.2507033242944364
Energy: 0.3078119179022454
Energy: 0.22664725963848445
Energy: 0.24115454847812604
Energy: 0.24922380692428242
Energy: 0.23923166242551666
Energy: 0.24235168840960722
Energy: 0.2632614538294207
Energy: 0.2696263038250897
Energy: 0.2793990469469355
Energy: 0.26333421093161513
Energy: 0.23735583657908302
Energy: 0.2703339985286348
Energy: 0.25889073092835097
Energy: 0.24961661212397396
Energy: 0.239800958608862
Energy: 0.25901494163487593
Energy: 0.24937694981075872
Energy: 0.24013645177526705
Energy: 0.25765311904886573
Energy: 0.24979152014297076
Energy: 0.2550649777131613
Energy: 0.2571629829654035
Energy: 0.25686010670064896
Energy: 0.2568362650934911
Energy: 0.2615696540746634
Energy: 0.26146509495529086
Energy: 0.2514947809509424
Energy: 0.26042696399970205
Energy: 0.26077447745220156
Energy: 0.25589227423211003
Energy: 0.33283897215508323
Energy: 0.2550615401517973
Energy: 0.22654827390275473
Energy: 0.23693214198395876
Energy: 0.2543149294245264
Energy: 0.226611432847056

minimum gb energy = 0.2263220193701144 eV
minimum distance =  2.65016780791647 Angstroms
sigma value = 33


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

Energy: 0.30374168993801476
Energy: 0.3146635743665831
Energy: 0.31559236646112115
Energy: 0.30437791620696947
Energy: 0.2910937429826144
Energy: 0.31456423402222156
Energy: 0.28853698215618045
Energy: 0.27174723764090863
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Energy: 0.26614841119868293
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Energy: 0.2685386667667242
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Energy: 0.2801339581894489
Energy: 0.283304650786428
Energy: 0.2733932584823941
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Energy: 0.26533789679176273
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Energy: 0.2793562264256311
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Energy: 0.2788810633490164
Energy: 0.2650075547415997
Energy: 0.27200372623673313
Energy: 0.26504081215133296
Energy: 0.2659525429868615
Energy: 0.26581402089332035
Energy: 0.2783628100545468
Energy: 0.26591656892865984
Energy: 0.2834745066067934
Energy: 0.2797272538282448
Energy: 0.27772280766799556
Energy: 0.2717075857208804
Energy: 0.27057218679269046
Energy: 0.2684558445970392
Energy: 0.2866196811629089
Energy: 0.27891439520626027
Energy: 0.2874585244954668
Energy: 0.2875635605936509
Energy: 0.2574689246337503
Energy: 0.2555551181583201
Energy: 0.2760892254683873
Energy: 0.25452549818942016

minimum gb energy = 0.25126367985048 eV
minimum distance =  2.6598646326049 Angstroms
sigma value = 67


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

Energy: 0.35245666232959677
Energy: 0.24971559433952722
Energy: 0.24969238258089838
Energy: 0.24777255989051997
Energy: 0.5076056170483869
Energy: 0.2496034465361535
Energy: 0.3347754249498297
Energy: 0.25659633492911593
Energy: 0.2562607129076876
Energy: 0.25750651414262565
Energy: 0.2916424727697307
Energy: 0.25586875389752284
Energy: 0.29810618144740425
Energy: 0.24071657149555462
Energy: 0.2564399340677959
Energy: 0.25757775928955934
Energy: 0.24056663766372502
Energy: 0.25645639500435896
Energy: 0.2937683774031249
Energy: 0.25568892519703107
Energy: 0.25551296964902587
Energy: 0.29367526110633896
Energy: 0.25724066999330514
Energy: 0.25611251711361666
Energy: 0.2930572888719018
Energy: 0.25788017082019205
Energy: 0.25691240610918015
Energy: 0.29348874128884345
Energy: 0.2567067862979649
Energy: 0.2567724716524445
Energy: 0.29435490073159026
Energy: 0.2536030997907436
Energy: 0.25709100640610355
Energy: 0.29452774919968916
Energy: 0.2526538485242258
Energy: 0.2577601103884604
Energy: 0.33609024772854557
Energy: 0.25641907438250866
Energy: 0.256828376890486
Energy: 0.2409761382587165
Energy: 0.2911584321812739
Energy: 0.25683479999910774

minimum gb energy = 0.24056663766372502 eV
minimum distance =  2.70681745791054 Angstroms
sigma value = 3


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

Energy: 0.44467110200604354
Energy: 0.3731551375117595
Energy: 0.32867792775278154
Energy: 0.32596033012752235
Energy: 0.36823390119873617
Energy: 0.3489846582715694
Energy: 0.28836028738105784
Energy: 0.330639333786636
Energy: 0.292259830993287
Energy: 0.31538132900713617
Energy: 0.31138748535866023
Energy: 0.29255343430184555
Energy: 0.3339213988353691
Energy: 0.29046065848350505
Energy: 0.30226084530873654
Energy: 0.33472506623190745
Energy: 0.2884406494407708
Energy: 0.3139228545775058
Energy: 0.29560579348199356
Energy: 0.29295347515836295
Energy: 0.2917778474412579
Energy: 0.29604239849396236
Energy: 0.3359891303833323
Energy: 0.2914397144538181
Energy: 0.2983677473256872
Energy: 0.3082974187514489
Energy: 0.29236154414502064
Energy: 0.29629877572699037
Energy: 0.31721694559007113
Energy: 0.2921820256423727
Energy: 0.29196776592042084
Energy: 0.30929934150751165
Energy: 0.316435270923024
Energy: 0.2917930412657933
Energy: 0.3081225656050401
Energy: 0.3152375783155396
Energy: 0.2911772634369306
Energy: 0.33304735330384755
Energy: 0.29869056750119494
Energy: 0.32488456438152813
Energy: 0.3303340123610537
Energy: 0.29838517538393927
Energy: 0.45044600520789274
Energy: 0.3638510039031929
Energy: 0.3336851731693551
Energy: 0.31976684315061105
Energy: 0.36257729867886246
Energy: 0.3172578713073384
Energy: 0.2920697471250294
Energy: 0.3107364156667041
Energy: 0.29846546767465615
Energy: 0.33253716748304724
Energy: 0.32798121774107813
Energy: 0.29815707336123276
Energy: 0.34609870481790905
Energy: 0.32035298984937643
Energy: 0.3219036742805989
Energy: 0.3251504092131937
Energy: 0.3202762506753904
Energy: 0.3024182189102035
Energy: 0.32986884716607606
Energy: 0.30900478893774186
Energy: 0.308635323079867
Energy: 0.3302506857541238
Energy: 0.3200832986905901
Energy: 0.3108796432986198
Energy: 0.33025277362834554
Energy: 0.3305120383817798
Energy: 0.3183243252425075
Energy: 0.33018419790838344
Energy: 0.2924945866686474
Energy: 0.3192331410254306
Energy: 0.3321288303780735
Energy: 0.29254763969412645
Energy: 0.2928048818251066
Energy: 0.3351189417290035
Energy: 0.29244975211776725
Energy: 0.2936687604738791
Energy: 0.33192345658967626
Energy: 0.29706796375282135
Energy: 0.29194333131664124
Energy: 0.29862227826593196
Energy: 0.2951550470487014
Energy: 0.29192794294331237
Energy: 0.3911330172608603
Energy: 0.33963688405308606
Energy: 0.33530936810873324
Energy: 0.3308019314486241
Energy: 0.3380032921920832
Energy: 0.3401183512762587
Energy: 0.32974216864944966
Energy: 0.3071996831624743
Energy: 0.3104861534472161
Energy: 0.2978885647792079
Energy: 0.30312244268729727
Energy: 0.30801411816349483
Energy: 0.37080546192542957
Energy: 0.31446125181906537
Energy: 0.3133714116100141
Energy: 0.3700700399832898
Energy: 0.30764281334020255
Energy: 0.3306561242616784
Energy: 0.3197147312596069
Energy: 0.3051838235031718
Energy: 0.3128460320319097
Energy: 0.3253635758620689
Energy: 0.3210687625332759
Energy: 0.3078590051084324
Energy: 0.32140712024833884
Energy: 0.3380115777023976
Energy: 0.2944708876363975
Energy: 0.3107972287357705
Energy: 0.29825022294046716
Energy: 0.2924874852854606
Energy: 0.35647089301818574
Energy: 0.31089822977185144
Energy: 0.29312906462159716
Energy: 0.31173669424214345
Energy: 0.31231655806197284
Energy: 0.29262453692618845
Energy: 0.32098263648597103
Energy: 0.30967516036339504
Energy: 0.31119587067078
Energy: 0.32234177087210014
Energy: 0.3040882268645145
Energy: 0.308810781159735
Energy: 0.341790532308145
Energy: 0.33840852267404126
Energy: 0.3398753361989619
Energy: 0.3412512309428089
Energy: 0.33570727791805943
Energy: 0.3369803955566142
Energy: 0.3154228076060751
Energy: 0.308924677742512
Energy: 0.2873236925727653
Energy: 0.31568449116691766
Energy: 0.3182396203754831
Energy: 0.2869626123734409
Energy: 0.3178993233119509
Energy: 0.3228582062596953
Energy: 0.3228664858492675
Energy: 0.3191822530766146
Energy: 0.32276001119070125
Energy: 0.28678492724762594
Energy: 0.29064743915516783
Energy: 0.3344244151568284
Energy: 0.28628541665598045
Energy: 0.3003541276886984
Energy: 0.3291519388238853
Energy: 0.2860805085352825
Energy: 0.3649654056356207
Energy: 0.32316802746074896
Energy: 0.33706944998295063
Energy: 0.3201285250853201
Energy: 0.33301797027163327
Energy: 0.2864163559602747
Energy: 0.2947218083928314
Energy: 0.31558048515227294
Energy: 0.33583446636082803
Energy: 0.33209034877179194
Energy: 0.33820205083913407
Energy: 0.2861364612492322
Energy: 0.2917428804071296
Energy: 0.2862964737664211
Energy: 0.2859651172165602
Energy: 0.29400182132552877
Energy: 0.32764235720920615
Energy: 0.2863291587929659
Energy: 0.2965112034916657
Energy: 0.3064560872351935
Energy: 0.30165971653259227
Energy: 0.2980593002107147
Energy: 0.30419344384927216
Energy: 0.2871412094192399
Energy: 0.29546778899142645
Energy: 0.3087477647922071
Energy: 0.28812248107973876
Energy: 0.2963070538421647
Energy: 0.3257722984871084
Energy: 0.28811328317585977
Energy: 0.33003892683464126
Energy: 0.31981069311608845
Energy: 0.3186154234839542
Energy: 0.3305779315608437
Energy: 0.32041858365839543
Energy: 0.2956994069079577
Energy: 0.2995944130645185
Energy: 0.2974487198357337
Energy: 0.30831048822160856
Energy: 0.30052625491283247
Energy: 0.31319213455769873
Energy: 0.3080699797123287
Energy: 0.3729441894480118
Energy: 0.3366113064648732
Energy: 0.3078240475975943
Energy: 0.3150632721692043
Energy: 0.3395049679868939
Energy: 0.28901719297009254
Energy: 0.3033571925228199
Energy: 0.32453192776352713
Energy: 0.32930948627363743
Energy: 0.3306133357526276
Energy: 0.32645840981637164
Energy: 0.32950581252353645
Energy: 0.30055875943900034
Energy: 0.3096827173016068
Energy: 0.3039315489406622
Energy: 0.32615278199340153
Energy: 0.3177096241059436
Energy: 0.3100221290668497
Energy: 0.34414928035749864
Energy: 0.3147214687219394
Energy: 0.31565866628405276
Energy: 0.32650497688004826
Energy: 0.3145540282986378
Energy: 0.301971424665097
Energy: 0.3412700715882808
Energy: 0.3226490879165761
Energy: 0.32585870189071936
Energy: 0.31734029767099786
Energy: 0.3148802695314955
Energy: 0.32556947384577245
Energy: 0.3659955399493734
Energy: 0.29384442604154304
Energy: 0.33855960239646543
Energy: 0.3642168311250163
Energy: 0.32734028516457364
Energy: 0.3423365751027864
Energy: 0.329117453684866
Energy: 0.29664354824032974
Energy: 0.2920619928456569
Energy: 0.3189382771336588
Energy: 0.29432068298284697
Energy: 0.29225469541988675
Energy: 0.3440319246995375
Energy: 0.2925375593088582
Energy: 0.2926818287146382
Energy: 0.3047266399546329
Energy: 0.2922073830925949
Energy: 0.293078222401525
Energy: 0.3293084425290389
Energy: 0.30830189430871735
Energy: 0.2936192166583437
Energy: 0.3092419308591676
Energy: 0.3090704514142407
Energy: 0.29322951243210044
Energy: 0.34879493732489464
Energy: 0.3077024890857951
Energy: 0.3095231065204906
Energy: 0.3355863797721722
Energy: 0.315357368216303
Energy: 0.3155327386945084
Energy: 0.3705113207503737
Energy: 0.30090130847690466
Energy: 0.3102983898683648
Energy: 0.363052224219357
Energy: 0.29009612857210654
Energy: 0.29830869196573107
Energy: 0.3140029290563839
Energy: 0.294993747497644
Energy: 0.2976312127624204
Energy: 0.3095605574484316
Energy: 0.31130339613663083
Energy: 0.2942744707536053
Energy: 0.42016836939504876
Energy: 0.3121740040130778
Energy: 0.30468195027285644
Energy: 0.3327956996785339
Energy: 0.31193201936849546
Energy: 0.3080617727575212
Energy: 0.31210932449095774
Energy: 0.31502489542035667
Energy: 0.2937741272582288
Energy: 0.32482380917101444
Energy: 0.31235346782439627
Energy: 0.3110093360288251
Energy: 0.33771784569113356
Energy: 0.32506659054097387
Energy: 0.32819974195586976
Energy: 0.3375749148202267
Energy: 0.3131360072783307
Energy: 0.33738907255355916
Energy: 0.31592943339426155
Energy: 0.3325966722742597
Energy: 0.32353146677482914
Energy: 0.3168260933057663
Energy: 0.31961317117538735
Energy: 0.29172991855902936
Energy: 0.31550163874684883
Energy: 0.29272314116307147
Energy: 0.29266096490175414
Energy: 0.315692888100374
Energy: 0.2919036321006436
Energy: 0.292051483604804
Energy: 0.2936823720691564
Energy: 0.29284230271805933
Energy: 0.2929315099109488
Energy: 0.29371405020581665
Energy: 0.2937387508760892
Energy: 0.29413635460873344
Energy: 0.28796381080920924
Energy: 0.32756758395113517
Energy: 0.2915287889972518
Energy: 0.3265519262849674
Energy: 0.3064423124925539
Energy: 0.2933290036712045

minimum gb energy = 0.2859651172165602 eV
minimum distance =  2.70611790049653 Angstroms
sigma value = 81


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

Energy: 0.47379125533823924
Energy: 0.3003696161467147
Energy: 0.30023248103260847
Energy: 0.3009632377397171
Energy: 0.3269069740459624
Energy: 0.300524481356446
Energy: 0.2773808969270548
Energy: 0.2797094129895265
Energy: 0.29171447957865926
Energy: 0.2793551633787882
Energy: 0.281446427213267
Energy: 0.2903074006245837
Energy: 0.3240202437465684
Energy: 0.27825863825896296
Energy: 0.320211483913006
Energy: 0.32491227317773824
Energy: 0.27726842846113947
Energy: 0.3065625737716378
Energy: 0.28192621846803095
Energy: 0.277339758925399
Energy: 0.27939290351243223
Energy: 0.2826755265606079
Energy: 0.2769216700466984
Energy: 0.2784425958967435
Energy: 0.2782936482182169
Energy: 0.29200221491826533
Energy: 0.29168264850259323
Energy: 0.27829773813476905
Energy: 0.2912071416056058
Energy: 0.27942021273310286
Energy: 0.27927298553859464
Energy: 0.29156525689383983
Energy: 0.2797610017771118
Energy: 0.2790456782374999
Energy: 0.29099519090375203
Energy: 0.3077195633496862
Energy: 0.27817441294915995
Energy: 0.2802687517869543
Energy: 0.29184332405327607
Energy: 0.2799247201075624
Energy: 0.28034499970443105
Energy: 0.29132315616601
Energy: 0.3907233936872547
Energy: 0.3007268804016419
Energy: 0.3144950355781397
Energy: 0.2890128264719573
Energy: 0.3013809837819199
Energy: 0.30537554974043885
Energy: 0.27956577915199105
Energy: 0.2917488046603235
Energy: 0.29080546063477264
Energy: 0.279584276964165
Energy: 0.2807817719862531
Energy: 0.29003541603502536
Energy: 0.32398207956676095
Energy: 0.2783336474793517
Energy: 0.278388488983154
Energy: 0.32460212323032067
Energy: 0.2774202865818366
Energy: 0.278101545555399
Energy: 0.2798842867783379
Energy: 0.2768322255375017
Energy: 0.27693969035773774
Energy: 0.2798843560830301
Energy: 0.29002203808229476
Energy: 0.3056774285234677
Energy: 0.2769431858406433
Energy: 0.2807201352629449
Energy: 0.3061542990216627
Energy: 0.27677990824341986
Energy: 0.28062122688629265
Energy: 0.29163887295322466
Energy: 0.27702507866823384
Energy: 0.2791154145499059
Energy: 0.2797363424584042
Energy: 0.2772764018778583
Energy: 0.2789332702707143
Energy: 0.31960508427780887
Energy: 0.28020353742790866
Energy: 0.2783874136917872
Energy: 0.2781355672944516
Energy: 0.28016159558134657
Energy: 0.2803783569215948
Energy: 0.2784366537310541
Energy: 0.28009622792417455
Energy: 0.3328711839240137
Energy: 0.2797294413026774
Energy: 0.29192407535650916
Energy: 0.32858896177422603
Energy: 0.30756948593426503
Energy: 0.2790325183737832
Energy: 0.28038349443338817
Energy: 0.2902161587357164
Energy: 0.27962914607400263
Energy: 0.28014577819340686
Energy: 0.28990935154589487
Energy: 0.32859408898506925
Energy: 0.3353346999895741
Energy: 0.3313792500975965
Energy: 0.3119464729789881
Energy: 0.28891981637928255
Energy: 0.332108013384123
Energy: 0.2792283652749952
Energy: 0.29117260491331515
Energy: 0.29249483603731086
Energy: 0.27994173822620466
Energy: 0.28066093770889766
Energy: 0.2923991347993408
Energy: 0.27854409355340026
Energy: 0.27982557881897746
Energy: 0.2774230214590848
Energy: 0.2902920542153541
Energy: 0.2788286897154877
Energy: 0.2773473288847793
Energy: 0.27840271076297735
Energy: 0.2806302705948816
Energy: 0.277888486384455
Energy: 0.2774907464254626
Energy: 0.2799508944142379
Energy: 0.2775067252396361
Energy: 0.2786484596847949
Energy: 0.2800525480145482
Energy: 0.29132176120085285
Energy: 0.2799046696408579
Energy: 0.2803218100755192
Energy: 0.29160759700834366
Energy: 0.2787216244187499
Energy: 0.31939558870150614
Energy: 0.31863217023218926
Energy: 0.2789043404297764
Energy: 0.2806564024076139
Energy: 0.31784065806860473
Energy: 0.2771980136541409
Energy: 0.2900417477245423
Energy: 0.27813964770708555
Energy: 0.2778599668624988
Energy: 0.2794174848490323
Energy: 0.2776754880742507
Energy: 0.2781390552772483
Energy: 0.3088788856594325
Energy: 0.308938511116453
Energy: 0.27852247155982657
Energy: 0.2922672128270631
Energy: 0.30860182115430534
Energy: 0.27920993807259464
Energy: 0.292295179431259
Energy: 0.29145820216881085
Energy: 0.2821233651438671
Energy: 0.27981401256481825
Energy: 0.2917222230962055
Energy: 0.3250386311987613
Energy: 0.30656785559839145
Energy: 0.2909502882332064
Energy: 0.2889024003148785
Energy: 0.2803515606607184
Energy: 0.29109450869063597
Energy: 0.281162935487008
Energy: 0.29994528588579067
Energy: 0.29104318413797875
Energy: 0.28851010588642223
Energy: 0.2800331410492455
Energy: 0.2910614931698237
Energy: 0.27931790840915416
Energy: 0.27668100703165477
Energy: 0.29283131970712123
Energy: 0.28259528314582466
Energy: 0.2774181019134427
Energy: 0.29222992807788917
Energy: 0.2798801774469139
Energy: 0.2792491439201222
Energy: 0.27877624761454
Energy: 0.28042761250557724
Energy: 0.2787449556322055
Energy: 0.3021070629801142
Energy: 0.2786241677211515
Energy: 0.2803914659692281
Energy: 0.2903635420013138
Energy: 0.27925908405503863
Energy: 0.28004553329363313
Energy: 0.2896287795443551
Energy: 0.30780557361299427
Energy: 0.30820180520579693
Energy: 0.3078747717973277
Energy: 0.2785189614257796
Energy: 0.327508275059474
Energy: 0.3188335473933958
Energy: 0.28082700159689644
Energy: 0.2781676669207123
Energy: 0.27800256932472794
Energy: 0.2804613499333973
Energy: 0.2802099103633324
Energy: 0.2780256741034868
Energy: 0.32798505466746386
Energy: 0.2787232724877237
Energy: 0.2798154084376752
Energy: 0.2917295695588882
Energy: 0.2783982188769882
Energy: 0.3038809852750714
Energy: 0.28136898189450604
Energy: 0.30593613979472123
Energy: 0.30633391356021467
Energy: 0.2805222757277981
Energy: 0.27972562162614695
Energy: 0.27957138213057914
Energy: 0.28015896773385446
Energy: 0.2909927328011786
Energy: 0.29354977709959423
Energy: 0.28031496080109186
Energy: 0.28888582418054853
Energy: 0.2932186515972246
Energy: 0.3534735243767763
Energy: 0.2895301202774504
Energy: 0.3062608070245011
Energy: 0.3358385048673585
Energy: 0.28943039671096477
Energy: 0.29087429140306786
Energy: 0.2800172828407265
Energy: 0.27959840122035234
Energy: 0.29051560903941503
Energy: 0.27929146480775735
Energy: 0.2807879519963004
Energy: 0.2900609081073348
Energy: 0.3664274237855331
Energy: 0.30746068295135015
Energy: 0.3005203179384279
Energy: 0.27892392362488927
Energy: 0.3075572076587813
Energy: 0.3009693479281142

minimum gb energy = 0.27668100703165477 eV
minimum distance =  2.72897096186601 Angstroms
sigma value = 43


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

Energy: 0.5041888086468451
Energy: 0.361236796494015
Energy: 0.3429764688961838
Energy: 0.3242191203919308
Energy: 0.3451835324595272
Energy: 0.3231922113686811
Energy: 0.28590436220697735
Energy: 0.3160812288666237
Energy: 0.2952746355383356
Energy: 0.3110084492729251
Energy: 0.28965375648406555
Energy: 0.29309763537664607
Energy: 0.3395541389975233
Energy: 0.2841721019985322
Energy: 0.2841122846347589
Energy: 0.34876395659259507
Energy: 0.28469945275069247
Energy: 0.2936736891534962
Energy: 0.2930245679902225
Energy: 0.2836684785827985
Energy: 0.2935132290124718
Energy: 0.2930347720154294
Energy: 0.27952818660791473
Energy: 0.2933072799268919
Energy: 0.2926727723937108
Energy: 0.29891863285406556
Energy: 0.29292183210225575
Energy: 0.29266953197021744
Energy: 0.2932440667157348
Energy: 0.29346978217966624
Energy: 0.2938292908685253
Energy: 0.2938755333653267
Energy: 0.29307621999927086
Energy: 0.29387450529426734
Energy: 0.2931576693804568
Energy: 0.3386767171235714
Energy: 0.2929328632824727
Energy: 0.29293636187443495
Energy: 0.29280532390089203
Energy: 0.29287513478799104
Energy: 0.2931019457280893
Energy: 0.2928520777255476
Energy: 0.3071300205702112
Energy: 0.2941183456500596
Energy: 0.2939524603670022
Energy: 0.28154208881688275
Energy: 0.29409128127824596
Energy: 0.34807699940954695
Energy: 0.2898273660520221
Energy: 0.29403010811779373
Energy: 0.29302268045009194
Energy: 0.289486617880802
Energy: 0.3134274668596333
Energy: 0.29347875330072204
Energy: 0.2890580505674282
Energy: 0.29273585756838205
Energy: 0.29259620128919606
Energy: 0.2889875566674697
Energy: 0.29220966448846186
Energy: 0.2925356786921474
Energy: 0.28205778567663925
Energy: 0.31242925258181703
Energy: 0.29813898847588566
Energy: 0.2900029394730348
Energy: 0.2875879232085802
Energy: 0.3058208464289207
Energy: 0.2923063046639296
Energy: 0.293283924323188
Energy: 0.293587636471087
Energy: 0.2851160526955645
Energy: 0.31145584324913406
Energy: 0.2940034434200645
Energy: 0.31537414154570503
Energy: 0.2936366377483561
Energy: 0.30275652469252534
Energy: 0.28514739960515656
Energy: 0.31488701413002285
Energy: 0.30290331048530683
Energy: 0.2821015966757095
Energy: 0.29353796151147943
Energy: 0.29324881091502425
Energy: 0.2894731035560827
Energy: 0.31037195574678467
Energy: 0.3104349738369643
Energy: 0.28259531515101033
Energy: 0.3421834385843389
Energy: 0.2825951005985019
Energy: 0.28257183055960416
Energy: 0.34101525827414564
Energy: 0.2826635527225342
Energy: 0.28146919292741374
Energy: 0.2824165760726476
Energy: 0.28176959378669925
Energy: 0.28238198283474736
Energy: 0.31259695642425944
Energy: 0.282171125172379
Energy: 0.28241108393863973
Energy: 0.2827843122029988
Energy: 0.2829124878805905
Energy: 0.28250100710680104
Energy: 0.30852348403228735
Energy: 0.28280806146383713
Energy: 0.28252789901721215
Energy: 0.3133568432468578
Energy: 0.3126326205412217
Energy: 0.29597409715302947
Energy: 0.3076027560245401
Energy: 0.2827881590514757
Energy: 0.2871355908961706
Energy: 0.2920224422746486
Energy: 0.2826100149369814
Energy: 0.3048326954626341
Energy: 0.3080081538540203
Energy: 0.29330107562543645
Energy: 0.2874085001634786
Energy: 0.3006671117988856
Energy: 0.283575582298463
Energy: 0.2818616715910422
Energy: 0.2891286807832122
Energy: 0.2927992883134978
Energy: 0.2822874219335439
Energy: 0.28308651304794324
Energy: 0.29903616936896327
Energy: 0.2968631115508879
Energy: 0.29399217758468094
Energy: 0.2826600046468077
Energy: 0.3544075389052316
Energy: 0.3304778926594523
Energy: 0.3301895746759028
Energy: 0.3006169951582413
Energy: 0.29158951357526985
Energy: 0.3301877902669164
Energy: 0.3085653547903411
Energy: 0.2830594305909937
Energy: 0.31273433363119896
Energy: 0.30822125378516213
Energy: 0.30753625039356364
Energy: 0.3296667067031141
Energy: 0.3405523063431037
Energy: 0.320787256480827
Energy: 0.28276586035182566
Energy: 0.2832846093138533
Energy: 0.33838341460210936
Energy: 0.2825182823651996
Energy: 0.3232277988574278
Energy: 0.2820226364893462
Energy: 0.28192234141319605
Energy: 0.3083272708715618
Energy: 0.28202311113913614
Energy: 0.2819971807341531
Energy: 0.31113503938606996
Energy: 0.2821646777841086
Energy: 0.2822852150961758
Energy: 0.293049172956355
Energy: 0.2818757865309646
Energy: 0.2828492790059955
Energy: 0.31150173900370676
Energy: 0.3368044088005386
Energy: 0.3414432280987313
Energy: 0.29391658833160095
Energy: 0.2891865103995332
Energy: 0.31002433764681875
Energy: 0.31160723479576324
Energy: 0.2950462786768489
Energy: 0.29311038535867445
Energy: 0.31321326198087507
Energy: 0.28893598636886847
Energy: 0.29379872261430784
Energy: 0.29491318052200255
Energy: 0.29285760319434034
Energy: 0.29261143640944903
Energy: 0.2946652605094518
Energy: 0.28111120326404127
Energy: 0.30149884572691915
Energy: 0.2933940779139131
Energy: 0.28435412132920873
Energy: 0.2936869762956999
Energy: 0.31139814877789485
Energy: 0.28973415408098113
Energy: 0.29307112674743
Energy: 0.3798348881283066
Energy: 0.33899320346811546
Energy: 0.30628591717815257
Energy: 0.3010828758745138
Energy: 0.2824081256150431
Energy: 0.2838336711436492

minimum gb energy = 0.27952818660791473 eV
minimum distance =  2.71647674649117 Angstroms
sigma value = 57


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

Energy: 0.3489413508149012
Energy: 0.3311776937114479
Energy: 0.33257335549304157
Energy: 0.35252350650331316
Energy: 0.5203219631514148
Energy: 0.329138900585382
Energy: 0.26748763151526406
Energy: 0.29269366716551254
Energy: 0.29342094153181025
Energy: 0.2920171785648983
Energy: 0.2930703906001051
Energy: 0.33439920625990827
Energy: 0.33447579412900164
Energy: 0.2654767778057901
Energy: 0.26620507654715353
Energy: 0.30807130852871917
Energy: 0.3111199679061476
Energy: 0.26654120695988387
Energy: 0.29143406910361397
Energy: 0.2658393259799241
Energy: 0.26527308429331153
Energy: 0.29169153265440173
Energy: 0.31062654238098397
Energy: 0.2888271748638433
Energy: 0.2887126696441198
Energy: 0.28005594234168457
Energy: 0.2805503149366902
Energy: 0.2883637536867803
Energy: 0.2889862035569767
Energy: 0.28001851365058017
Energy: 0.26591656285601656
Energy: 0.28000421469582143
Energy: 0.2790748809508632
Energy: 0.2800127644015256
Energy: 0.28880925911468835
Energy: 0.2792598408043596
Energy: 0.2923372185169512
Energy: 0.28879842924887333
Energy: 0.2889391347019602
Energy: 0.29214812576755406
Energy: 0.29007761587156994
Energy: 0.2885523866367919
Energy: 0.287584037650867
Energy: 0.28978367143757155
Energy: 0.33642916177807597
Energy: 0.2785092546315116
Energy: 0.28873372810837655
Energy: 0.29064996120363473
Energy: 0.2915988755741839
Energy: 0.2900034647942119
Energy: 0.28987168584076145
Energy: 0.29195503228010944
Energy: 0.2926729391179368
Energy: 0.29055136244616697
Energy: 0.2926591627563265
Energy: 0.28812098963877425
Energy: 0.2884483264502244
Energy: 0.2928750812982978
Energy: 0.28912139765078
Energy: 0.2881419970479777
Energy: 0.32054333367670895
Energy: 0.2892757702885638
Energy: 0.32599630124962914
Energy: 0.2928831490546884
Energy: 0.2918952828144685
Energy: 0.2900452680163869
Energy: 0.2649311822849303
Energy: 0.2936164290500551
Energy: 0.293587292019519
Energy: 0.2660375724473778
Energy: 0.29325079222976547
Energy: 0.31032478343350584
Energy: 0.26729703100086044
Energy: 0.2935995206623916
Energy: 0.3111878097412155
Energy: 0.2686182866524919
Energy: 0.2928814004785203
Energy: 0.3111028967897106
Energy: 0.32135584704553855
Energy: 0.29196413804285426
Energy: 0.2890971711534659
Energy: 0.2931378015847665
Energy: 0.2925817610865644
Energy: 0.2901346343632829
Energy: 0.2895402646792121
Energy: 0.2873112665943372
Energy: 0.28726092498575573
Energy: 0.28961809032808433
Energy: 0.2893418866060097
Energy: 0.33743043491776137
Energy: 0.2882350956231235
Energy: 0.2796455747788874
Energy: 0.27987980297112697
Energy: 0.2889375721399764
Energy: 0.30241074383844013
Energy: 0.28824295925880644
Energy: 0.2894648285142526
Energy: 0.2795784273162824
Energy: 0.2801616729196438
Energy: 0.2898387380652524
Energy: 0.3081904705454265
Energy: 0.27949897050718703
Energy: 0.28919165873310415
Energy: 0.2888524234680051
Energy: 0.2890767139346287
Energy: 0.28903249080165394
Energy: 0.2890023514979512
Energy: 0.2793756214870856
Energy: 0.2919217566765011
Energy: 0.28903773871834587
Energy: 0.28914206168662837
Energy: 0.2922099652457196
Energy: 0.2890207842845699
Energy: 0.2893507158965969
Energy: 0.2918523193871641
Energy: 0.28979016564678245
Energy: 0.2898496204379538
Energy: 0.2920982092516925
Energy: 0.30867611137562145
Energy: 0.28991009191012534
Energy: 0.2932725456937982
Energy: 0.29018537793314625
Energy: 0.2907380885896107
Energy: 0.2933475935471086
Energy: 0.2924643305471139
Energy: 0.2899304738252788
Energy: 0.3316653185485949
Energy: 0.30978725243248095
Energy: 0.30873897809364825
Energy: 0.33109789472444245
Energy: 0.3101123163573695
Energy: 0.3071756462119583
Energy: 0.32152420243908414
Energy: 0.2919564186277882
Energy: 0.29015956978357954
Energy: 0.2927414400833447
Energy: 0.29251564561909427
Energy: 0.28999223574942895
Energy: 0.26747547373995334
Energy: 0.2931572484442201
Energy: 0.31129996927577036
Energy: 0.3320864854135328
Energy: 0.2926567492085995
Energy: 0.3111836623705155

minimum gb energy = 0.2649311822849303 eV
minimum distance =  2.69425123484783 Angstroms
sigma value = 17


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

Energy: 0.2604791667582103
Energy: 0.36125195064522636
Energy: 0.36122790633135143
Energy: 0.27799689078667417
Energy: 0.35106587200744277
Energy: 0.29406855863789555
Energy: 0.28064674147134255
Energy: 0.3166449633276791
Energy: 0.3157663322684309
Energy: 0.3192010792179956
Energy: 0.32039857686456524
Energy: 0.2938681000088403
Energy: 0.3099806953467694
Energy: 0.2789911694021934
Energy: 0.27904903205958487
Energy: 0.31970310581706896
Energy: 0.30843525522122894
Energy: 0.27891215096411787
Energy: 0.31740391668211193
Energy: 0.27867444863817525
Energy: 0.27883736453229013
Energy: 0.3178961206824258
Energy: 0.2573728041329698
Energy: 0.3155548860330771
Energy: 0.27434156969743745
Energy: 0.298589212550061
Energy: 0.29951402414253075
Energy: 0.2746201064749987
Energy: 0.30416779768415403
Energy: 0.29788618696917246
Energy: 0.2802253633325685
Energy: 0.2696645684526378
Energy: 0.269216048168414
Energy: 0.322140442089597
Energy: 0.26962668350490054
Energy: 0.25797897415370424
Energy: 0.28122209654940067
Energy: 0.27018140675439073
Energy: 0.26985788719759707
Energy: 0.28125555443120615
Energy: 0.27064429992298067
Energy: 0.26901375428517404
Energy: 0.2705375653330148
Energy: 0.28413822337917166
Energy: 0.28370320680522626
Energy: 0.2876829671437031
Energy: 0.27306676779617933
Energy: 0.2837572070969567
Energy: 0.2703084095823634
Energy: 0.27558104232100733
Energy: 0.28853447352806033
Energy: 0.27093756785431367
Energy: 0.26988554299456324
Energy: 0.26913671433943165
Energy: 0.26923458242613263
Energy: 0.27050971614256025
Energy: 0.269435274978109
Energy: 0.26930543612244934
Energy: 0.2700710863891568
Energy: 0.26970882632343385
Energy: 0.2710561200380791
Energy: 0.294731245257729
Energy: 0.29807319981255087
Energy: 0.2875389227827165
Energy: 0.27489444098019683
Energy: 0.2701740738924218
Energy: 0.27984635213487113
Energy: 0.3158871844043637
Energy: 0.31534303583508055
Energy: 0.27314621488528174
Energy: 0.3176043912410722
Energy: 0.3157009296882297
Energy: 0.27404302395844515
Energy: 0.3164732293109236
Energy: 0.31649103239157245
Energy: 0.29690641613963475
Energy: 0.31980635898942783
Energy: 0.3143978594419061
Energy: 0.31999963629673345
Energy: 0.3169068023315628
Energy: 0.316304976166408
Energy: 0.3199326669946746
Energy: 0.3178457529230774
Energy: 0.2936930330454082
Energy: 0.3346144329648189
Energy: 0.3188184336056081
Energy: 0.28723524237237325
Energy: 0.3191430104304794
Energy: 0.31279488383742066
Energy: 0.3541699617663848
Energy: 0.347739742600849
Energy: 0.319932260767689
Energy: 0.2944417364150727
Energy: 0.32098069936129914
Energy: 0.3196832472708378
Energy: 0.3167709354925329
Energy: 0.255677269089185
Energy: 0.3197161095456976
Energy: 0.3510155689742772
Energy: 0.25728356351231263
Energy: 0.3184508810360439
Energy: 0.3509246223605454

minimum gb energy = 0.255677269089185 eV
minimum distance =  2.68182444571645 Angstroms
sigma value = 17


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

Energy: 0.4953592202984244
Energy: 0.43151742111282476
Energy: 0.31110138765233375
Energy: 0.2954051188906997
Energy: 0.46691695879143363
Energy: 0.320782822798027
Energy: 0.3086497496282302
Energy: 0.2921060504163004
Energy: 0.32538360460266086
Energy: 0.29663938583401345
Energy: 0.345016119275393
Energy: 0.3146380001920517
Energy: 0.3949103504589752
Energy: 0.2708100642338457
Energy: 0.3082832034495061
Energy: 0.32590292160563467
Energy: 0.3060343940517729
Energy: 0.30814637886384494
Energy: 0.3036108528256237
Energy: 0.3187434239388485
Energy: 0.30810591928727027
Energy: 0.33673260593303433
Energy: 0.2732679087192291
Energy: 0.3081872227805298
Energy: 0.30001973000940807
Energy: 0.30276130447256877
Energy: 0.27081355323877565
Energy: 0.3004493607034896
Energy: 0.31363797606681054
Energy: 0.27003263554047235
Energy: 0.2568467016028416
Energy: 0.2934731750455331
Energy: 0.2716620820576618
Energy: 0.2776583409817859
Energy: 0.2934199128056837
Energy: 0.27180091678018464
Energy: 0.27390350220984866
Energy: 0.29556879537529507
Energy: 0.2928431549235566
Energy: 0.27401977338247746
Energy: 0.2948320894183441
Energy: 0.2932497483534446
Energy: 0.31362218379097856
Energy: 0.2577073315887338
Energy: 0.2766260420963408
Energy: 0.3016775886788023
Energy: 0.25826982892272665
Energy: 0.2778308221797452
Energy: 0.27439928952530723
Energy: 0.2718509356720466
Energy: 0.27042570441248376
Energy: 0.2752520270313536
Energy: 0.2780207240667974
Energy: 0.2705232828579874
Energy: 0.2721900559039368
Energy: 0.28523227661132095
Energy: 0.27940181978158934
Energy: 0.27197558222189117
Energy: 0.2870369879516902
Energy: 0.290548089210375
Energy: 0.2739208824334469
Energy: 0.2713710161137871
Energy: 0.27238637640491226
Energy: 0.2957322119943124
Energy: 0.27135117347483184
Energy: 0.2934711011718356
Energy: 0.27136798977601
Energy: 0.27100691346472006
Energy: 0.2709665152507898
Energy: 0.271721236499296
Energy: 0.2738583830896913
Energy: 0.27091923704033877
Energy: 0.2715909959517497
Energy: 0.27479673988347747
Energy: 0.27513890942394253
Energy: 0.30837371065700026
Energy: 0.2748444880132584
Energy: 0.27454113242456596
Energy: 0.29483198259250226
Energy: 0.3225472171924226
Energy: 0.31696402521031636
Energy: 0.29560434257025076
Energy: 0.27072834373605154
Energy: 0.2944191427508096
Energy: 0.2963375822908243
Energy: 0.289606205010721
Energy: 0.3213046988491087
Energy: 0.2962296549700514
Energy: 0.2824574697004205
Energy: 0.29755288349945663
Energy: 0.359678749360904
Energy: 0.27276801253803606
Energy: 0.3186260005135626
Energy: 0.30626831652018693
Energy: 0.2729595298719306
Energy: 0.3029330107510642
Energy: 0.262466873490685
Energy: 0.3443328533895341
Energy: 0.3442588921576348
Energy: 0.2636353691385088
Energy: 0.3507904429695823
Energy: 0.28873278589663653
Energy: 0.2627999147612995
Energy: 0.3493846958212483
Energy: 0.34931442495830506
Energy: 0.26353871112775906
Energy: 0.3419499523232872
Energy: 0.28941619640751143
Energy: 0.3661953495986512
Energy: 0.33808668195209823
Energy: 0.31920361600074026
Energy: 0.32343316072244016
Energy: 0.28873578725631416
Energy: 0.3107765852470659
Energy: 0.391697554189178
Energy: 0.2955300449698816
Energy: 0.29119529685143314
Energy: 0.323326696584479
Energy: 0.2961074758815774
Energy: 0.3469067972867839
Energy: 0.39209582249568004
Energy: 0.3376793901836352
Energy: 0.33991109191096563
Energy: 0.3066088697487795
Energy: 0.32072296272091944
Energy: 0.30664023179247724
Energy: 0.2596463081635531
Energy: 0.35462991279322575
Energy: 0.3442372353340293
Energy: 0.29090804939387616
Energy: 0.3458911904382919
Energy: 0.2959260711012789
Energy: 0.2609815471426409
Energy: 0.3528583348507277
Energy: 0.3513412350516233
Energy: 0.2615158087759368
Energy: 0.355565372511104
Energy: 0.31145379573029436
Energy: 0.3891127004549536
Energy: 0.2956021186653128
Energy: 0.3037326253525039
Energy: 0.3036753643960413
Energy: 0.27466407406573123
Energy: 0.30097684155774923
Energy: 0.3328470350287503
Energy: 0.2722863646393482
Energy: 0.30896577288631616
Energy: 0.3272305044494693
Energy: 0.2719653394618098
Energy: 0.30900804707392165
Energy: 0.3021388004635155
Energy: 0.30223650824791454
Energy: 0.3017524679393416
Energy: 0.30235280247901813
Energy: 0.30665601703876677
Energy: 0.32140474383449236
Energy: 0.2566005866838756
Energy: 0.3019238311306073
Energy: 0.301077430637885
Energy: 0.27305362722420023
Energy: 0.314491765383259
Energy: 0.2719593761238149
Energy: 0.25958700875746366
Energy: 0.2949228536803113
Energy: 0.29457934896379956
Energy: 0.2598401129525403
Energy: 0.2974163013762964
Energy: 0.29455136264778575
Energy: 0.35075944748696597
Energy: 0.3007586045583612
Energy: 0.31705079427689964
Energy: 0.27912384246922667
Energy: 0.2775699855360589
Energy: 0.2752449239681467
Energy: 0.2780978245919338
Energy: 0.2570720449900105
Energy: 0.2722889964730517
Energy: 0.278729971931108
Energy: 0.2589988214678194
Energy: 0.2715494858950202
Energy: 0.27559104284584024
Energy: 0.2858543197126444
Energy: 0.28902288224009254
Energy: 0.27633375457530446
Energy: 0.32243528189850007
Energy: 0.2722574474570554
Energy: 0.2770498068086013
Energy: 0.294951114832063
Energy: 0.2932678444180524
Energy: 0.27339581518482425
Energy: 0.2736141431651845
Energy: 0.29580525709880795
Energy: 0.2760670259743578
Energy: 0.27359129025198464
Energy: 0.27080468885272524
Energy: 0.27818470860344907
Energy: 0.27313479585518213
Energy: 0.2706293796462161
Energy: 0.2794721170198141
Energy: 0.2988901574052356
Energy: 0.3299878508784236
Energy: 0.28869920159417944
Energy: 0.27323516106153345
Energy: 0.29313566942976116
Energy: 0.29737848939388384
Energy: 0.29608934312367224
Energy: 0.29946652628278075
Energy: 0.29715476826123
Energy: 0.27942719374315467
Energy: 0.28728310035259236
Energy: 0.29929919892283374
Energy: 0.26299665204452793
Energy: 0.29492081316392144
Energy: 0.2954290452725936
Energy: 0.26304461121145467
Energy: 0.2945378081671837
Energy: 0.35971866089835314
Energy: 0.3000883356721438
Energy: 0.29951796066246716
Energy: 0.3123939750157966
Energy: 0.27345929458918056
Energy: 0.29920308325214995
Energy: 0.26608514056928045
Energy: 0.3426486569319761
Energy: 0.3241071213356939
Energy: 0.30020800680233045
Energy: 0.34435159150183015
Energy: 0.2952203224055379
Energy: 0.26229967818114563
Energy: 0.34560107184957944
Energy: 0.2906058616794286
Energy: 0.2963995694559974
Energy: 0.359158264123239
Energy: 0.2896230238254615
Energy: 0.2948110236740005
Energy: 0.33348765293996
Energy: 0.30834256818362066
Energy: 0.29471176046162206
Energy: 0.33530839889868
Energy: 0.31412515885052833
Energy: 0.369677072500193
Energy: 0.28901636522525687
Energy: 0.3333065270576072
Energy: 0.3395981004270386
Energy: 0.28976995141005135
Energy: 0.3331506761078994
Energy: 0.3953166047417701
Energy: 0.32511711190212605
Energy: 0.3200070153925452
Energy: 0.3118775191314488
Energy: 0.2962754962980055
Energy: 0.3178322305723256
Energy: 0.2725881395609316
Energy: 0.3614448708940538
Energy: 0.3499859537346508
Energy: 0.2618540216290219
Energy: 0.35994231000687665
Energy: 0.3255787374039301

minimum gb energy = 0.2566005866838756 eV
minimum distance =  2.63828769211501 Angstroms
sigma value = 57


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

Energy: 0.42262583526110775
Energy: 0.35506579648982317
Energy: 0.3163818166633222
Energy: 0.2670232593802206
Energy: 0.44437919427411154
Energy: 0.38210628913211936
Energy: 0.3713358386904335
Energy: 0.29342829210574467
Energy: 0.2881805488180962
Energy: 0.32937127354039625
Energy: 0.32096453158487515
Energy: 0.32211611145447133
Energy: 0.37078936482097763
Energy: 0.266118939677327
Energy: 0.26607723612444456
Energy: 0.34225816474346027
Energy: 0.26651885044813944
Energy: 0.30281143928443166
Energy: 0.3185913533654877
Energy: 0.2660728550355453
Energy: 0.3023077046469833
Energy: 0.2883001204097504
Energy: 0.26684774261280725
Energy: 0.30231919759795906
Energy: 0.2530741673777378
Energy: 0.2880162770108947
Energy: 0.29077568623570366
Energy: 0.25331027911787724
Energy: 0.28607711949901893
Energy: 0.28508684309830706
Energy: 0.23913189649991845
Energy: 0.28577955810587113
Energy: 0.26623791733263386
Energy: 0.2716013141630174
Energy: 0.28600343164533704
Energy: 0.26725741102470474
Energy: 0.25799782820522454
Energy: 0.2889865327166154
Energy: 0.2900417049171494
Energy: 0.2703243403957542
Energy: 0.2864814265137981
Energy: 0.27637817963189504
Energy: 0.3244142856363943
Energy: 0.24718959493074988
Energy: 0.24686926638452877
Energy: 0.26435363182964017
Energy: 0.24635008801838687
Energy: 0.25811759341557083
Energy: 0.2578473683086353
Energy: 0.2566956602585424
Energy: 0.25590387309611085
Energy: 0.25791726919616653
Energy: 0.24282359905203635
Energy: 0.25602962421914427
Energy: 0.2640761319323466
Energy: 0.2692917587418296
Energy: 0.2930715977958729
Energy: 0.26406789538568715
Energy: 0.25117859913019613
Energy: 0.29263825449006253
Energy: 0.25105489943807413
Energy: 0.24349383522154014
Energy: 0.24299636564259097
Energy: 0.2895613114645383
Energy: 0.2519479237000648
Energy: 0.24382706485772374
Energy: 0.26178653204461005
Energy: 0.25105319188892017
Energy: 0.25020276030865995
Energy: 0.24884711416875388
Energy: 0.24824279800482724
Energy: 0.24397054857242007
Energy: 0.2451678437130403
Energy: 0.2445074815606241
Energy: 0.26613221874315834
Energy: 0.24576174932276557
Energy: 0.24525240353651676
Energy: 0.2674521369221586
Energy: 0.24386458626037616
Energy: 0.2663353330021467
Energy: 0.24253755247163558
Energy: 0.24464552108266582
Energy: 0.2484536942824776
Energy: 0.24885916954235898
Energy: 0.24391826057469504
Energy: 0.2768091622237386
Energy: 0.2885372011176774
Energy: 0.2424654247646359
Energy: 0.27591595820548354
Energy: 0.2990808861203638
Energy: 0.296287532557641
Energy: 0.26324631027017376
Energy: 0.2574637177947863
Energy: 0.2570223559021878
Energy: 0.2616299456839536
Energy: 0.2905254789340868
Energy: 0.2427381952904625
Energy: 0.26132276500658813
Energy: 0.2562733645344679
Energy: 0.2573560901389032
Energy: 0.25975944873590934
Energy: 0.256007480230076
Energy: 0.24353416208376283
Energy: 0.26244046908300733
Energy: 0.2564691293624553
Energy: 0.2441354798194118
Energy: 0.2619543277374263
Energy: 0.2563980749013291
Energy: 0.28455194456294297
Energy: 0.2848858646822009
Energy: 0.2755151917224997
Energy: 0.28536995469330473
Energy: 0.2641825969702281
Energy: 0.29063794290015815
Energy: 0.2870370935321831
Energy: 0.308136501395396
Energy: 0.28745452365057733
Energy: 0.28713526810950346
Energy: 0.28679116208384026
Energy: 0.2895122681597642
Energy: 0.3403827491296575
Energy: 0.3189694608154743
Energy: 0.3311160312889948
Energy: 0.2919346055589304
Energy: 0.2930700079743332
Energy: 0.29052521210904886
Energy: 0.24223118866128124
Energy: 0.3272374223089496
Energy: 0.28463781448967385
Energy: 0.2573279769676425
Energy: 0.33074778549378764
Energy: 0.28427677894845443
Energy: 0.25847248339262013
Energy: 0.3253995810861626
Energy: 0.32662760993107764
Energy: 0.2590779449779789
Energy: 0.3223743646974684
Energy: 0.31801569189385404
Energy: 0.3426216019044229
Energy: 0.2886469200758683
Energy: 0.2912822437158364
Energy: 0.2930751602812268
Energy: 0.2908941794022063
Energy: 0.28694544505800096
Energy: 0.36842372700918746
Energy: 0.2879176914313166
Energy: 0.28748718971925247
Energy: 0.34230782947604055
Energy: 0.2868911543098067
Energy: 0.32861186571548545
Energy: 0.33336382971075523
Energy: 0.31984693401827735
Energy: 0.32308161667950464
Energy: 0.31711407963635607
Energy: 0.3283718314480573
Energy: 0.3118607791353185
Energy: 0.2453048030154783
Energy: 0.32304458559453575
Energy: 0.3026768342895297
Energy: 0.2669681808294101
Energy: 0.32669631082701467
Energy: 0.30678967760266984

minimum gb energy = 0.23913189649991845 eV
minimum distance =  2.65871771383955 Angstroms
sigma value = 43


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

Energy: 0.22181532776662677
Energy: 0.2747607931597342
Energy: 0.2940074958489311
Energy: 0.23827508479554263
Energy: 0.30805542886740084
Energy: 0.2572581014693758
Energy: 0.3175210623398742
Energy: 0.27500412453524326
Energy: 0.27243819569972444
Energy: 0.30535297296687314
Energy: 0.2748885033172164
Energy: 0.2713117743883919
Energy: 0.33639007191076353
Energy: 0.2349395563554185
Energy: 0.2558783015917939
Energy: 0.29985837861020276
Energy: 0.23561632555718456
Energy: 0.25603254953007176
Energy: 0.29771357417496397
Energy: 0.2547840274361731
Energy: 0.25551288529908706
Energy: 0.27335332470892365
Energy: 0.26034125960380283
Energy: 0.2846833320715342
Energy: 0.23748558605325537
Energy: 0.27074468197593693
Energy: 0.2704468553495349
Energy: 0.27290370080810994
Energy: 0.27247296015595024
Energy: 0.26727983616211853
Energy: 0.2147177761612463
Energy: 0.2713540906626359
Energy: 0.2559869546105103
Energy: 0.25573307273090273
Energy: 0.2713180008462749
Energy: 0.23469002959408408
Energy: 0.2998020026256598
Energy: 0.270458081088012
Energy: 0.270146454350308
Energy: 0.25685333631522433
Energy: 0.27217532080731144
Energy: 0.26634669669582994
Energy: 0.2986065213161676
Energy: 0.22315950609124405
Energy: 0.23482700773389875
Energy: 0.2453833810399801
Energy: 0.22170662175552966
Energy: 0.2348538511718429
Energy: 0.2466172694376229
Energy: 0.2348105929133433
Energy: 0.24532012445937307
Energy: 0.24742574962390632
Energy: 0.2214459072184792
Energy: 0.24539802690652973
Energy: 0.2332321739842229
Energy: 0.22868340911166168
Energy: 0.2519259566008978
Energy: 0.24606181839099878
Energy: 0.22943731722068475
Energy: 0.23417251773361328
Energy: 0.21183950539631205
Energy: 0.22798949032235147
Energy: 0.2288064774717518
Energy: 0.2558928451480282
Energy: 0.22793818144982567
Energy: 0.22290558509930206
Energy: 0.25953790158032897
Energy: 0.22848409331736197
Energy: 0.22837896349302605
Energy: 0.22687644666070417
Energy: 0.2320404704544884
Energy: 0.260134319629518
Energy: 0.2793833988817163
Energy: 0.23916714577198053
Energy: 0.2603793697875133
Energy: 0.22259905310937875
Energy: 0.25689415920112024
Energy: 0.21850608957339354
Energy: 0.21819619746431182
Energy: 0.21766183273501125
Energy: 0.21760451449563445
Energy: 0.2191835951025802
Energy: 0.21349092322197613
Energy: 0.21750843069016723
Energy: 0.2189846111762943
Energy: 0.2138203931180915
Energy: 0.21345451101921653
Energy: 0.21836171187170442
Energy: 0.2138082259882782
Energy: 0.2606664823183601
Energy: 0.21439281518088707
Energy: 0.21251987239175668
Energy: 0.21378304808836057
Energy: 0.25253159440168377
Energy: 0.21277484972458355
Energy: 0.25006231540265333
Energy: 0.21857306970105292
Energy: 0.21253505494461417
Energy: 0.2130748286014286
Energy: 0.23954504290833106
Energy: 0.21291434827554975
Energy: 0.23412911313367918
Energy: 0.23247498710063166
Energy: 0.2129080487756941
Energy: 0.24678030670476717
Energy: 0.21296438699042694
Energy: 0.21381543120199864
Energy: 0.24795325546706282
Energy: 0.21265986123073652
Energy: 0.21329350200493277
Energy: 0.212862256457063
Energy: 0.21344715317549232
Energy: 0.2317739254014734
Energy: 0.2124744002163641
Energy: 0.21327171937012215
Energy: 0.2515106663375899
Energy: 0.2535330798672404
Energy: 0.21367462514769595
Energy: 0.2512438577844982
Energy: 0.2534638716598121
Energy: 0.2288604225600636
Energy: 0.2183053901182961
Energy: 0.21813944997606552
Energy: 0.2218950545539771
Energy: 0.21836110249424712
Energy: 0.25143981440181146
Energy: 0.21456361319188222
Energy: 0.21740771896159503
Energy: 0.2180777112066638
Energy: 0.21819586151406492
Energy: 0.21768245378229675
Energy: 0.21796844879932076
Energy: 0.22691845134574284
Energy: 0.21817415522090564
Energy: 0.21808922755675347
Energy: 0.22963145893282225
Energy: 0.21861232516607873
Energy: 0.2648390539653095
Energy: 0.22842098548602816
Energy: 0.22891125243793387
Energy: 0.2280319576389419
Energy: 0.22886187892394816
Energy: 0.21749955335278043
Energy: 0.2280609006270625
Energy: 0.2871513211050713
Energy: 0.242575013041936
Energy: 0.22882913802427826
Energy: 0.22839110680759642
Energy: 0.2415794453621495
Energy: 0.2288473417288143
Energy: 0.2871463746594046
Energy: 0.24590199586867198
Energy: 0.24567552400641132
Energy: 0.23719621363713778
Energy: 0.24816719723444725
Energy: 0.27302950194336334
Energy: 0.21323364250934335
Energy: 0.24528707247172377
Energy: 0.24582194328379497
Energy: 0.2194273954366399
Energy: 0.2453084583057955
Energy: 0.228599447100061
Energy: 0.24471051721150058
Energy: 0.24604420428909482
Energy: 0.24602877578360244
Energy: 0.2558815035644975
Energy: 0.24730257763443203
Energy: 0.24611993480187405
Energy: 0.2728771272723903
Energy: 0.24520943358300376
Energy: 0.27087242372900655
Energy: 0.2736532493250702
Energy: 0.2275434096855801
Energy: 0.2710300104357579
Energy: 0.315643490442149
Energy: 0.2281580435808727
Energy: 0.24555236298914057
Energy: 0.2675297029463343
Energy: 0.2281304156753143
Energy: 0.24580941576255286
Energy: 0.3118341912364517
Energy: 0.2742256616836658
Energy: 0.2726825250655776
Energy: 0.27755011074891156
Energy: 0.2756169985121032
Energy: 0.27062500028772307
Energy: 0.21888556115227856
Energy: 0.29920186379258296
Energy: 0.27313307445860663
Energy: 0.265738551225465
Energy: 0.30195233097220225
Energy: 0.2465699473317701
Energy: 0.24539224781546343
Energy: 0.2995042313579062
Energy: 0.29614519618944596
Energy: 0.24509678620194875
Energy: 0.3068371130546764
Energy: 0.29272145339528216
Energy: 0.3131147465649339
Energy: 0.27000498636460013
Energy: 0.26982455752512857
Energy: 0.27368779069220334
Energy: 0.2526109065378492
Energy: 0.29645629954528174
Energy: 0.3285008735501053
Energy: 0.24552523666202195
Energy: 0.2704878732348293
Energy: 0.3121309270752581
Energy: 0.24513129233688463
Energy: 0.2701996751499386
Energy: 0.317521069308484
Energy: 0.2997739928087368
Energy: 0.29586267386795034
Energy: 0.30621359468993037
Energy: 0.29737558584233714
Energy: 0.3001136336439931

minimum gb energy = 0.21183950539631205 eV
minimum distance =  2.66652290607834 Angstroms
sigma value = 81


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

Energy: 0.05279036243974285
Energy: 0.09735362380318537
Energy: 0.09537884781574149
Energy: 0.05376631877428968
Energy: 0.057259205007424326
Energy: 0.05313753674290374
Energy: 0.0708100597096523
Energy: 0.056881300836010756
Energy: 0.05643239744002237
Energy: 0.07501473607963455
Energy: 0.058116754815173706
Energy: 0.05660915417757393
Energy: 0.07457328782953351
Energy: 0.05336467941062523
Energy: 0.07683842242401173
Energy: 0.08895776291775333
Energy: 0.052957161567011204
Energy: 0.07563148594468526
Energy: 0.05693261759482346
Energy: 0.0532402883590489
Energy: 0.07622448528844036
Energy: 0.05832970824806595
Energy: 0.053197344069388385
Energy: 0.0749801607305009
Energy: 0.07564076521005945
Energy: 0.07420668382041111
Energy: 0.07423532803807774
Energy: 0.07521044960511708
Energy: 0.07430376767413877
Energy: 0.08835006682550929
Energy: 0.053050221599064175
Energy: 0.05687210237816818
Energy: 0.053854586949546514
Energy: 0.05399877336519706
Energy: 0.056566760471802334
Energy: 0.05328546758641287
Energy: 0.0744724419458436
Energy: 0.056272470063771084
Energy: 0.05633406258712089
Energy: 0.07444866577309388
Energy: 0.05694407095932851
Energy: 0.05659999015572553
Energy: 0.07461409724953089
Energy: 0.05298293479816598
Energy: 0.07669985415745552
Energy: 0.07418951794722041
Energy: 0.05291238109190983
Energy: 0.07551489405834708
Energy: 0.05677696044436993
Energy: 0.07506312661571976
Energy: 0.053785972149440454
Energy: 0.05731238263171199
Energy: 0.053291051142571245
Energy: 0.0710719934870489
Energy: 0.07707670609108444
Energy: 0.08874648749316162
Energy: 0.08869664127777202
Energy: 0.07679070671111948
Energy: 0.0882155172111031
Energy: 0.08833321459939344

minimum gb energy = 0.05279036243974285 eV
minimum distance =  2.8001949798702 Angstroms
sigma value = 3


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

Energy: 0.3923597657299961
Energy: 0.3270821117976964
Energy: 0.30428371796424064
Energy: 0.2721464036684514
Energy: 0.3467885777349023
Energy: 0.273011476792235
Energy: 0.284921383884527
Energy: 0.2845366284079342
Energy: 0.25554758978676995
Energy: 0.27621088802810945
Energy: 0.2553638163941006
Energy: 0.2791419186443326
Energy: 0.297946762537908
Energy: 0.2671371886646245
Energy: 0.2518469352664532
Energy: 0.2978554871716241
Energy: 0.23229399825893973
Energy: 0.2825657198189209
Energy: 0.2862924200660041
Energy: 0.26216770373154935
Energy: 0.2626811711125631
Energy: 0.28664703600262337
Energy: 0.253001751171199
Energy: 0.2530270891862101
Energy: 0.25251373543134875
Energy: 0.28406951802029173
Energy: 0.27996540380190893
Energy: 0.252558550027767
Energy: 0.29773987557786114
Energy: 0.2549637138967765
Energy: 0.23305604317851986
Energy: 0.2550990575638975
Energy: 0.2595674011433808
Energy: 0.23410141464886047
Energy: 0.25492228037452086
Energy: 0.2712547855963868
Energy: 0.28328457316565314
Energy: 0.2542247941100044
Energy: 0.25415272413825674
Energy: 0.2832739221341161
Energy: 0.2571358951445192
Energy: 0.2837960946690942
Energy: 0.28787577530466824
Energy: 0.23251782250520922
Energy: 0.26267757336783626
Energy: 0.288486934994447
Energy: 0.2191387977274419
Energy: 0.25899577003252344
Energy: 0.2853115405440786
Energy: 0.24931378023385548
Energy: 0.23404115608178894
Energy: 0.28727696246532086
Energy: 0.23308845215173624
Energy: 0.2338501645807314
Energy: 0.23358027729793324
Energy: 0.25483508841351804
Energy: 0.25427113100314214
Energy: 0.23366718712319906
Energy: 0.25514437370013965
Energy: 0.25421792257211084
Energy: 0.22004453182403594
Energy: 0.2207383302763544
Energy: 0.2422344599908092
Energy: 0.2188633060853029
Energy: 0.22011881437247735
Energy: 0.233134148639042
Energy: 0.23321727655481694
Energy: 0.2502487368528525
Energy: 0.2788307179844984
Energy: 0.23299404103751914
Energy: 0.22034245247117532
Energy: 0.23362296492230566
Energy: 0.23625815981851378
Energy: 0.2119069953704828
Energy: 0.23363848425714412
Energy: 0.23681873190883643
Energy: 0.21276960273374176
Energy: 0.2336984190823539
Energy: 0.2747781402053315
Energy: 0.22021802017562447
Energy: 0.26702019239441427
Energy: 0.2511803839731229
Energy: 0.2199406374515932
Energy: 0.2668262076619619
Energy: 0.21344576427860074
Energy: 0.21884067454360764
Energy: 0.21860555488957611
Energy: 0.21353730495320053
Energy: 0.2206587138397672
Energy: 0.21897169823216275
Energy: 0.21445848418676006
Energy: 0.2667473401363314
Energy: 0.26653228183203376
Energy: 0.2153135388846893
Energy: 0.2689227301205076
Energy: 0.2670202145365577
Energy: 0.2143503745064377
Energy: 0.24020838047965226
Energy: 0.21334191308576805
Energy: 0.2147763926887714
Energy: 0.2137480686352465
Energy: 0.21318681861857128
Energy: 0.212988928137933
Energy: 0.21389031037514922
Energy: 0.21389235839196571
Energy: 0.21297385967542287
Energy: 0.22143842523650525
Energy: 0.21323337235230772
Energy: 0.2938275710757857
Energy: 0.21324195794294193
Energy: 0.21389515384705376
Energy: 0.24094343860127027
Energy: 0.21306160599789192
Energy: 0.2607449434537759
Energy: 0.21349178507102534
Energy: 0.2120823815483874
Energy: 0.21189129829369518
Energy: 0.23906528062529
Energy: 0.21439336981527018
Energy: 0.21215287069079639
Energy: 0.21354161268402994
Energy: 0.21228584457836228
Energy: 0.2667129042343283
Energy: 0.2694923269320148
Energy: 0.21376050783095024
Energy: 0.26517261528572356
Energy: 0.21961384189938632
Energy: 0.21202495664861398
Energy: 0.21873679790246833
Energy: 0.22040356553589957
Energy: 0.2574671783223465
Energy: 0.21933706387516655
Energy: 0.21967648591422184
Energy: 0.2662674568247624
Energy: 0.26519719570984773
Energy: 0.21972571752509504
Energy: 0.26539343336126825
Energy: 0.2653415686862619
Energy: 0.3245368898460397
Energy: 0.23399358893936506
Energy: 0.23399820265749563
Energy: 0.22435841100586126
Energy: 0.23391433960516436
Energy: 0.23327253547880428
Energy: 0.22020863887307987
Energy: 0.23257773097316412
Energy: 0.23263536422092979
Energy: 0.22038801995099647
Energy: 0.2359491673160902
Energy: 0.2331016762728623
Energy: 0.22023625751000572
Energy: 0.22343047400152358
Energy: 0.24948525988674253
Energy: 0.22068837452935205
Energy: 0.24559316646795187
Energy: 0.26776321190666375
Energy: 0.25576770713216007
Energy: 0.27271113744235137
Energy: 0.24948994064823238
Energy: 0.2564512514774397
Energy: 0.22479992772276305
Energy: 0.2544938908715763
Energy: 0.240524862345648
Energy: 0.264223538296197
Energy: 0.2649330309482844
Energy: 0.24049010780012942
Energy: 0.2604756095091672
Energy: 0.2653660090995576
Energy: 0.22418499029475777
Energy: 0.2852045924914773
Energy: 0.2767200532112152
Energy: 0.22552731206798762
Energy: 0.28525716737878704
Energy: 0.2418748693654086
Energy: 0.25420382448850637
Energy: 0.2829374923225982
Energy: 0.2549184482182934
Energy: 0.2543520408291435
Energy: 0.28380724385413925
Energy: 0.30038552788024253
Energy: 0.2572595654884842
Energy: 0.24009737549003354
Energy: 0.26995754106060915
Energy: 0.25703644353700844
Energy: 0.2227659178592325
Energy: 0.27168649514151644
Energy: 0.2981361611922553
Energy: 0.28368863045624143
Energy: 0.24217296961449455
Energy: 0.2981307902191043
Energy: 0.24032834505366554
Energy: 0.25529344057997194
Energy: 0.26465695857195803
Energy: 0.28208360165931456
Energy: 0.28235446137306014
Energy: 0.2645159015239358
Energy: 0.2859258377992265
Energy: 0.2669847646659299

minimum gb energy = 0.21189129829369518 eV
minimum distance =  2.64324776540349 Angstroms
sigma value = 67


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

Energy: 0.38373379628033993
Energy: 0.39784471158941986
Energy: 0.3311193520594208
Energy: 0.28632992357218634
Energy: 0.41116916591906294
Energy: 0.3316613944009992
Energy: 0.3172434020177536
Energy: 0.33942197673853114
Energy: 0.26963493396041094
Energy: 0.2674437180931533
Energy: 0.3267622861399774
Energy: 0.30824926198284847
Energy: 0.33082521357510686
Energy: 0.30173267332068116
Energy: 0.289667159536541
Energy: 0.30809980760435723
Energy: 0.2972158450331784
Energy: 0.309226636778361
Energy: 0.305471516741736
Energy: 0.31777640926542317
Energy: 0.308539557368706
Energy: 0.3066486814954399
Energy: 0.2670411422828695
Energy: 0.30483243974026303
Energy: 0.2967658790666847
Energy: 0.34937526967629695
Energy: 0.3063310669345345
Energy: 0.2966375532278848
Energy: 0.32693147373814707
Energy: 0.2711734994795515
Energy: 0.36231665775040595
Energy: 0.2773167226658864
Energy: 0.31043465406086107
Energy: 0.2692203813661783
Energy: 0.27381893238408844
Energy: 0.2860159885907189
Energy: 0.3064555832524422
Energy: 0.2729145882329927
Energy: 0.2748887129415878
Energy: 0.30517348795396
Energy: 0.2709175850476305
Energy: 0.30765242799121956
Energy: 0.3071727465081674
Energy: 0.2526700969333225
Energy: 0.2619209705227444
Energy: 0.30782846945019926
Energy: 0.2505422983476506
Energy: 0.3055998016411478
Energy: 0.2805474123455834
Energy: 0.3151747239990923
Energy: 0.3202103521649408
Energy: 0.31511851860269097
Energy: 0.2679102228682193
Energy: 0.3191507959771051
Energy: 0.24913844880110345
Energy: 0.27058600393219434
Energy: 0.2675919906209565
Energy: 0.24911579223184085
Energy: 0.2686472842249153
Energy: 0.26744388397194635
Energy: 0.249632064538225
Energy: 0.3105088886895054
Energy: 0.3122146667328673
Energy: 0.24971596295516055
Energy: 0.26350494089163035
Energy: 0.31377903407718344
Energy: 0.25275800415186067
Energy: 0.30010124909665636
Energy: 0.25073273211651953
Energy: 0.2534266968916635
Energy: 0.2636947036457801
Energy: 0.24894754866507585
Energy: 0.2523401992534232
Energy: 0.25337296600276965
Energy: 0.24936106369910613
Energy: 0.2530122526990558
Energy: 0.2625377195300374
Energy: 0.24887645821962526
Energy: 0.26264350770590794
Energy: 0.25082660660559414
Energy: 0.3002456067388756
Energy: 0.26108024278183983
Energy: 0.2492914722470494
Energy: 0.2998101109465734
Energy: 0.2501438927418878
Energy: 0.2524525012837926
Energy: 0.24848500786688793
Energy: 0.2756329670939708
Energy: 0.25089904079837044
Energy: 0.24842844629138722
Energy: 0.250601281709487
Energy: 0.30663112853728003
Energy: 0.3052480885509195
Energy: 0.27816337067290436
Energy: 0.25037222719367963
Energy: 0.30956615688849853
Energy: 0.2693125226753516
Energy: 0.2478275284647351
Energy: 0.2570520667308376
Energy: 0.27020062300872205
Energy: 0.24584239350286566
Energy: 0.26786732779482897
Energy: 0.271924230893591
Energy: 0.28099238760898787
Energy: 0.28233286227253956
Energy: 0.27225792838875196
Energy: 0.2818729310086475
Energy: 0.26843505993973227
Energy: 0.3387529962482509
Energy: 0.28382467164751385
Energy: 0.2878163247872832
Energy: 0.2551215713536493
Energy: 0.28302853478963597
Energy: 0.28832101839508334
Energy: 0.26823905427093253
Energy: 0.30694518900100587
Energy: 0.308565668220691
Energy: 0.2681523782793378
Energy: 0.30516958840539304
Energy: 0.30882114454844595
Energy: 0.3005792941333922
Energy: 0.3033267277250345
Energy: 0.3250035812897999
Energy: 0.3014966183296218
Energy: 0.2545064302266456
Energy: 0.2856710760479772
Energy: 0.3303946502059839
Energy: 0.25722746311840006
Energy: 0.3483551667258769
Energy: 0.30754649812956986
Energy: 0.29725044494832586
Energy: 0.31971662313914656
Energy: 0.31711240199747187
Energy: 0.3077497077456831
Energy: 0.31103771936212404
Energy: 0.3168248863605035
Energy: 0.3058374224107611
Energy: 0.2972284334089203

minimum gb energy = 0.24584239350286566 eV
minimum distance =  2.63785289564105 Angstroms
sigma value = 33


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

Energy: 0.43558623825038656
Energy: 0.28213400889788914
Energy: 0.28294856784440137
Energy: 0.3332040508809967
Energy: 0.4397306975421244
Energy: 0.3326560550196728
Energy: 0.3307957573000971
Energy: 0.3045964767558734
Energy: 0.3052566081025622
Energy: 0.33155865873796625
Energy: 0.33308611240801106
Energy: 0.30387664629002203
Energy: 0.3330629984384249
Energy: 0.30537003698378495
Energy: 0.33223629109499997
Energy: 0.33303806346318077
Energy: 0.2684768738120086
Energy: 0.26940313708764957
Energy: 0.3040223799953594
Energy: 0.3144936964470897
Energy: 0.30657685030330795
Energy: 0.30293405085966885
Energy: 0.30300648644422346
Energy: 0.3045524908196655
Energy: 0.300263695524349
Energy: 0.30638503294670444
Energy: 0.30711873294281655
Energy: 0.30031814074149543
Energy: 0.3323146020969982
Energy: 0.30541371678725954
Energy: 0.26767168959890125
Energy: 0.2705998700350046
Energy: 0.271422712358204
Energy: 0.27081456960454287
Energy: 0.3114277889862919
Energy: 0.3087464201597966
Energy: 0.30605737441393505
Energy: 0.3054039202376714
Energy: 0.3062765605074007
Energy: 0.3058803487330254
Energy: 0.30190762990161896
Energy: 0.2934757646520539
Energy: 0.3058524986780736
Energy: 0.2689044940100612
Energy: 0.26954512129167285
Energy: 0.3057139146375709
Energy: 0.2849275461103517
Energy: 0.29173366236465054
Energy: 0.3009390896050106
Energy: 0.2696308657731415
Energy: 0.3271523492648881
Energy: 0.32286110120019296
Energy: 0.26822187891851806
Energy: 0.32728502620475
Energy: 0.26925087917464957
Energy: 0.2715346416133265
Energy: 0.2682622989222564
Energy: 0.2714812277067271
Energy: 0.2698151382629013
Energy: 0.26803492491670156
Energy: 0.2858952223643177
Energy: 0.26931854039539566
Energy: 0.27542388903858994
Energy: 0.2828659654363459
Energy: 0.26918721592871686
Energy: 0.3203627302811958
Energy: 0.2705541977857716
Energy: 0.2704572057079422
Energy: 0.2682973375307321
Energy: 0.2712048005970873
Energy: 0.26605464809994134
Energy: 0.26936974298621974
Energy: 0.2706848775288282
Energy: 0.2697839332986758
Energy: 0.26806982994355266
Energy: 0.2684167657086591
Energy: 0.28670017757355987
Energy: 0.2688957237121616
Energy: 0.2599288670312372
Energy: 0.2876467154440973
Energy: 0.3220641447456081
Energy: 0.2614844680279944
Energy: 0.28795675029231604
Energy: 0.282507352423461
Energy: 0.25973120749335676
Energy: 0.3055864449177429
Energy: 0.3018808781766911
Energy: 0.2595331031120456
Energy: 0.3028122167800802
Energy: 0.3051556549669904
Energy: 0.2996117140585479
Energy: 0.32646883362111007
Energy: 0.3266833474999745
Energy: 0.3004988172497343
Energy: 0.2759377508960815
Energy: 0.30538166422727564
Energy: 0.33255505164891114
Energy: 0.2762357863200464
Energy: 0.2759437806286399
Energy: 0.3326545988345303
Energy: 0.28120425404369315
Energy: 0.27854705911628785
Energy: 0.33158085650975666
Energy: 0.30391778700655303
Energy: 0.3038653973201475
Energy: 0.3319206511738741
Energy: 0.3037819713807674
Energy: 0.30538393430493266
Energy: 0.43528466723891607
Energy: 0.30569805978982195
Energy: 0.3173267208131023
Energy: 0.28065148033657356
Energy: 0.30548734903279995
Energy: 0.3339963310328056
Energy: 0.32529662411996285
Energy: 0.30662811141761853
Energy: 0.3063693197336728
Energy: 0.32541280912310566
Energy: 0.33176834597700594
Energy: 0.30702975579760533
Energy: 0.3329758627370389
Energy: 0.28694504330969944
Energy: 0.2869617421834171
Energy: 0.3329477247107277
Energy: 0.2925896089363248
Energy: 0.30505852436849995
Energy: 0.30191438085616196
Energy: 0.3057600152464394
Energy: 0.30734482096344456
Energy: 0.30320139974404997
Energy: 0.2835954112575278
Energy: 0.2992515695794243
Energy: 0.30068194831174366
Energy: 0.34636455666182003
Energy: 0.30502077422139584
Energy: 0.30080248824296124
Energy: 0.33198263556763274
Energy: 0.30569779348326265
Energy: 0.3984036986971355
Energy: 0.32201474855050627
Energy: 0.32266324017860715
Energy: 0.30884903759793414
Energy: 0.3738450687514208
Energy: 0.30848458768874554
Energy: 0.3052574419759842
Energy: 0.3057901712940401
Energy: 0.30682351457533963
Energy: 0.30522195857670387
Energy: 0.3008948552058493
Energy: 0.29253788068123115
Energy: 0.3056265282446238
Energy: 0.2689492474418557
Energy: 0.26923348395611757
Energy: 0.30555539524420744
Energy: 0.2830060913099538
Energy: 0.29150794826564036
Energy: 0.31961262760521353
Energy: 0.3132903554495585
Energy: 0.3003217916706769
Energy: 0.3235087509623492
Energy: 0.2695182260675694
Energy: 0.32868446761441006
Energy: 0.26985905015796713
Energy: 0.26967695730467073
Energy: 0.2680508904652577
Energy: 0.296425089901044
Energy: 0.26921064398612754
Energy: 0.268169909115913
Energy: 0.26926126469502537
Energy: 0.26905547354486037
Energy: 0.26932951465125127
Energy: 0.2833636144338898
Energy: 0.2690094812555863
Energy: 0.26976538859128696
Energy: 0.272296640997646
Energy: 0.26992833776639585
Energy: 0.2690786399602397
Energy: 0.2693438405536395
Energy: 0.26674287037973393
Energy: 0.2697589095464609
Energy: 0.26940158365098466
Energy: 0.2740637546965246
Energy: 0.2682005820117698
Energy: 0.2698355813077922
Energy: 0.27213453053668174
Energy: 0.2682200896378945
Energy: 0.25954607566780524
Energy: 0.27539696990876333
Energy: 0.27835905604982064
Energy: 0.2614232740205267
Energy: 0.2862497707193787
Energy: 0.27938279535361615
Energy: 0.25939636957588247
Energy: 0.3048368912612793
Energy: 0.3019641397156752
Energy: 0.2593053146492716
Energy: 0.3039908086164711
Energy: 0.288844061141411
Energy: 0.2986312549291835
Energy: 0.27634534932844734
Energy: 0.305745001936113
Energy: 0.299586472165205
Energy: 0.27573470652934484
Energy: 0.305740804765003
Energy: 0.34556515025690215
Energy: 0.2760033270775877
Energy: 0.27604531940745575
Energy: 0.34481989967315807
Energy: 0.26247211929791375
Energy: 0.30869460021477846
Energy: 0.3315065210277577
Energy: 0.3053459324013632
Energy: 0.303787527606187
Energy: 0.3320096712867213
Energy: 0.30506494865597933
Energy: 0.2927144133532788
Energy: 0.27627449042226365
Energy: 0.30503794229892506
Energy: 0.28030475898711305
Energy: 0.27897612875315886
Energy: 0.3045469232577015
Energy: 0.27791299550623655

minimum gb energy = 0.2593053146492716 eV
minimum distance =  2.64212848485995 Angstroms
sigma value = 41


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

Energy: 0.4004122261932816
Energy: 0.3874096064218321
Energy: 0.38783166187398144
Energy: 0.4004982140554776
Energy: 0.47545388856756443
Energy: 0.3408066690312804
Energy: 0.31871931606401577
Energy: 0.30387166215296674
Energy: 0.3050312267125781
Energy: 0.3083651152952628
Energy: 0.36222284536040705
Energy: 0.2998826316256153
Energy: 0.363838504523767
Energy: 0.2973585788739176
Energy: 0.29290115304253606
Energy: 0.36430094658783313
Energy: 0.3033166355937079
Energy: 0.30393684732366827
Energy: 0.3460867406294249
Energy: 0.2997755012937284
Energy: 0.3119809159347638
Energy: 0.3457542423470094
Energy: 0.2980575068734368
Energy: 0.30562185070326037
Energy: 0.3023604887254189
Energy: 0.3636265505304769
Energy: 0.34714258734890285
Energy: 0.3017263959676245
Energy: 0.3427882660521148
Energy: 0.294107749818683
Energy: 0.368572078222641
Energy: 0.35563547724966277
Energy: 0.3085030345409456
Energy: 0.31210471166153614
Energy: 0.353431776139068
Energy: 0.2939601483845367
Energy: 0.30119448999080367
Energy: 0.30118498515162173
Energy: 0.29574754132488423
Energy: 0.3012141816978718
Energy: 0.3126559985300589
Energy: 0.29507298951100436
Energy: 0.30360350548227905
Energy: 0.29437459330212723
Energy: 0.2993075797472241
Energy: 0.30423377051828254
Energy: 0.2944753714613663
Energy: 0.3038150713110269
Energy: 0.3409322788933426
Energy: 0.30072422065958176
Energy: 0.30010519446823747
Energy: 0.3418090361018358
Energy: 0.3206204241107538
Energy: 0.31345530192670185
Energy: 0.31888272504063503
Energy: 0.3070207171222756
Energy: 0.3044910152422613
Energy: 0.3009559288283411
Energy: 0.3049129472624391
Energy: 0.2942130216364324
Energy: 0.3131546314055522
Energy: 0.3029106624589557
Energy: 0.2994024739343537
Energy: 0.3132001541662227
Energy: 0.2837882364363458
Energy: 0.3124398346354465
Energy: 0.3589242780531617
Energy: 0.32710348925873634
Energy: 0.32497207566637054
Energy: 0.3595897372074843
Energy: 0.284264658310914
Energy: 0.32529506414932996
Energy: 0.34126716341592545
Energy: 0.3029057059381468
Energy: 0.312407467407248
Energy: 0.3081179083945821
Energy: 0.3032263579002522
Energy: 0.30010168709591833
Energy: 0.28441929780608183
Energy: 0.3046223904808228
Energy: 0.28452605131865144
Energy: 0.28462127868769077
Energy: 0.34751951967299627
Energy: 0.2836260458820765

minimum gb energy = 0.2836260458820765 eV
minimum distance =  2.65967582956293 Angstroms
sigma value = 11


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

Energy: 0.5074451104588701
Energy: 0.40577895427504107
Energy: 0.3712176616853438
Energy: 0.35450367686209094
Energy: 0.32163142042065135
Energy: 0.3758866205161404
Energy: 0.36351390282315915
Energy: 0.32304585471378733
Energy: 0.3226051473788595
Energy: 0.34437034916948867
Energy: 0.32810517313881016
Energy: 0.3354574489920691
Energy: 0.3832566552585126
Energy: 0.34289707015162035
Energy: 0.34461719447196076
Energy: 0.3650427153133875
Energy: 0.34027869003591227
Energy: 0.3400411235108276
Energy: 0.34985309927941977
Energy: 0.3514862938755758
Energy: 0.34507466351032756
Energy: 0.3508714709237946
Energy: 0.33968057295664916
Energy: 0.33303702216166886
Energy: 0.35313659300803363
Energy: 0.3267878543896597
Energy: 0.32170036490902165
Energy: 0.34568258083699327
Energy: 0.32708039779485726
Energy: 0.3224284033829169
Energy: 0.35028408609827466
Energy: 0.3272587279166103
Energy: 0.327651108287437
Energy: 0.3462922116759651
Energy: 0.32750074630464143
Energy: 0.32771761802714733
Energy: 0.32788796678620025
Energy: 0.32824827586219746
Energy: 0.327488820104531
Energy: 0.3277555372547201
Energy: 0.32452744706006775
Energy: 0.3276404256409734
Energy: 0.32715036493664756
Energy: 0.3369549014079433
Energy: 0.33961658589240573
Energy: 0.32725834689449695
Energy: 0.35482530089004993
Energy: 0.3222108306827273
Energy: 0.3190726978291243
Energy: 0.3333208346746284
Energy: 0.3332515906064863
Energy: 0.3313259869657449
Energy: 0.3333666363870604
Energy: 0.33161487969562303
Energy: 0.3191629917395549
Energy: 0.33444737712192846
Energy: 0.3341468077146837
Energy: 0.33105226285957967
Energy: 0.3368058305767695
Energy: 0.3188213180144417
Energy: 0.32739328695185077
Energy: 0.33187704165222875
Energy: 0.339664138209714
Energy: 0.32681994500623546
Energy: 0.3287789566515162
Energy: 0.3224283245176307
Energy: 0.3242379189454298
Energy: 0.3299225392404827
Energy: 0.35489330131860236
Energy: 0.32479188346496646
Energy: 0.35635231730673117
Energy: 0.3535548211100094
Energy: 0.32254909001273613
Energy: 0.3459488512503979
Energy: 0.33762130712676636
Energy: 0.3234577541636032
Energy: 0.3455281444462304
Energy: 0.3350177225241351
Energy: 0.331305426227233
Energy: 0.3607368462831901
Energy: 0.35775241207899194
Energy: 0.33890777451946985
Energy: 0.3907640588284989
Energy: 0.35453282241126743
Energy: 0.31910274403640126
Energy: 0.32686035546539743
Energy: 0.3275661001311607
Energy: 0.3190674807738374
Energy: 0.33304137613822643
Energy: 0.3296477383155311
Energy: 0.3190148883694281
Energy: 0.3356592692500446
Energy: 0.33029391631789506
Energy: 0.3189603027294838
Energy: 0.3339238214040195
Energy: 0.31763520387038013
Energy: 0.31784085465944195
Energy: 0.3440997707104075
Energy: 0.3317778492878725
Energy: 0.3179458263230205
Energy: 0.3430438782571892
Energy: 0.3190101043819909
Energy: 0.4005443956563973
Energy: 0.3522206093158306
Energy: 0.33408104177942544
Energy: 0.3378902948576786
Energy: 0.35356859634396226
Energy: 0.33747098511145207
Energy: 0.3304470884776951
Energy: 0.32418028064237076
Energy: 0.32606719856590216
Energy: 0.33065502894183485
Energy: 0.3501123527429391
Energy: 0.3230004630088136
Energy: 0.3341861683773889
Energy: 0.3452126241537589
Energy: 0.34370090214851373
Energy: 0.3349045096778345
Energy: 0.3435788620488153
Energy: 0.3272908797950819
Energy: 0.3479888825121003
Energy: 0.3456404773923425
Energy: 0.3411112002269661
Energy: 0.34810354332285287
Energy: 0.3501931341477118
Energy: 0.326061568026709
Energy: 0.32730598146713896
Energy: 0.33139752801871797
Energy: 0.3225135932135721
Energy: 0.3224764474300513
Energy: 0.34845792817515053
Energy: 0.3224681667579112
Energy: 0.348324993346081
Energy: 0.3228989213714361
Energy: 0.3362339832347296
Energy: 0.3384922034311877
Energy: 0.33564293973280873
Energy: 0.3382999577167058
Energy: 0.35021188053337377
Energy: 0.3299111341662628
Energy: 0.3472883857521408
Energy: 0.3502488678232394
Energy: 0.33058267156904714
Energy: 0.3258956324066594
Energy: 0.3531572727869611
Energy: 0.33722825655423083
Energy: 0.344041888645786
Energy: 0.35289451636061087
Energy: 0.3274869987265315
Energy: 0.3514749548454637
Energy: 0.35921890369977155
Energy: 0.31843332741116026
Energy: 0.3189749526066787
Energy: 0.34141056066608555
Energy: 0.31817564015424576
Energy: 0.35317242165713364
Energy: 0.35789376013543345
Energy: 0.3178003891676011
Energy: 0.31762738696706494
Energy: 0.33485054120022617
Energy: 0.31940028475452503
Energy: 0.3182295526219742
Energy: 0.35872953714505945
Energy: 0.3186624099411798
Energy: 0.34306731482425606
Energy: 0.35037910360894475
Energy: 0.3200302929836495
Energy: 0.3376133192251351
Energy: 0.3890799477394194
Energy: 0.3503519025246706
Energy: 0.3523890219303055
Energy: 0.38963738861589764
Energy: 0.3239028054167067
Energy: 0.3567543533531169
Energy: 0.39045572586382227
Energy: 0.3224271822130002
Energy: 0.32264231577990965
Energy: 0.359799382583201
Energy: 0.3228589491817932
Energy: 0.3374708814226059
Energy: 0.3202592341303205
Energy: 0.32297977779988896
Energy: 0.3492722744384393
Energy: 0.34619278308140744
Energy: 0.3248282646894518
Energy: 0.31625468110251503

minimum gb energy = 0.31625468110251503 eV
minimum distance =  2.62438556432807 Angstroms
sigma value = 57


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

Energy: 0.455143113056643
Energy: 0.3677011109058109
Energy: 0.36491252999955603
Energy: 0.3645616977341697
Energy: 0.49692004645418475
Energy: 0.36512119590003816
Energy: 0.2978095557153165
Energy: 0.3101675464374154
Energy: 0.31065924727512984
Energy: 0.3101578974455755
Energy: 0.3118691109153126
Energy: 0.3112687946553407
Energy: 0.3365831448578652
Energy: 0.3287651115626635
Energy: 0.3292193254358882
Energy: 0.33744375282502215
Energy: 0.30997592487395004
Energy: 0.3106986139468533
Energy: 0.3098034873505051
Energy: 0.3143811158576944
Energy: 0.31068456923816695
Energy: 0.3105113991321551
Energy: 0.31916924943884484
Energy: 0.3204972956623224
Energy: 0.32158171392804735
Energy: 0.31289143238402745
Energy: 0.31005448778337386
Energy: 0.320296722000477
Energy: 0.31185843631762306
Energy: 0.31051801835731785
Energy: 0.3203717747592689
Energy: 0.33705151725859867
Energy: 0.3222157097451551
Energy: 0.3108673824157639
Energy: 0.33628005599571414
Energy: 0.33725835485333183
Energy: 0.33644609913008655
Energy: 0.3244067584065569
Energy: 0.32259801719766246
Energy: 0.3371712123742119
Energy: 0.3261794818006571
Energy: 0.3355567916641753
Energy: 0.34066012659113243
Energy: 0.3120769153010747
Energy: 0.3107423264937699
Energy: 0.3114054428953378
Energy: 0.3215033455712981
Energy: 0.31162695552879244
Energy: 0.29810225624659886
Energy: 0.31327133414577707
Energy: 0.3184467404989778
Energy: 0.3046050558064381
Energy: 0.31150207141737735
Energy: 0.31790548676321695
Energy: 0.298195490593245
Energy: 0.31206259817037146
Energy: 0.3179126950338804
Energy: 0.29886455369199066
Energy: 0.33622419604686155
Energy: 0.3180451304956943
Energy: 0.34032940352818225
Energy: 0.3126965058230573
Energy: 0.3120850941084836
Energy: 0.31136472338553584
Energy: 0.32135938590511165
Energy: 0.3117322094957048
Energy: 0.3329246180728333
Energy: 0.35298029576285517
Energy: 0.35153036705301643
Energy: 0.3334083965237321
Energy: 0.3272931764567764
Energy: 0.33150653755743337
Energy: 0.3109768228853105
Energy: 0.31065861710956333
Energy: 0.3111373552356424
Energy: 0.3109076267493481
Energy: 0.31134958826673087
Energy: 0.34279952913198275
Energy: 0.38852242542734156
Energy: 0.33865573221904166
Energy: 0.33569989911528425
Energy: 0.312743462878689
Energy: 0.3360280538528514
Energy: 0.33565767435799815
Energy: 0.32174734928261284
Energy: 0.32088267430198447
Energy: 0.31127871197906887
Energy: 0.3218836432870426
Energy: 0.31818685935912305
Energy: 0.33149129081222556
Energy: 0.3372058223990709
Energy: 0.3210763448165172
Energy: 0.3271071853591934
Energy: 0.3379968823637849
Energy: 0.3184000163531456
Energy: 0.3109633903527254
Energy: 0.29791721527114007
Energy: 0.3105693012243012
Energy: 0.31093596186382033
Energy: 0.29783173534255536
Energy: 0.31254866799002634
Energy: 0.3109295545581682

minimum gb energy = 0.2978095557153165 eV
minimum distance =  2.66551767000577 Angstroms
sigma value = 9


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

Energy: 0.5584242325776166
Energy: 0.42781864460376506
Energy: 0.39374322616613144
Energy: 0.37748032019858907
Energy: 0.5565061459681032
Energy: 0.377416828014893
Energy: 0.34381702557376687
Energy: 0.33367344760032863
Energy: 0.33444723469215865
Energy: 0.3670210655781189
Energy: 0.3457839901332036
Energy: 0.3287820178218322
Energy: 0.3685214303581265
Energy: 0.3568877979993435
Energy: 0.3464080760971756
Energy: 0.36894969519993565
Energy: 0.3588600227554523
Energy: 0.33663362941594965
Energy: 0.3367929553363901
Energy: 0.3420616714972887
Energy: 0.3454624111198485
Energy: 0.3287440984611503
Energy: 0.3399603326685145
Energy: 0.33968139825954846
Energy: 0.3554127464189098
Energy: 0.3418501986201779
Energy: 0.33882131454882874
Energy: 0.3558174564564749
Energy: 0.34199890474894323
Energy: 0.32263018388853293
Energy: 0.3378148114270022
Energy: 0.3262510727454124
Energy: 0.3394198525403593
Energy: 0.338509147005744
Energy: 0.33269650805304524
Energy: 0.3463678483488846
Energy: 0.32694338193651606
Energy: 0.3516351230243064
Energy: 0.34363130473646764
Energy: 0.32722835188274985
Energy: 0.34582984625923846
Energy: 0.3481155403069253
Energy: 0.33905819385865915
Energy: 0.349951681784476
Energy: 0.3480621036164608
Energy: 0.34931097340452005
Energy: 0.32286133460870137
Energy: 0.32634938215408416
Energy: 0.3395673904591181
Energy: 0.3434020387458729
Energy: 0.3392923295480843
Energy: 0.3508921914914407
Energy: 0.3418101318281213
Energy: 0.34581130596204157
Energy: 0.3394897062951701
Energy: 0.3288626914712235
Energy: 0.3318059568281993
Energy: 0.35549891484634616
Energy: 0.3274694256844123
Energy: 0.3263568385367162
Energy: 0.3434152000594244
Energy: 0.3392939863747418
Energy: 0.33887174677499154
Energy: 0.34910882991861136
Energy: 0.3475741579847038
Energy: 0.3261625184053304
Energy: 0.3428352544107211
Energy: 0.3601917044024958
Energy: 0.3292519649952084
Energy: 0.3433930082758015
Energy: 0.3555601893921359
Energy: 0.33319852771092306
Energy: 0.42242345129350917
Energy: 0.3316194563302373
Energy: 0.3292764981392508
Energy: 0.34767377970111957
Energy: 0.33133871390381203
Energy: 0.3513049392880036
Energy: 0.3453782120011831
Energy: 0.3432191824809432
Energy: 0.34557938144199934
Energy: 0.3338860858851274
Energy: 0.3469293535801032
Energy: 0.3395635318647463
Energy: 0.33945346184611414
Energy: 0.3409978126237725
Energy: 0.3417460443833949
Energy: 0.3400831914118678
Energy: 0.35135355560250975
Energy: 0.3333138136264958
Energy: 0.33384092411883387
Energy: 0.32591435729425733
Energy: 0.3327998136438155
Energy: 0.3343540211317971
Energy: 0.3432065310139338
Energy: 0.334664618142378
Energy: 0.3334374412594235
Energy: 0.3463403479217557
Energy: 0.34664100225810085
Energy: 0.3334004947486487
Energy: 0.3439702664358322
Energy: 0.3431248895437914
Energy: 0.39229647269404194
Energy: 0.3376695141840994
Energy: 0.33440404962964826
Energy: 0.35562894730362626
Energy: 0.3364107150701333
Energy: 0.3301618403084515
Energy: 0.3333619545603829
Energy: 0.3418382060970108
Energy: 0.35266808337381456
Energy: 0.33334419788096825
Energy: 0.3613588588767253
Energy: 0.339975477390816
Energy: 0.35863368485995134
Energy: 0.3414733774660738
Energy: 0.3288602988049741
Energy: 0.359053407423455
Energy: 0.3573053462354908
Energy: 0.34733603945729297
Energy: 0.3351305659129368
Energy: 0.33783501743414485
Energy: 0.33339900313641596
Energy: 0.32239076882934936
Energy: 0.3360492811711835
Energy: 0.3334804214535818

minimum gb energy = 0.32239076882934936 eV
minimum distance =  2.64609278971067 Angstroms
sigma value = 27


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

Energy: 0.35882488969571436
Energy: 0.3195893004789802
Energy: 0.29364958457507206
Energy: 0.31842937378340624
Energy: 0.48413973525085946
Energy: 0.31842981141358967
Energy: 0.3218871046449581
Energy: 0.31712298512800824
Energy: 0.31661128735708016
Energy: 0.33274727022838274
Energy: 0.3191368788642892
Energy: 0.3274553167399665
Energy: 0.36746067404486243
Energy: 0.3488972584283607
Energy: 0.32938485176544374
Energy: 0.35188138144973974
Energy: 0.33577451268986774
Energy: 0.3605441639436542
Energy: 0.3535736314671845
Energy: 0.33037329787216935
Energy: 0.3458386923486297
Energy: 0.3185201385788161
Energy: 0.3400044088436475
Energy: 0.31973728610273605
Energy: 0.34325324723034567
Energy: 0.323488830748124
Energy: 0.32348959751426987
Energy: 0.3442683470980467
Energy: 0.3258544970621848
Energy: 0.3155089675360711
Energy: 0.365447912879136
Energy: 0.3307955570242834
Energy: 0.3469205991655634
Energy: 0.3554579908714408
Energy: 0.3519712099753266
Energy: 0.3445438780364845
Energy: 0.35261406844744847
Energy: 0.32218736451972896
Energy: 0.29371905296423123
Energy: 0.33566689063092475
Energy: 0.3204024137632619
Energy: 0.2936472413780946
Energy: 0.34777470851420744
Energy: 0.2928385630877466
Energy: 0.34555940129794416
Energy: 0.3419522509149088
Energy: 0.2928514587267194
Energy: 0.34198259238126005
Energy: 0.36153147158588955
Energy: 0.3649466233142442
Energy: 0.3652034608284706
Energy: 0.34719526591936484
Energy: 0.36361046930094326
Energy: 0.36522154142826707
Energy: 0.40496220402941174
Energy: 0.35930636770720076
Energy: 0.3623828544497275
Energy: 0.34905091198303145
Energy: 0.3580695573063391
Energy: 0.36450877312835533
Energy: 0.3478291510429338
Energy: 0.34872297736165225
Energy: 0.3459380576748343
Energy: 0.34857958967707825
Energy: 0.3219388008353838
Energy: 0.34184440908966685
Energy: 0.3589819074262178
Energy: 0.36263896416075536
Energy: 0.35135539517767966
Energy: 0.3540326584681732
Energy: 0.35865102276526256
Energy: 0.3512960352671212
Energy: 0.3211535087799369
Energy: 0.3469147919457622
Energy: 0.29370113085360994
Energy: 0.32237585290739235
Energy: 0.347096964935158
Energy: 0.2942391418886991
Energy: 0.2930034540215328
Energy: 0.3479575760142029
Energy: 0.3466521114302224
Energy: 0.29296595342024656
Energy: 0.34744755190047755
Energy: 0.33220503293225057
Energy: 0.36351801303313547
Energy: 0.3675366083913693
Energy: 0.3651612774858919
Energy: 0.36388090357866676
Energy: 0.34354356666723235
Energy: 0.36426211359319793
Energy: 0.3629047635281991
Energy: 0.34664108714541236
Energy: 0.36190272966220693
Energy: 0.3536470016029643
Energy: 0.34765660511194596
Energy: 0.36100183827364446
Energy: 0.3213160108015171
Energy: 0.346894240479194
Energy: 0.34450890913158827
Energy: 0.321361986313926
Energy: 0.3482894559458476
Energy: 0.35011392894451354
Energy: 0.364678596416618
Energy: 0.35036334408551284
Energy: 0.3457540231193481
Energy: 0.35389603261567654
Energy: 0.35076514805558634
Energy: 0.345615716366495
Energy: 0.34589506801317255
Energy: 0.3308563416171351
Energy: 0.3340044083573064
Energy: 0.34506859714499455
Energy: 0.3284935794559414
Energy: 0.2938515865900055
Energy: 0.35443335900164635
Energy: 0.3307100574638304
Energy: 0.3338874798487242
Energy: 0.3395155191927736
Energy: 0.32841420732656995
Energy: 0.29353431298105337
Energy: 0.352896152575374
Energy: 0.33603310313230716
Energy: 0.34680192722252073
Energy: 0.33544896594786194
Energy: 0.33450687143073266
Energy: 0.3480422616751657
Energy: 0.33407589743498606
Energy: 0.33667790671353515
Energy: 0.34381264686086105
Energy: 0.33520967202488616
Energy: 0.3396133493909495
Energy: 0.31751848369802027
Energy: 0.3541588211856268
Energy: 0.3306860011433726
Energy: 0.3469778497094704
Energy: 0.3237929724958152
Energy: 0.34842458931841236
Energy: 0.3454532488354566
Energy: 0.3543366755157406
Energy: 0.3559142701686547
Energy: 0.32009628101076126
Energy: 0.3250034728318887
Energy: 0.34461951261967994
Energy: 0.320984076003521
Energy: 0.33968631942175775
Energy: 0.31708167946074145
Energy: 0.3170699408689887
Energy: 0.2928288634157728
Energy: 0.31824889954248226
Energy: 0.3174145964528781

minimum gb energy = 0.2928288634157728 eV
minimum distance =  2.65752785262435 Angstroms
sigma value = 19


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

Energy: 0.35200194838464954
Energy: 0.32067862659856766
Energy: 0.3221343535424441
Energy: 0.3417845541164774
Energy: 0.33729681232721626
Energy: 0.3185572197129324
Energy: 0.32761622997419243
Energy: 0.33859746749413716
Energy: 0.3369634196426161
Energy: 0.33253300544242925
Energy: 0.33706885868588643
Energy: 0.3324204711621889
Energy: 0.33427622438810267
Energy: 0.34890500093203985
Energy: 0.3281877858726677
Energy: 0.33450275568042753
Energy: 0.33781215955617083
Energy: 0.33047574108340666
Energy: 0.33239974568464387
Energy: 0.33026254681158645
Energy: 0.3303768707816539
Energy: 0.33231731000637854
Energy: 0.334284119600198
Energy: 0.3303467600481226
Energy: 0.3442705681378633
Energy: 0.33336577553424424
Energy: 0.3308517394060005
Energy: 0.34519479097767597
Energy: 0.33552401135956855
Energy: 0.3311668466180384
Energy: 0.3319906185752703
Energy: 0.32892980165491226
Energy: 0.3437614810926297
Energy: 0.3325990565221553
Energy: 0.33226524739696695
Energy: 0.33010979266703505
Energy: 0.32154463907290276
Energy: 0.3447336408659979
Energy: 0.3261411362121937
Energy: 0.3218056021933571
Energy: 0.3431162328787051
Energy: 0.32611900714325626
Energy: 0.3429563399946995
Energy: 0.35255666835354976
Energy: 0.3558558561762265
Energy: 0.34329135112360754
Energy: 0.3585775808562464
Energy: 0.3449131333558762
Energy: 0.3387361998159744
Energy: 0.3368123003982574
Energy: 0.3377415170333432
Energy: 0.3396006865081638
Energy: 0.3306851946159667
Energy: 0.3271991713785382
Energy: 0.3374059486286628
Energy: 0.3404786708496431
Energy: 0.32666212928829813
Energy: 0.3208447817846132
Energy: 0.3380203532542865
Energy: 0.32635837999527145
Energy: 0.361472684183086
Energy: 0.32811572293253416
Energy: 0.32342807407696494
Energy: 0.3620771045674928
Energy: 0.3285226665180745
Energy: 0.35873521893559074
Energy: 0.32620701275938047
Energy: 0.33375001581616276
Energy: 0.34268148892403927
Energy: 0.3263468201069677
Energy: 0.33698037165528966
Energy: 0.32041377164192003
Energy: 0.3498022288718717
Energy: 0.31373722992527675
Energy: 0.32717092786199
Energy: 0.3393483940996402
Energy: 0.3378935752530427
Energy: 0.3271045617309256
Energy: 0.33877214433229696
Energy: 0.326265752472397
Energy: 0.3261055065493725
Energy: 0.3338130861387822
Energy: 0.329982147305809
Energy: 0.3292975935329982
Energy: 0.3265079894790294
Energy: 0.3253477051635189
Energy: 0.3342461958741051
Energy: 0.3266742395897714
Energy: 0.3250957885983895
Energy: 0.32568126741539966
Energy: 0.3260519496510304
Energy: 0.33743637269557225
Energy: 0.34017377431284745
Energy: 0.3262548257096625
Energy: 0.3266958247192642
Energy: 0.3189381625331525
Energy: 0.3277808428748321
Energy: 0.32658466876813314
Energy: 0.33298936962927883
Energy: 0.32681008721240123
Energy: 0.32629896595746877
Energy: 0.3337536423778944
Energy: 0.3338421758553933
Energy: 0.3269889267130357
Energy: 0.32355756440018985
Energy: 0.33437955418592336
Energy: 0.3416686330970066
Energy: 0.3186503056585804
Energy: 0.3538909787180253
Energy: 0.3428743917770442
Energy: 0.3424257660156559
Energy: 0.3545272059263054
Energy: 0.33681103443013904
Energy: 0.3225014016581984
Energy: 0.34147041234870457
Energy: 0.34762079830764947
Energy: 0.3415835358622941
Energy: 0.34112409954894557
Energy: 0.3373459808075987
Energy: 0.3185434686923502
Energy: 0.32657387560172674
Energy: 0.3269945667965625
Energy: 0.3238812266133325
Energy: 0.3261764075687361
Energy: 0.3265313629247952
Energy: 0.3188255379911654
Energy: 0.32794809799388175
Energy: 0.3275721702100565
Energy: 0.3246388865419863
Energy: 0.32836794813138387
Energy: 0.32639782475256185
Energy: 0.3453395774439973
Energy: 0.3333248678816272
Energy: 0.3571434073924675
Energy: 0.3351180108445408
Energy: 0.33358154054704114
Energy: 0.3584996574587965
Energy: 0.319273207313382
Energy: 0.342826956879069
Energy: 0.32159158476820227
Energy: 0.3392963558044776
Energy: 0.3429465781794328
Energy: 0.32093563299223604
Energy: 0.3311845248788682
Energy: 0.33727161294068564
Energy: 0.34452339108477487
Energy: 0.32712010141539766
Energy: 0.3378548797837527
Energy: 0.34490566873078404
Energy: 0.3199812412360417
Energy: 0.338477879601356
Energy: 0.3300285817891448
Energy: 0.32702451687031864
Energy: 0.3363641330902144
Energy: 0.3298671736406439
Energy: 0.32736246885089815
Energy: 0.33521432368358034
Energy: 0.3460922307029485
Energy: 0.32635685174985113
Energy: 0.3356106504807576
Energy: 0.3397791397010015
Energy: 0.32656799887032906
Energy: 0.3340402848681071
Energy: 0.33935468894058335
Energy: 0.344878610040422
Energy: 0.33523588234406104
Energy: 0.33648623432420005
Energy: 0.33059060161862275
Energy: 0.33447097373200513
Energy: 0.3453841432081741
Energy: 0.3451788467214744
Energy: 0.31972239828065185
Energy: 0.3454511879927519
Energy: 0.3255393424677233

minimum gb energy = 0.31373722992527675 eV
minimum distance =  2.63826652610828 Angstroms
sigma value = 101


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

Energy: 0.5267754317008532
Energy: 0.33163376880559664
Energy: 0.3338879843669249
Energy: 0.3250948033994206
Energy: 0.3252323203440259
Energy: 0.3250793672022611
Energy: 0.3450822414786249
Energy: 0.32819113542224304
Energy: 0.32542968811284784
Energy: 0.3282046244358585
Energy: 0.3279827652791926
Energy: 0.31302167692349775
Energy: 0.3369288727368106
Energy: 0.3405157008751481
Energy: 0.34013598746738505
Energy: 0.3373074836447514
Energy: 0.321460981212201
Energy: 0.3295043965036758
Energy: 0.32473889865032457
Energy: 0.3241407861214729
Energy: 0.32470767294880654
Energy: 0.3254314136862553
Energy: 0.32562043535577295
Energy: 0.3238155763700267
Energy: 0.3303589014565318
Energy: 0.3313411280252939
Energy: 0.3329832947134553
Energy: 0.33133625800487915
Energy: 0.335363369545186
Energy: 0.3494225548529937
Energy: 0.32751442174745804
Energy: 0.3395532382454832
Energy: 0.334481596671384
Energy: 0.3278102571037528
Energy: 0.3300105855162464
Energy: 0.33639546598283687
Energy: 0.3261308748703686
Energy: 0.3261554850433401
Energy: 0.32543723325039103
Energy: 0.32664726096126756
Energy: 0.326358740450258
Energy: 0.33025963430728533
Energy: 0.3199982837455371
Energy: 0.3463022439587726
Energy: 0.33153132039830524
Energy: 0.3202388745902513
Energy: 0.3378564915169463
Energy: 0.3329649051854311
Energy: 0.3207979664234196
Energy: 0.3298331750462866
Energy: 0.3420969382212191
Energy: 0.32175012942600917
Energy: 0.32874307135134667
Energy: 0.33967611563870526
Energy: 0.3219074302518603
Energy: 0.3241867192750446
Energy: 0.3261147208975804
Energy: 0.32672204026002044
Energy: 0.34419404625689326
Energy: 0.34211195519737714
Energy: 0.38153894267910904
Energy: 0.33273449578690734
Energy: 0.32046772416589236
Energy: 0.38191032759754495
Energy: 0.30993088203324837
Energy: 0.32634387812238175
Energy: 0.33240595916839183
Energy: 0.326756482132979
Energy: 0.32815270207122604
Energy: 0.3332471521047276
Energy: 0.3395309843520078
Energy: 0.33947271219465674
Energy: 0.3199115955957438
Energy: 0.33182576112003137
Energy: 0.3287835578686267
Energy: 0.3206230895753161
Energy: 0.3298250933614929
Energy: 0.3293341018182481
Energy: 0.3227294739356366
Energy: 0.31750444474225215
Energy: 0.3158440467061693
Energy: 0.3231647141209867
Energy: 0.3194646696556482
Energy: 0.33593482866357494
Energy: 0.33450372600914174
Energy: 0.3287848897215432
Energy: 0.33019411207392313
Energy: 0.3349535504075634
Energy: 0.32051370291582765
Energy: 0.32826408780460037
Energy: 0.3351778845122307
Energy: 0.3227172458089153
Energy: 0.327420682322095
Energy: 0.33603496639544816
Energy: 0.32080745319994924
Energy: 0.31489591517785914
Energy: 0.3107608837202637
Energy: 0.32385773240886534
Energy: 0.33022079689844164
Energy: 0.30662747123763
Energy: 0.32512723980736197
Energy: 0.3204568730970556
Energy: 0.32371277920646657
Energy: 0.3280343870403649
Energy: 0.3286299738506736
Energy: 0.32421878459458897
Energy: 0.3278672062442454
Energy: 0.33431990030549097
Energy: 0.3353420202740725
Energy: 0.3275028628698521
Energy: 0.34042885172083936
Energy: 0.32903856918013685
Energy: 0.33316498123991156
Energy: 0.32993714231263593
Energy: 0.3281049748361437
Energy: 0.3392931255579549
Energy: 0.33960154605038045
Energy: 0.3285692838511578
Energy: 0.3172595021392762
Energy: 0.3242512467917734
Energy: 0.3314233254717917
Energy: 0.32823225133606826
Energy: 0.3318768569861802
Energy: 0.33252020576185537
Energy: 0.33160983547331385
Energy: 0.3277459434198077
Energy: 0.3265193218944696
Energy: 0.33818352862602624
Energy: 0.3358921846558333
Energy: 0.32728828645009644
Energy: 0.33717634626056103
Energy: 0.34000009617567184
Energy: 0.32981501510222294
Energy: 0.31533612965560187
Energy: 0.3372119742711527
Energy: 0.3299765881615618
Energy: 0.3152830692178467
Energy: 0.32615436374988066
Energy: 0.32078959680355146
Energy: 0.3123851562665627
Energy: 0.3331983897611226
Energy: 0.32115280830104836
Energy: 0.32470581680463323
Energy: 0.33248574510115636
Energy: 0.32054475294075596
Energy: 0.33875439598914414
Energy: 0.3298946649158551
Energy: 0.32126413696048717
Energy: 0.32951535339673216
Energy: 0.3401484503376864
Energy: 0.32154433514663017
Energy: 0.3291291417594882
Energy: 0.3255005658861347
Energy: 0.3220600174559541
Energy: 0.33732388915449063
Energy: 0.34004181874821127
Energy: 0.32447136198657517
Energy: 0.332237886466805
Energy: 0.32066619903515475
Energy: 0.3248232671115044
Energy: 0.3100703318826136
Energy: 0.3327298349960284
Energy: 0.33135122355273683
Energy: 0.3074706311063965
Energy: 0.33508913362243115
Energy: 0.3321815868217074
Energy: 0.3051491277782902
Energy: 0.32904976721761015
Energy: 0.3211415099419005
Energy: 0.33439571596444345
Energy: 0.3392241056533482
Energy: 0.32122848788987995
Energy: 0.33329179766254485
Energy: 0.3336892408119833
Energy: 0.3184458978757585
Energy: 0.3263464356473039
Energy: 0.32280403638424066
Energy: 0.3252913297607473
Energy: 0.3261794878585027
Energy: 0.32314214231583743
Energy: 0.33543766642927975
Energy: 0.3287486292758707
Energy: 0.3304472849073246
Energy: 0.33593274371214205
Energy: 0.3219326091798721
Energy: 0.33599326390691014
Energy: 0.3349029326173137
Energy: 0.32764072153368773
Energy: 0.32713535050243636
Energy: 0.3383605439503543
Energy: 0.3220675024256151
Energy: 0.3392082270530631
Energy: 0.31551632781571815
Energy: 0.33473473728893344
Energy: 0.33239040053454916
Energy: 0.3045587653955783
Energy: 0.33450324682782684
Energy: 0.32533425034118274

minimum gb energy = 0.3045587653955783 eV
minimum distance =  2.61809824708703 Angstroms
sigma value = 33


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

Energy: 0.011712321395698617
Energy: 0.012398053038567827
Energy: 0.012235369350306275
Energy: 0.012944784559638964
Energy: 0.34420469174349777
Energy: 0.01213336037077184
Energy: 0.012539766952337909
Energy: 0.06054288800918466
Energy: 0.060245640279696845
Energy: 0.060025239998610314
Energy: 0.06065072055002246
Energy: 0.0600452959290119
Energy: 0.46715830864818736
Energy: 0.34405504577891477
Energy: 0.34290663816575906
Energy: 0.34325660513582507
Energy: 0.3438396640731323
Energy: 0.34261466106145366
Energy: 0.012539766952337909
Energy: 0.06054288800883125
Energy: 0.060245640279343426
Energy: 0.06002523999758935
Energy: 0.060650720549669065
Energy: 0.060045295928324714

minimum gb energy = 0.011712321395698617 eV
minimum distance =  2.82474204987649 Angstroms
sigma value = 1