Model name: model_name=EAM_Dynamo_HepburnAckland_2008_FeC__MO_143977152728_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.8553125262260437
cohesive_energy=4.013297914353109
mass=55.845
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=[1.28468931220656e-19, 2.13235290395694e-19, 2.82981243626982e-19, 3.44538472081896e-19, 3.9416749549667997e-19, 4.3340480126333994e-19, 4.644790170797699e-19, 4.8980141878014e-19, 5.11546160056788e-19, 5.310029931000839e-19, 5.4859168818813595e-19, 5.6435870844333e-19, 5.78328086515176e-19, 5.9057192035220395e-19, 6.0120877102533e-19, 6.10400458374588e-19, 6.182879739437699e-19, 6.249994918635959e-19, 6.30611916612498e-19, 6.351572917231559e-19, 6.386404237254719e-19, 6.410773343857859e-19, 6.424952607068759e-19, 6.429502788709319e-19, 6.424712280573659e-19, 6.40952364608334e-19, 6.38268718746384e-19, 6.342744923978219e-19, 6.28793446132908e-19, 6.216221035191239e-19, 6.1252814894454e-19, 6.01242416734644e-19, 5.87471708565414e-19, 5.705367015440339e-19, 5.49139632596964e-19, 5.217504230387339e-19, 4.86305469364752e-19, 4.40947848856212e-19, 3.8431410919757993e-19, 3.14641856091456e-19, 2.2907120424615e-19, 1.206233926792848e-19, -3.24435961855098e-20, -2.6284028116096796e-19, -6.3238712832297e-19, -1.2523461724960019e-18, -2.3323365914128198e-18, -4.32190351374768e-18, -8.31436746801228e-18, -1.71346382299764e-17, -3.8891075396052596e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.01240457157623236
Energy: 0.21472371140351157
Energy: 0.21417544858676268
Energy: 0.21425410706735817
Energy: 0.21551190549371774
Energy: 0.012481931670684005
Energy: 0.21472371140448904
Energy: 0.9399704443024356
Energy: 0.94056628299368
Energy: 0.2141831372096244
Energy: 0.9400757316958579
Energy: 0.21419297007714613
Energy: 0.21417569162984115
Energy: 0.9405662829927026
Energy: 0.9404731789863336
Energy: 0.013000923178014809
Energy: 0.2142165542060203
Energy: 0.9405783498873799
Energy: 0.21425410707227333
Energy: 0.21418313657682664
Energy: 0.013000923177037363
Energy: 0.012541317595257577
Energy: 0.21449647013315246
Energy: 0.21428517418433693
Energy: 0.21551190549422042
Energy: 0.9400757317007731
Energy: 0.21421655420551758
Energy: 0.21449647013267772
Energy: 0.9400852852512896
Energy: 0.2142240555204891
Energy: 0.012481931669706561
Energy: 0.21419297007714613
Energy: 0.9405783498883852
Energy: 0.21428517434793323
Energy: 0.2142240554178015
Energy: 0.012541415689552977

minimum gb energy = 0.01240457157623236 eV
minimum distance =  2.47159881764991 Angstroms
sigma value = 1


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

Energy: 1.9799370431042036
Energy: 1.2791864602448189
Energy: 1.3591052443522227
Energy: 1.2752947045676377
Energy: 1.294643826068232
Energy: 1.2558636856135432
Energy: 1.3717438709054672
Energy: 1.3636217981486596
Energy: 1.2650723424420236
Energy: 1.245416660812537
Energy: 1.2399919697838104
Energy: 1.2466578724512465
Energy: 1.276851704788474
Energy: 1.2441669205033135
Energy: 1.245221371262455
Energy: 1.3405341297747493
Energy: 1.2446034910085473
Energy: 1.2392944457739001
Energy: 1.2405789582965807
Energy: 1.2199722783163385
Energy: 1.3045253563696309
Energy: 1.4332995580234416
Energy: 1.2479066245931671
Energy: 1.23609759462366
Energy: 1.2758949634933008
Energy: 1.2580386139457174
Energy: 1.2624929517634444
Energy: 1.2738730585215474
Energy: 1.3608876399526382
Energy: 1.3121127424070858
Energy: 1.3582050928446585
Energy: 1.3305416590657408
Energy: 1.4083337806100211
Energy: 1.2409464869091587
Energy: 1.3305313263499752
Energy: 1.3340129389799347
Energy: 1.3583347618474295
Energy: 1.3297323262964817
Energy: 1.3392942124830167
Energy: 1.367560374620124
Energy: 1.3294643314750931
Energy: 1.3296513268129806
Energy: 1.3921816520033323
Energy: 1.2873681648096817
Energy: 1.353598623913249
Energy: 1.141030625607408
Energy: 1.4090463238129722
Energy: 1.2705475841026874
Energy: 1.2059907468525444
Energy: 1.3171742480776338
Energy: 1.3472022054021469
Energy: 1.1413873533835035
Energy: 1.316312037073488
Energy: 1.477646826572683
Energy: 1.2098920042126207
Energy: 1.3160918131582409
Energy: 1.314972977503567
Energy: 1.1285494593968144
Energy: 1.313124573981845
Energy: 1.3278706294839504
Energy: 1.308865184741093
Energy: 1.2717969805359508
Energy: 1.127202380014015
Energy: 1.1291179478087423
Energy: 1.127376006415238
Energy: 1.2733331569330002
Energy: 1.2997066833140725
Energy: 1.2730913417174103
Energy: 1.2788835315761666
Energy: 1.1277274887642927
Energy: 1.2823962947296472
Energy: 1.3239741226052837
Energy: 1.2947972165856343
Energy: 1.2714352120812429
Energy: 1.2657759138877622
Energy: 1.1274568170744805
Energy: 1.272224317711323
Energy: 1.3890819070395677
Energy: 1.3482704151244362
Energy: 1.3272898719026403
Energy: 1.1302103235451213
Energy: 1.127490145545967
Energy: 1.12697800383606
Energy: 1.3261938933902506
Energy: 1.1782439748881526
Energy: 1.228131241304428
Energy: 1.2279891209730627
Energy: 1.1287358648171673
Energy: 1.23296327892191
Energy: 1.3064230985666359
Energy: 1.2361473870123691
Energy: 1.2249246331868209
Energy: 1.250095151518335
Energy: 1.14286979109562
Energy: 1.2228323147239846
Energy: 1.435143087663486
Energy: 1.353006411325787
Energy: 1.3291706149713987
Energy: 1.4486479783224038
Energy: 1.2817795590698855
Energy: 1.3286525281340125
Energy: 1.3342416247534754
Energy: 1.2973282269278688
Energy: 1.334320316238657
Energy: 1.3284710168094356
Energy: 1.3288510588046196
Energy: 1.3273279325168141
Energy: 1.4109070603836884
Energy: 1.296270639395667
Energy: 1.3287917318399285
Energy: 1.417801808420402
Energy: 1.2924870319413166
Energy: 1.3292345355778183
Energy: 1.3631458478368
Energy: 1.2786152261421724
Energy: 1.3443873586206312
Energy: 1.1953306533082522
Energy: 1.1414694083642003
Energy: 1.3363238036766096
Energy: 1.3933062572353831
Energy: 1.246981021493159
Energy: 1.3268686015934283
Energy: 1.3257260124908077
Energy: 1.3697538861431338
Energy: 1.3324912143136798
Energy: 1.3758577259525882
Energy: 1.2765902631870827
Energy: 1.3352520215400758
Energy: 1.3335265026870462
Energy: 1.2079285218437592
Energy: 1.3329706132775534
Energy: 1.2599422488146705
Energy: 1.178459314444762
Energy: 1.3604152131879905
Energy: 1.3165107468392452
Energy: 1.234279338344319
Energy: 1.2364506436375424
Energy: 1.248087691760613

minimum gb energy = 1.12697800383606 eV
minimum distance =  2.177360795161 Angstroms
sigma value = 33


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

Energy: 2.3447031597084953
Energy: 1.2878851243761882
Energy: 1.2173448931621413
Energy: 1.2621739807791355
Energy: 1.2805916939634923
Energy: 1.3691460940895719
Energy: 1.3831490139614298
Energy: 1.5099901869834629
Energy: 1.2349224920046211
Energy: 1.2414509752487382
Energy: 1.2290003961583378
Energy: 1.3339639121242033
Energy: 1.384176088378184
Energy: 1.3115239378562569
Energy: 1.3075104540152989
Energy: 1.2591693767648782
Energy: 1.3096364300124965
Energy: 1.3964780149998823
Energy: 1.3198118294997336
Energy: 1.3170108961162321
Energy: 1.3109350989529251
Energy: 1.4642988417748508
Energy: 1.3103422709272328
Energy: 1.312572075787543
Energy: 1.3669299458145507
Energy: 1.3084523031256992
Energy: 1.3479488548559067
Energy: 1.4304178764831768
Energy: 1.522499415232344
Energy: 1.3606002733321265
Energy: 1.2393962887178152
Energy: 1.3808031841848865
Energy: 1.3770081130029128
Energy: 1.2409116569311265
Energy: 1.3775491962549282
Energy: 1.379542443824875
Energy: 1.2384982105083466
Energy: 1.3795749106598063
Energy: 1.3777682835057248
Energy: 1.5051486776570617
Energy: 1.3783317314677077
Energy: 1.378744000495358
Energy: 1.2475362761752105
Energy: 1.2293957133086733
Energy: 1.2665656644719838
Energy: 1.2494876605055818
Energy: 1.376336856551238
Energy: 1.2304825347045565
Energy: 1.3660352171003989
Energy: 1.3124204700999575
Energy: 1.3138492981376853
Energy: 1.3216001700075806
Energy: 1.3140334062329215
Energy: 1.4120387256017715
Energy: 1.1795719132775924
Energy: 1.3121414923506114
Energy: 1.3462052628188426
Energy: 1.3458511949765557
Energy: 1.3089881614216368
Energy: 1.351054034166473
Energy: 1.3329905707747252
Energy: 1.2522687738583271
Energy: 1.309160274269051
Energy: 1.3304476417479298
Energy: 1.3167734030078622
Energy: 1.249711115747011
Energy: 1.241790180232579
Energy: 1.2284799111711273
Energy: 1.2268401732182639
Energy: 1.2578752168562704
Energy: 1.2332282096296356
Energy: 1.2306283174677934
Energy: 1.2161116378153563
Energy: 1.233307788410405
Energy: 1.2330257599901389
Energy: 1.210676842380718
Energy: 1.2267766112232603
Energy: 1.2292199255333032
Energy: 1.2128753967298036
Energy: 1.298802911204072
Energy: 1.3215782000602838
Energy: 1.3330769841818568
Energy: 1.3141260268103523
Energy: 1.2139984497827465
Energy: 1.2378242290207075
Energy: 1.3615064025036767
Energy: 1.4004643239927017
Energy: 1.3956507728150107
Energy: 1.3637519290185847
Energy: 1.362086067162456
Energy: 1.2608771570490223
Energy: 1.3605017318616475
Energy: 1.3723163147777186
Energy: 1.4571433694773874
Energy: 1.3603529115075674
Energy: 1.4345632599844675
Energy: 1.2962780854846894
Energy: 1.2126287672720986
Energy: 1.4628876099117247
Energy: 1.3356473791483492
Energy: 1.41480192720699
Energy: 1.2993258818950035
Energy: 1.17966202007541
Energy: 1.3598353360879267
Energy: 1.3606977192755796
Energy: 1.4573923795422863
Energy: 1.359982006772457
Energy: 1.3766457289405298
Energy: 1.1778803874419603
Energy: 1.360996593701279
Energy: 1.3609539826702812
Energy: 1.3792331322224052
Energy: 1.3615167292729087
Energy: 1.360424396966271
Energy: 1.2179159675516176
Energy: 1.2182903946417825
Energy: 1.3394119014547263
Energy: 1.3829811244582981
Energy: 1.5080426171997297
Energy: 1.220467412505377
Energy: 1.2183350654522558
Energy: 1.2282750945411367
Energy: 1.2751427004698297
Energy: 1.5232189954190019
Energy: 1.2433261588180118
Energy: 1.2163601242102113
Energy: 1.2410777051989503
Energy: 1.2434173754184077
Energy: 1.3736781797233903
Energy: 1.281616932665869
Energy: 1.228135077853947
Energy: 1.2742679364102285
Energy: 1.4296921517320877
Energy: 1.5216257621397289
Energy: 1.3080345068098944
Energy: 1.3333650921447104
Energy: 1.3074756505278848
Energy: 1.3582246862933174
Energy: 1.2106950463200479
Energy: 1.3134328504552109
Energy: 1.312048796753908
Energy: 1.3237017576417902
Energy: 1.3081558873843377
Energy: 1.366938446008544
Energy: 1.4301634066637683
Energy: 1.522684416492436
Energy: 1.3093470116356063
Energy: 1.3226782789241411
Energy: 1.317494653364694
Energy: 1.3580469405837579
Energy: 1.2446529404801643
Energy: 1.3775820367551133
Energy: 1.3793527885789292
Energy: 1.2421191288695796
Energy: 1.3799061214590693
Energy: 1.2659500559208483
Energy: 1.2972988050581133
Energy: 1.378109754178998
Energy: 1.3786841442740685
Energy: 1.4670325913634674
Energy: 1.3796883356988774
Energy: 1.3776309202493657
Energy: 1.2393810686974664
Energy: 1.3793146428976857
Energy: 1.2388648664675734
Energy: 1.239859570056715
Energy: 1.3785165970145794
Energy: 1.4148828395693385
Energy: 1.3275683634112891
Energy: 1.3153659468879368
Energy: 1.4420396710332932
Energy: 1.3395247598516895
Energy: 1.3114034583492253
Energy: 1.407220652577569
Energy: 1.3446410691160429
Energy: 1.318124818775438
Energy: 1.3465803979775408
Energy: 1.4259065965754238
Energy: 1.3131850708366515
Energy: 1.4260335867247127
Energy: 1.3327878410887533
Energy: 1.3214799768796313
Energy: 1.3589570742197095
Energy: 1.3341866674337262
Energy: 1.319465593850394
Energy: 1.3458580670447606
Energy: 1.4513633819079035
Energy: 1.2324165920174204
Energy: 1.2295771140368008
Energy: 1.2432022118057746
Energy: 1.2278549896269353
Energy: 1.573875256642818
Energy: 1.3077855081392142
Energy: 1.2420604907926291
Energy: 1.2278508150833003
Energy: 1.2161984098758782
Energy: 1.2279094717500902
Energy: 1.3117430075661518
Energy: 1.3834176329607222
Energy: 1.3110962512679971
Energy: 1.2821175040990873
Energy: 1.2702889663162094
Energy: 1.230645906172441
Energy: 1.3283574986404563
Energy: 1.347048409561653
Energy: 1.4002870544121457
Energy: 1.3646721479136545
Energy: 1.2381548433989058
Energy: 1.362001342234059
Energy: 1.4406177119019408
Energy: 1.3429505857612962
Energy: 1.362323331066812
Energy: 1.3605392159059242
Energy: 1.2611342777015846
Energy: 1.3600101021158018
Energy: 1.3726488802793786
Energy: 1.3333734361012612
Energy: 1.350093675259561
Energy: 1.212172114423292
Energy: 1.3922682860335482
Energy: 1.299837435633037
Energy: 1.3495285586573094
Energy: 1.3460136193969592
Energy: 1.3615744428445442
Energy: 1.3606505686970232
Energy: 1.179553688548654
Energy: 1.362616098737234
Energy: 1.4314491629969066
Energy: 1.3455320177860333
Energy: 1.3601616735275037
Energy: 1.3604239267639897
Energy: 1.3104352180102978
Energy: 1.3651928535157531
Energy: 1.4626470116334735
Energy: 1.3819398098640212
Energy: 1.3168621354221473
Energy: 1.2187547318629992
Energy: 1.2201174044602776
Energy: 1.219860311166222
Energy: 1.3110359344516747
Energy: 1.1763089273945087
Energy: 1.2280812069772336
Energy: 1.2318333881742198
Energy: 1.2166541270401694
Energy: 1.2280777476291145
Energy: 1.352482069969466

minimum gb energy = 1.1763089273945087 eV
minimum distance =  2.20064845480549 Angstroms
sigma value = 51


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

Energy: 2.184515527836289
Energy: 1.2911761164799411
Energy: 1.434267283369551
Energy: 1.3330436903866225
Energy: 1.2945924947130756
Energy: 1.3746603225514695
Energy: 1.3528886524464645
Energy: 1.3979752209116454
Energy: 1.28963617006883
Energy: 1.3807279317501238
Energy: 1.2925724644881855
Energy: 1.294802091719781
Energy: 1.3518024644899915
Energy: 1.2886183259098953
Energy: 1.2893448617286245
Energy: 1.3273181469401507
Energy: 1.2979801745911501
Energy: 1.2922570626347532
Energy: 1.3278802023202927
Energy: 1.289288936972306
Energy: 1.2887724531883025
Energy: 1.3259142068624723
Energy: 1.2869633294099099
Energy: 1.2907255523691459
Energy: 1.3290167227220677
Energy: 1.2897781670215598
Energy: 1.3185295473881098
Energy: 1.3326717746380026
Energy: 1.4349868334459608
Energy: 1.304942873729954
Energy: 1.4142729572013844
Energy: 1.3863092122963618
Energy: 1.3855989691123893
Energy: 1.37789854409904
Energy: 1.3874972015969578
Energy: 1.3874639507191613
Energy: 1.4121152270589858
Energy: 1.388552589164322
Energy: 1.391634682625584
Energy: 1.4689847071737159
Energy: 1.3892136639704495
Energy: 1.388675537745307
Energy: 1.450762442577651
Energy: 1.2907025909641723
Energy: 1.3886657174581964
Energy: 1.3572861285639584
Energy: 1.38705445873569
Energy: 1.2919149497177869
Energy: 1.2000478897501012
Energy: 1.2910180559933218
Energy: 1.2881129979510206
Energy: 1.3258858299349938
Energy: 1.2916463971690142
Energy: 1.363734646168084
Energy: 1.1729151180244057
Energy: 1.2952758392272001
Energy: 1.3817064498486877
Energy: 1.3733567152813777
Energy: 1.2887901882818467
Energy: 1.3643314423726618
Energy: 1.3598795633149179
Energy: 1.318123125985694
Energy: 1.2905784428560478
Energy: 1.3539731089830263
Energy: 1.4204214461544755
Energy: 1.2884216241978772
Energy: 1.3769199210721212
Energy: 1.2870378122415598
Energy: 1.2864062939130978
Energy: 1.3900579466199736
Energy: 1.2891481094763086
Energy: 1.2868819563598544
Energy: 1.3472978744222388
Energy: 1.2969195051797864
Energy: 1.2877503084331767
Energy: 1.3894654207180328
Energy: 1.302562412176868
Energy: 1.2867107005155127
Energy: 1.3352461552996897
Energy: 1.318072009577553
Energy: 1.320854865061782
Energy: 1.4523735158870787
Energy: 1.3202663546826428
Energy: 1.3859343165364924
Energy: 1.4058853586257771
Energy: 1.38658504378207
Energy: 1.3908860458915797
Energy: 1.521836221758394
Energy: 1.3867163225441663
Energy: 1.3866352103900008
Energy: 1.3521587038564005
Energy: 1.3864934782447798
Energy: 1.386399583671905
Energy: 1.4692128033232037
Energy: 1.388027359580724
Energy: 1.3862271311711842
Energy: 1.3380009270618194
Energy: 1.4134278147822714
Energy: 1.386695161133593
Energy: 1.4542512057400003
Energy: 1.3198845623954294
Energy: 1.31988239217422
Energy: 1.1736795369855573
Energy: 1.2902118376222795
Energy: 1.2885594329075183
Energy: 1.3261917550018834
Energy: 1.296497870746896
Energy: 1.3610419160433018

minimum gb energy = 1.1729151180244057 eV
minimum distance =  2.2047217430929 Angstroms
sigma value = 19


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

Energy: 2.0214961958078237
Energy: 1.3131856582095118
Energy: 1.4425036104795168
Energy: 1.436322327666932
Energy: 1.3139607926590668
Energy: 1.3892644255214042
Energy: 1.381954805287
Energy: 1.502794647436694
Energy: 1.3119870168605974
Energy: 1.3552889577224871
Energy: 1.3760132576928885
Energy: 1.4975670304554223
Energy: 1.4568037223572363
Energy: 1.4285004011795288
Energy: 1.4860862878362064
Energy: 1.3501745062055923
Energy: 1.4307716849441372
Energy: 1.5075944230163134
Energy: 1.499350952025065
Energy: 1.4294695214121074
Energy: 1.43146164823263
Energy: 1.500034240612131
Energy: 1.433378376394022
Energy: 1.504031362706703
Energy: 1.508239545303227
Energy: 1.4469244661741865
Energy: 1.5019905581103004
Energy: 1.3503029001295337
Energy: 1.5417667439393172
Energy: 1.5482272473963257
Energy: 1.4977283064894482
Energy: 1.447906552023583
Energy: 1.5099892536047401
Energy: 1.2955061793824643
Energy: 1.4864759436615285
Energy: 1.4974116364351036
Energy: 1.5356488242256006
Energy: 1.4572834920746425
Energy: 1.473941053472045
Energy: 1.4760480430981815
Energy: 1.4330933046065053
Energy: 1.5419390998067457
Energy: 1.4538104083400265
Energy: 1.4296568382926746
Energy: 1.4946799064988758
Energy: 1.3504363112558897
Energy: 1.4861159291053772
Energy: 1.459566164619913
Energy: 1.3453600476618115
Energy: 1.3761361299563446
Energy: 1.3130003581635818
Energy: 1.3518294617133515
Energy: 1.3202924075313778
Energy: 1.496636794489622
Energy: 1.2891058247375702
Energy: 1.3150060651767626
Energy: 1.3122052925238745
Energy: 1.3183727487017078
Energy: 1.3182416591223591
Energy: 1.4340918945751928
Energy: 1.3826854712606136
Energy: 1.4906031745591755
Energy: 1.37717902662782
Energy: 1.361037789444895
Energy: 1.3758306113155006
Energy: 1.4736821512749099
Energy: 1.4567639928614557
Energy: 1.523682476141463
Energy: 1.4836386114742808
Energy: 1.4984667666699618
Energy: 1.4792220125673554
Energy: 1.5398202682457438
Energy: 1.5790108697235117
Energy: 1.4855689861930923
Energy: 1.511565058343966
Energy: 1.4984578762318297
Energy: 1.4913707516546466
Energy: 1.5488854699413297
Energy: 1.3841538109429707
Energy: 1.4874221899550149
Energy: 1.4293735732068682
Energy: 1.4115176232482503
Energy: 1.489944421738276
Energy: 1.5001467251143872
Energy: 1.3175886312097258
Energy: 1.3108307640871049
Energy: 1.4643915988669016
Energy: 1.4148362217957686
Energy: 1.3774089027846108
Energy: 1.3651683229908758
Energy: 1.3580683568277265
Energy: 1.3130441509077024
Energy: 1.3720896997065675
Energy: 1.2997946446242696
Energy: 1.311893636557477
Energy: 1.3573170738086537
Energy: 1.2956892090641765
Energy: 1.3764367206566988
Energy: 1.4902016642408298
Energy: 1.382855350585923
Energy: 1.4911538043790906
Energy: 1.31137094253513
Energy: 1.4648936519989841
Energy: 1.4319251078653394
Energy: 1.5069165541729934
Energy: 1.519812331385068
Energy: 1.4295844816639292
Energy: 1.4308499991047514
Energy: 1.4663928030291935
Energy: 1.4309196940007824
Energy: 1.4287925877187422
Energy: 1.4971738410600697
Energy: 1.4287179871619997
Energy: 1.4871714508779876
Energy: 1.3495840283051221
Energy: 1.493040803657397
Energy: 1.450775023619249
Energy: 1.4908448778612884
Energy: 1.4912596731811143
Energy: 1.376348232659064
Energy: 1.346572827045016
Energy: 1.486451063990808
Energy: 1.475216449199045
Energy: 1.4957138910877992
Energy: 1.4308087949039772
Energy: 1.5099500994521775
Energy: 1.2316602758719173
Energy: 1.4312825669482707
Energy: 1.4556481517449702
Energy: 1.5444649399614487
Energy: 1.458819851749476
Energy: 1.4751916766530482
Energy: 1.2950272158174294
Energy: 1.43981418476012
Energy: 1.5288534749266893
Energy: 1.3834485255335733
Energy: 1.4881879693206455
Energy: 1.377119805953611
Energy: 1.3552293195111276
Energy: 1.310420573196009
Energy: 1.4360246752969898
Energy: 1.3454840848121743
Energy: 1.3113314345655758
Energy: 1.3561304818082656
Energy: 1.3194662275267328
Energy: 1.313268366227172
Energy: 1.3760236571387958
Energy: 1.346679550352692
Energy: 1.3107020523357458
Energy: 1.3119922572996785
Energy: 1.373567477548965
Energy: 1.50992011167947
Energy: 1.5260341628190075
Energy: 1.3828362210267455
Energy: 1.48729569720824
Energy: 1.3770064841080467
Energy: 1.4938052033058993
Energy: 1.4795283675674487
Energy: 1.479481677844208
Energy: 1.4986006471847875
Energy: 1.4799351440179245
Energy: 1.4849908647607593
Energy: 1.455906467428396
Energy: 1.478899454873566
Energy: 1.4890704624543962
Energy: 1.5818742339698215
Energy: 1.4730140963294873
Energy: 1.5076323771859041
Energy: 1.3832994635421036
Energy: 1.4894931684299855
Energy: 1.4179741118608702
Energy: 1.3839939754945803
Energy: 1.5036224016234767
Energy: 1.4289927655463064
Energy: 1.2294446717644638
Energy: 1.3107897174938403
Energy: 1.3119396565443389
Energy: 1.3172027805884106
Energy: 1.3143733877888548
Energy: 1.3705461168660231

minimum gb energy = 1.2294446717644638 eV
minimum distance =  2.19806726220334 Angstroms
sigma value = 27


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

Energy: 1.6517104423023665
Energy: 1.3250505535991615
Energy: 1.5040331566611496
Energy: 1.2426456528815455
Energy: 1.4413581540448128
Energy: 1.4008327581012623
Energy: 1.2094267031069632
Energy: 1.3994310716647653
Energy: 1.3862888437619914
Energy: 1.205376100652255
Energy: 1.3317553253039112
Energy: 1.393097594788413
Energy: 1.2005431128713946
Energy: 1.3521467320441978
Energy: 1.332719532704272
Energy: 1.2079708577457324
Energy: 1.3362175085167871
Energy: 1.3867207183480985
Energy: 1.3384637175024037
Energy: 1.3290884634420743
Energy: 1.3321668552968635
Energy: 1.3858007750993397
Energy: 1.333089722083573
Energy: 1.3283234719568053
Energy: 1.2044773975317595
Energy: 1.3214643817906668
Energy: 1.3980771154802947
Energy: 1.2100628128058584
Energy: 1.3928116046277905
Energy: 1.3223474023914892
Energy: 1.2410998380489713
Energy: 1.3298364903935693
Energy: 1.3944018707705634
Energy: 1.2091734977837008
Energy: 1.3957624924804306
Energy: 1.3301951915295795
Energy: 1.2438694683439737
Energy: 1.4462668446008955
Energy: 1.3737281264892571
Energy: 1.651374896912587
Energy: 1.332505985464507
Energy: 1.5016015369260682
Energy: 1.204595634714975
Energy: 1.3859091899984552
Energy: 1.469224078906593
Energy: 1.2094382265962238
Energy: 1.3969441277828363
Energy: 1.3856343594758191
Energy: 1.207927297533171
Energy: 1.332410886553129
Energy: 1.3504621441872389
Energy: 1.210344387420793
Energy: 1.3352174789039146
Energy: 1.3969652288962677
Energy: 1.354177186940013
Energy: 1.333874679162965
Energy: 1.3286420784054513
Energy: 1.3887208210284256
Energy: 1.332182461875034
Energy: 1.333274798217004
Energy: 1.2104361740184508
Energy: 1.3851776358573573
Energy: 1.3252431818887718
Energy: 1.2046146884330176
Energy: 1.467556048496484
Energy: 1.5631072433363187
Energy: 1.1878283868284945
Energy: 1.3853912912735697
Energy: 1.3277032232144008
Energy: 1.24107479468883
Energy: 1.3331699538947621
Energy: 1.4740975271879797

minimum gb energy = 1.1878283868284945 eV
minimum distance =  2.21917139552028 Angstroms
sigma value = 9


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

Energy: 1.3678477576701071
Energy: 1.3173406500047211
Energy: 1.2894837706583069
Energy: 1.3928241933565513
Energy: 1.316307916376102
Energy: 1.4604250302514066
Energy: 1.396963709159992
Energy: 1.4588051371187443
Energy: 1.3156519644444096
Energy: 1.3164938095312548
Energy: 1.3144734984770947
Energy: 1.3896626554158364
Energy: 1.4407658296363703
Energy: 1.5044697567158805
Energy: 1.5009434411534701
Energy: 1.3232563602130303
Energy: 1.4955696719995957
Energy: 1.5599123416701446
Energy: 1.2477269837184013
Energy: 1.501571663781566
Energy: 1.5024438883785958
Energy: 1.3149105524829108
Energy: 1.496980685803746
Energy: 1.5018566707467784
Energy: 1.3646609268529486
Energy: 1.501270709320988
Energy: 1.5021033711381782
Energy: 1.3912792916126242
Energy: 1.4949285062264432
Energy: 1.5256116617345852
Energy: 1.3590967787930022
Energy: 1.3141270168664272
Energy: 1.5384377474140738
Energy: 1.3940305482933297
Energy: 1.3150887486332903
Energy: 1.3169157534427898
Energy: 1.2904015855590163
Energy: 1.3165624631772952
Energy: 1.4166163168573647
Energy: 1.468081245440719
Energy: 1.3152167362075073
Energy: 1.2877749272781978
Energy: 1.2757696041102544
Energy: 1.315151194021363
Energy: 1.554922638468798
Energy: 1.3932974306118755
Energy: 1.3169271235795061
Energy: 1.277271720873664
Energy: 1.290561292879953
Energy: 1.481351059626805
Energy: 1.5388772927766148
Energy: 1.390503004805327
Energy: 1.469550495027836
Energy: 1.5112372890634536
Energy: 1.290165962073068
Energy: 1.4813000258789064
Energy: 1.4684661301340134
Energy: 1.3811479924362802
Energy: 1.4704443550397506
Energy: 1.488786856311615
Energy: 1.3946257246004004
Energy: 1.5070127826476685
Energy: 1.4678695749937885
Energy: 1.392753147184284
Energy: 1.4681561992956966
Energy: 1.4912904488856733
Energy: 1.3921073651882316
Energy: 1.5617014576045312
Energy: 1.419454919352604
Energy: 1.3906108289965966
Energy: 1.41719160274632
Energy: 1.3908726014862618
Energy: 1.3591572061252508
Energy: 1.4184942676855887
Energy: 1.4036915274211728
Energy: 1.3381551898606874
Energy: 1.417694690281733
Energy: 1.508922042988241
Energy: 1.3952806806572922
Energy: 1.4190595844740441
Energy: 1.3888710318099418
Energy: 1.3664470180663113
Energy: 1.4170760991904927
Energy: 1.4824700212817343
Energy: 1.3965091688533031
Energy: 1.5923663591055064
Energy: 1.3980829141787987
Energy: 1.339143314858703
Energy: 1.4200200964144538
Energy: 1.5149379388891269
Energy: 1.4797551988457303
Energy: 1.4178575715699213
Energy: 1.425535640547411
Energy: 1.3672444286400507
Energy: 1.4169916656644452
Energy: 1.4445743051281275
Energy: 1.3908999618473314
Energy: 1.4177951233381303
Energy: 1.417267854313742
Energy: 1.388973909798725
Energy: 1.4173430260331157
Energy: 1.4430459033149805
Energy: 1.3934631887511022
Energy: 1.4677514295699432
Energy: 1.5370248193411962
Energy: 1.438048239321949
Energy: 1.468025751459641
Energy: 1.3176517013648383
Energy: 1.2953057099089529
Energy: 1.4898750796709888
Energy: 1.5111979659187302
Energy: 1.4121838479447348
Energy: 1.4763068696677475
Energy: 1.5184294319635137
Energy: 1.2913693596331663
Energy: 1.4755978375127847
Energy: 1.4689447910400373
Energy: 1.3924502325263084
Energy: 1.468691959119281
Energy: 1.4997756763863526
Energy: 1.2867308503636399
Energy: 1.2783013322440284
Energy: 1.5598233397825911
Energy: 1.3882547474420275
Energy: 1.536408120506787
Energy: 1.2761947914143645
Energy: 1.2749995625378463
Energy: 1.3146525191588656
Energy: 1.379362082436054
Energy: 1.3849212786748786
Energy: 1.3140873175186198
Energy: 1.2754590967201205
Energy: 1.358329741648967
Energy: 1.315315305507467
Energy: 1.4695558859737168
Energy: 1.3853742760600862
Energy: 1.3144821047258084
Energy: 1.3135572781450162
Energy: 1.3614611536469612
Energy: 1.501351957443743
Energy: 1.503733323955833
Energy: 1.389297970843898
Energy: 1.517316415900474
Energy: 1.3153639060525157
Energy: 1.3629652689985143
Energy: 1.5230578771469523
Energy: 1.5011566335293176
Energy: 1.3201790006281582
Energy: 1.5019472392192488
Energy: 1.5556468400302432
Energy: 1.363936402920122
Energy: 1.501937136694061
Energy: 1.5040106501125081
Energy: 1.2391326616721143
Energy: 1.5019682654386943
Energy: 1.5033728958047252
Energy: 1.4391623439216816
Energy: 1.4920963739981847
Energy: 1.3147616164740334
Energy: 1.3626387622251332
Energy: 1.3162212614880262
Energy: 1.3914440962180255
Energy: 1.4358734151917074
Energy: 1.3140632941825523
Energy: 1.3157930914257978
Energy: 1.3513237995433365
Energy: 1.3146077580699524
Energy: 1.418862425878047
Energy: 1.39085170223035
Energy: 1.3148144290914643
Energy: 1.3142212863549467
Energy: 1.271791901667833
Energy: 1.3138762670203303
Energy: 1.4147724493563316
Energy: 1.437257284603125
Energy: 1.5414408382718119
Energy: 1.3798743170468248
Energy: 1.2893937929022696
Energy: 1.5084505536241561
Energy: 1.609896066914524
Energy: 1.4873074696488873
Energy: 1.4687670162455349
Energy: 1.49068228846109
Energy: 1.5262535915939628
Energy: 1.4684498260814192
Energy: 1.4682875875121557
Energy: 1.4822863306212952
Energy: 1.4709468881738523
Energy: 1.5249509230314
Energy: 1.294833727535377
Energy: 1.481680657610399
Energy: 1.4859183134757825
Energy: 1.4406575194709108
Energy: 1.4173698657737532
Energy: 1.4278305943737506
Energy: 1.3903399999698725
Energy: 1.474791679148868
Energy: 1.387730141381942
Energy: 1.3989264016121599
Energy: 1.4169102340783062
Energy: 1.4167645311920725
Energy: 1.3845136619751963
Energy: 1.41746356700153
Energy: 1.4823624111724196
Energy: 1.3712500880866645
Energy: 1.4153065075115823
Energy: 1.4164738512872508
Energy: 1.3882869215792175
Energy: 1.4171860516783796
Energy: 1.3927272788224363
Energy: 1.3349017702387351
Energy: 1.4849070724455173
Energy: 1.5913467586031511
Energy: 1.3904817695354825
Energy: 1.5819502026706918
Energy: 1.4096768088488578
Energy: 1.3716116729055168
Energy: 1.4158478717057608
Energy: 1.416524228307766
Energy: 1.3908796250230084
Energy: 1.4174664531704908
Energy: 1.4212880372846883
Energy: 1.3514337163967802
Energy: 1.442330860406207
Energy: 1.4452156737670938
Energy: 1.3800897564935164
Energy: 1.4167871729924515
Energy: 1.4982110137367655
Energy: 1.4379873895586517
Energy: 1.4154957687245986
Energy: 1.4563978968979165
Energy: 1.3918723113068068
Energy: 1.467923810120636
Energy: 1.3875871989744863
Energy: 1.3650764433902822
Energy: 1.475209360367749
Energy: 1.5258869550195857
Energy: 1.2943688945719949
Energy: 1.4818737798743158
Energy: 1.4687424792521897
Energy: 1.4437252899510167
Energy: 1.4687274719967536
Energy: 1.4878180647620987
Energy: 1.288490171968439
Energy: 1.467070121723538
Energy: 1.4682667162895837
Energy: 1.4377944558482079
Energy: 1.5426748262054868
Energy: 1.5102738383704897
Energy: 1.2894894906527756
Energy: 1.500376063369063
Energy: 1.5305995096566734
Energy: 1.3913719418214856
Energy: 1.3139430967481502
Energy: 1.3148669620832207
Energy: 1.2708879488468745
Energy: 1.3142889920277367
Energy: 1.6078313133557744

minimum gb energy = 1.2391326616721143 eV
minimum distance =  2.20287573975023 Angstroms
sigma value = 57


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

Energy: 2.368839618502954
Energy: 1.3033098649689072
Energy: 1.1674434528993367
Energy: 1.1681369503084678
Energy: 1.318428343901929
Energy: 1.4334597670480762
Energy: 1.1412456704276486
Energy: 1.4491474389223395
Energy: 1.2937459169082248
Energy: 1.1397376746541534
Energy: 1.2936598361389355
Energy: 1.4157966085319482
Energy: 1.1437933141691243
Energy: 1.3383415547306998
Energy: 1.4274412714351243
Energy: 1.1400301368070527
Energy: 1.4273536880678974
Energy: 1.3020211143081173
Energy: 1.1461086043352406
Energy: 1.4270763305861065
Energy: 1.4281360709786601
Energy: 1.3454836179931473
Energy: 1.4270377153599945
Energy: 1.1441401937951634
Energy: 1.1471824102780697
Energy: 1.3450837213014584
Energy: 1.4345815137485538
Energy: 1.139218950725667
Energy: 1.428060931460062
Energy: 1.344804089530279
Energy: 1.1363478157643607
Energy: 1.292933767170167
Energy: 1.4369623365231703
Energy: 1.1506650105755627
Energy: 1.2955607873594566
Energy: 1.2920024048576342
Energy: 1.1626869960188666
Energy: 1.324224872181555
Energy: 1.2990496545642214
Energy: 1.3380497525465798
Energy: 1.3300144676941155
Energy: 1.1651177665050747
Energy: 1.166584981713843
Energy: 1.292735122546713
Energy: 1.4500672544755489
Energy: 1.2963196640214607
Energy: 1.29616758805629
Energy: 1.2911145911988522
Energy: 1.1643669087583426
Energy: 1.1652797911786077
Energy: 1.4489266384650155
Energy: 1.1421543854545932
Energy: 1.4353075212012294
Energy: 1.1652542154367798
Energy: 1.1664418349177232
Energy: 1.2983523644428439
Energy: 1.4135224119737135
Energy: 1.4101261551148598
Energy: 1.2951867250295868
Energy: 1.165234189585502
Energy: 1.1418220617512327
Energy: 1.1471017676053228
Energy: 1.4409949921028011
Energy: 1.1416652528654725
Energy: 1.2917303538270015
Energy: 1.1455603559710625
Energy: 1.1510749217549079
Energy: 1.447520421687826
Energy: 1.42753523333509
Energy: 1.1419169462487757
Energy: 1.4279692362592522
Energy: 1.2936863361685313
Energy: 1.1529323810664551
Energy: 1.4278250503585679
Energy: 1.344225330326248
Energy: 1.3002658693886306
Energy: 1.444763190857492
Energy: 1.4278133358579965
Energy: 1.1492075489829032
Energy: 1.4493826607375369
Energy: 1.344823593786525
Energy: 1.1429522672981844
Energy: 1.4278149109544636
Energy: 1.3429128892372633
Energy: 1.1453283632777478
Energy: 1.4287499050372234
Energy: 1.297321122197257
Energy: 1.1474774860937076
Energy: 1.2986900341692291
Energy: 1.2943693802205383
Energy: 1.4203314279460855
Energy: 1.2975813932353926
Energy: 1.2982899296059573
Energy: 1.1488175706326194
Energy: 1.297389678176391
Energy: 1.3418584405874796
Energy: 1.4174949120902962
Energy: 1.2936004349909926
Energy: 1.2930392317588226
Energy: 1.1667039889186777
Energy: 1.2928980471314644
Energy: 1.4160553433537049
Energy: 1.138735899461929
Energy: 1.4342992504553023
Energy: 1.1649470936222268
Energy: 1.1628791583537996
Energy: 1.2994954661265588
Energy: 1.4144078082355651
Energy: 1.4212891374603385
Energy: 1.29415588565006
Energy: 1.2918062657851437
Energy: 1.1657726671068047
Energy: 1.2923943726877054
Energy: 1.434024951267128

minimum gb energy = 1.1363478157643607 eV
minimum distance =  2.18209566253712 Angstroms
sigma value = 11


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

Energy: 1.6014360066162052
Energy: 1.2091590198788305
Energy: 1.0858728086901634
Energy: 1.1928745563895224
Energy: 1.1966686138905227
Energy: 1.3117578660894178
Energy: 1.4645667644871172
Energy: 1.3360341816954469
Energy: 1.2529946545496125
Energy: 1.2504394328423474
Energy: 1.1937433895404073
Energy: 1.3666798338251376
Energy: 1.4755457905630545
Energy: 1.3343849107997563
Energy: 1.3380466018432986
Energy: 1.251173248968497
Energy: 1.3349860635749602
Energy: 1.3358815794349221
Energy: 1.4647353394896618
Energy: 1.3344673157518567
Energy: 1.3380886695271323
Energy: 1.2510171288995298
Energy: 1.3344246186368252
Energy: 1.3599427862940097
Energy: 1.4676797079673307
Energy: 1.334180147486755
Energy: 1.3354004472967433
Energy: 1.3675524927686824
Energy: 1.3340143446321675
Energy: 1.361057540311114
Energy: 1.4706457920544875
Energy: 1.336775567639759
Energy: 1.3357334000646421
Energy: 1.301336323558811
Energy: 1.335722026165473
Energy: 1.4016613087609613
Energy: 1.2782029800389094
Energy: 1.2482766234275189
Energy: 1.3353840047347205
Energy: 1.2491545693164585
Energy: 1.3352863308270921
Energy: 1.2464044970219512
Energy: 1.0793792528333728
Energy: 1.33581483794573
Energy: 1.3360316126177165
Energy: 1.3370396523612833
Energy: 1.3405436549983558
Energy: 1.2499305341756397
Energy: 1.2788492394949125
Energy: 1.1964551309782319
Energy: 1.3666364332398129
Energy: 1.4097557852536902
Energy: 1.335979027668081
Energy: 1.2006843817850883
Energy: 1.268190906728987
Energy: 1.1924379937263376
Energy: 1.1935621569378925
Energy: 1.382168637630919
Energy: 1.1933508733838796
Energy: 1.1958486249191154
Energy: 1.0860666827153567
Energy: 1.1925909230133538
Energy: 1.194028767879001
Energy: 1.3358143127885276
Energy: 1.1927446913151467
Energy: 1.1919378277190809
Energy: 1.0807702901307938
Energy: 1.1935549961988359
Energy: 1.366617661250423
Energy: 1.3667890987395386
Energy: 1.3053160696034039
Energy: 1.0850535675400783
Energy: 1.0865780011704966
Energy: 1.1936649500194518
Energy: 1.3403364474193709
Energy: 1.3615900587234422
Energy: 1.1936066124412008
Energy: 1.084249977798575
Energy: 1.078541547438993
Energy: 1.194922098761399
Energy: 1.2978028491065876
Energy: 1.361041596523854
Energy: 1.2011875220862607
Energy: 1.2498541716567866
Energy: 1.2727354673517646
Energy: 1.194640056839515
Energy: 1.3664514296808938
Energy: 1.3763808097804866
Energy: 1.3383054413084297
Energy: 1.2559524628432006
Energy: 1.279263936141317
Energy: 1.3346583773779845
Energy: 1.3838529043007055
Energy: 1.4042319222997728
Energy: 1.3347143342799948
Energy: 1.3355971976330119
Energy: 1.2887823748202822
Energy: 1.3385653473073977
Energy: 1.361167397257855
Energy: 1.3604870376466485
Energy: 1.335121517589534
Energy: 1.2472436178604744
Energy: 1.4722250951573832
Energy: 1.3352854545285284
Energy: 1.3357200039692798
Energy: 1.4253663109172938
Energy: 1.335331236053839
Energy: 1.3364073377138415
Energy: 1.4681293448987496
Energy: 1.3346965351950546
Energy: 1.4012281531605173
Energy: 1.364577234722947
Energy: 1.3354364750311758
Energy: 1.384390749546806
Energy: 1.2821953158760722
Energy: 1.335855955528412
Energy: 1.2472991614363615
Energy: 1.1968350147649895
Energy: 1.3377694769641904
Energy: 1.3364344154978074
Energy: 1.4637994287752185
Energy: 1.3437547826899674
Energy: 1.250534753309536
Energy: 1.0764084801065033
Energy: 1.3340737361561215
Energy: 1.3340638507749671
Energy: 1.4788027866546674
Energy: 1.3393567992646587
Energy: 1.1943195463005087
Energy: 1.258151437843794
Energy: 1.1941538565321728
Energy: 1.3653239656154832
Energy: 1.7390790352929353
Energy: 1.1948133529599643
Energy: 1.1952326557048587
Energy: 1.0799603910849787
Energy: 1.1935938842782954
Energy: 1.3367267332280413
Energy: 1.7370249253081085
Energy: 1.1917274496830248
Energy: 1.1912403019296995
Energy: 1.0929800392906008
Energy: 1.1911193275043663
Energy: 1.3667349418857926
Energy: 1.4609490123611368
Energy: 1.3051872797111
Energy: 1.0850172483690985
Energy: 1.0819538624991045
Energy: 1.1945585933024347
Energy: 1.3649469686011937
Energy: 2.027004877070438
Energy: 1.1924132854454281
Energy: 1.082948941488997
Energy: 1.0836949397157294
Energy: 1.1918353716457784
Energy: 1.296661371011254

minimum gb energy = 1.0764084801065033 eV
minimum distance =  2.17210609645941 Angstroms
sigma value = 41


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

Energy: 1.894686688912644
Energy: 1.095179738948517
Energy: 1.00594613786685
Energy: 1.0060498526639523
Energy: 1.09604009452352
Energy: 1.2577085309295803
Energy: 1.738792408857928
Energy: 1.2179196709809685
Energy: 1.0993802531996135
Energy: 1.136437842681878
Energy: 1.0997818526498748
Energy: 1.2488215077624323
Energy: 1.7344618502671683
Energy: 1.2612320789842544
Energy: 1.2171320343565446
Energy: 1.161703283690386
Energy: 1.2161239071929606
Energy: 1.295477594737858
Energy: 1.7250974486123545
Energy: 1.2162122367217616
Energy: 1.2166107151011423
Energy: 1.164494908549325
Energy: 1.215514969794942
Energy: 1.244232027711422
Energy: 1.7365584126476763
Energy: 1.215349028717289
Energy: 1.2152492305301197
Energy: 1.2598470182388297
Energy: 1.2164202097693493
Energy: 1.2434153676932203
Energy: 1.73211762935124
Energy: 1.2525125415165026
Energy: 1.2731797627364518
Energy: 1.260435371648868
Energy: 1.2523158841431385
Energy: 1.2530782631607864
Energy: 1.5229803453542683
Energy: 1.252975588431588
Energy: 1.252366505797901
Energy: 1.2525365252127643
Energy: 1.2522226401116996
Energy: 1.2520591293196897
Energy: 1.2955813725167276
Energy: 1.2525197181102397
Energy: 1.2526242275527013
Energy: 1.216661912722849
Energy: 1.264872379415148
Energy: 1.2431078968523241
Energy: 1.5121187601037729
Energy: 1.2732440117954091
Energy: 1.2524771221843711
Energy: 1.2473941792622099
Energy: 1.252272862351466
Energy: 1.218618971676841
Energy: 1.5088454759076664
Energy: 1.2599943688595143
Energy: 1.2155838990999621
Energy: 1.2510566894431407
Energy: 1.216065947424204
Energy: 1.2604912885189334
Energy: 1.1558655828723126
Energy: 1.2163990894291101
Energy: 1.2156790637695556
Energy: 1.2885067866746067
Energy: 1.2166267629609016
Energy: 1.1472724855176542
Energy: 1.1529606670270913
Energy: 1.1474008610868052
Energy: 1.2480463376086528
Energy: 1.2521937079564731
Energy: 1.2161670405273872
Energy: 1.147834347544213
Energy: 1.143965903623085
Energy: 1.0935146591370328
Energy: 1.2165927611585354
Energy: 1.251455562974168
Energy: 1.0992034238521364
Energy: 1.0933655972875056
Energy: 1.0026516810079091
Energy: 1.0969367933632352
Energy: 1.2148044055967748
Energy: 1.215716148655503
Energy: 1.0953901133593316
Energy: 1.0040692556996986
Energy: 1.0046838849416568
Energy: 1.0936373400057247
Energy: 1.2486560159319393
Energy: 1.2725742057517517
Energy: 1.201317963187908
Energy: 1.0933334113198916
Energy: 1.0036093175212548
Energy: 1.0938302573869083
Energy: 1.2254184775448342
Energy: 1.2481838418430777
Energy: 1.2011019114260386
Energy: 1.0055809101479054
Energy: 1.0024492001481007
Energy: 1.0068475180396521
Energy: 1.1773722757399518
Energy: 1.24519420446645
Energy: 1.0952100214657468
Energy: 1.0042145361994284
Energy: 1.142660480795169
Energy: 1.1312917165182144
Energy: 1.2248149356755875
Energy: 1.2441503569604788
Energy: 1.0987953850396255
Energy: 1.1304562001204375
Energy: 1.1567529870193356
Energy: 1.2161634739569926
Energy: 1.2475287800624937
Energy: 1.252279529995549
Energy: 1.2166247285760763
Energy: 1.161828840752209
Energy: 1.1545093136784117
Energy: 1.2164780993068034
Energy: 1.2157708201391406
Energy: 1.2441305106136713
Energy: 1.2161197493186309
Energy: 1.216756668255059
Energy: 1.5046514019219632
Energy: 1.21601178743304
Energy: 1.243859192156039
Energy: 1.24362326246343
Energy: 1.2162789046044644
Energy: 1.217689563959789
Energy: 1.5190962331955997
Energy: 1.216485866297093
Energy: 1.2544776684763677
Energy: 1.2479363119950124
Energy: 1.2523286900330022
Energy: 1.2162066548169925
Energy: 1.5197756163957516
Energy: 1.2522361520040441
Energy: 1.2531361692505596
Energy: 1.216074352961764
Energy: 1.2647534194129304
Energy: 1.252350160294743
Energy: 1.5236111429290586
Energy: 1.2525541106135998
Energy: 1.2526845057368388
Energy: 1.246326285420768
Energy: 1.2524569823942768
Energy: 1.2522783613409025
Energy: 1.732779335108074
Energy: 1.2527882780529764
Energy: 1.252994482504091
Energy: 1.2605179980446282
Energy: 1.2525439725620664
Energy: 1.2520105594273534
Energy: 1.534109395359325
Energy: 1.2162906681703152
Energy: 1.2600536826669033
Energy: 1.2605436173178965
Energy: 1.2151146450540316
Energy: 1.2164284773322096
Energy: 1.4995910741677734
Energy: 1.216009315319384
Energy: 1.1477271292205935
Energy: 1.1625500273205003
Energy: 1.2160915337083822
Energy: 1.2154914564916608
Energy: 1.7351290604254175
Energy: 1.2246837243618283
Energy: 1.147594119829422
Energy: 1.1642666816784961
Energy: 1.2152793320370487
Energy: 1.2518086434326123
Energy: 1.7368920949532072
Energy: 1.2180526781305376
Energy: 1.0990027857088476
Energy: 1.138156905802641
Energy: 1.1002319259038895
Energy: 1.2482539239004622
Energy: 1.7214232071937372
Energy: 1.0949493625564344
Energy: 1.0945769772308882
Energy: 1.0018054175461326
Energy: 1.0948823143185593
Energy: 1.2148952731361675
Energy: 1.7349701486506774
Energy: 1.0997906609771826
Energy: 1.0946683615949266
Energy: 1.005065409202226
Energy: 1.0992577930003216
Energy: 1.2483398264978762
Energy: 1.7347235231476084
Energy: 1.2073005762632891
Energy: 1.0039067573248586
Energy: 1.0034323808559094
Energy: 1.1853595916343718
Energy: 1.2479406097862946
Energy: 1.7098085978649538
Energy: 1.093839637599979
Energy: 1.0053814370407768
Energy: 1.0054227088604852
Energy: 1.09427693545256
Energy: 1.1771941587690486

minimum gb energy = 1.0018054175461326 eV
minimum distance =  2.16740850068374 Angstroms
sigma value = 33


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

Energy: 1.8105252423453297
Energy: 0.962141456163186
Energy: 0.8958406168872872
Energy: 1.0343586481130471
Energy: 0.899025591414544
Energy: 1.0877527917348937
Energy: 2.0383456747166746
Energy: 1.07941043775782
Energy: 0.9681529620652197
Energy: 0.9802372086315467
Energy: 0.97984854437775
Energy: 1.0773903189824559
Energy: 2.0448880181969984
Energy: 1.077566986848023
Energy: 1.0497674896674032
Energy: 1.0049515313324335
Energy: 1.0517760800768705
Energy: 1.092845401700494
Energy: 1.7069065354562423
Energy: 1.0506281270918727
Energy: 0.9938018530748363
Energy: 1.0020770724499568
Energy: 1.050510148871762
Energy: 1.0751936921806335
Energy: 1.7662943559475481
Energy: 1.0505153124352131
Energy: 1.0502329970939088
Energy: 1.0755860984996246
Energy: 1.0516337896864232
Energy: 1.0778254268975063
Energy: 2.01476263883798
Energy: 1.092987243166335
Energy: 1.0940796958407193
Energy: 1.0755753249318156
Energy: 1.0934411601298653
Energy: 1.0931737373259212
Energy: 1.8774132868731839
Energy: 1.1212853404398972
Energy: 1.09400147397195
Energy: 1.1063859883108398
Energy: 1.0921058653182878
Energy: 1.1214671062456467
Energy: 1.5823193544200618
Energy: 1.0939862669387983
Energy: 1.0919733380888408
Energy: 1.0807650469291499
Energy: 1.093382504076532
Energy: 1.1047802852631181
Energy: 1.8566799332725188
Energy: 1.1058341622689898
Energy: 1.092112373837957
Energy: 1.0934355779052447
Energy: 1.1235939259899987
Energy: 1.1099037506927047
Energy: 1.7089642097781237
Energy: 1.10680231851429
Energy: 1.1051318885669004
Energy: 1.1076273827212324
Energy: 1.1069333891799396
Energy: 1.1077645896180401
Energy: 1.387568371244199
Energy: 1.1060057036901838
Energy: 1.1060686879756074
Energy: 1.1205817313484028
Energy: 1.1078916293673484
Energy: 1.1051429927827376
Energy: 1.3932920765635481
Energy: 1.1052876522378847
Energy: 1.1053237038564978
Energy: 1.106613128094907
Energy: 1.106683880718836
Energy: 1.105322726133776
Energy: 1.5422234500277632
Energy: 1.093924175799892
Energy: 1.1234550292500054
Energy: 1.1058788781185174
Energy: 1.0932231398851446
Energy: 1.0937467904070186
Energy: 1.2410509105374412
Energy: 1.0948158729144326
Energy: 1.0940485954992671
Energy: 1.1049554425572745
Energy: 1.0927869599520506
Energy: 1.0932465030602205
Energy: 1.2458055721145191
Energy: 1.093350239102516
Energy: 1.1279313510902615
Energy: 1.1090826747537939
Energy: 1.1213012427574913
Energy: 1.1137746538247935
Energy: 1.242681246051831
Energy: 1.0995275733477912
Energy: 1.0963910208474936
Energy: 1.106108663010875
Energy: 1.092583392209936
Energy: 1.0759832745141693
Energy: 1.2346817604018137
Energy: 1.0755466590635232
Energy: 1.0923709183274564
Energy: 1.0929945074089966
Energy: 1.0506291329952357
Energy: 1.0762429971483713
Energy: 1.0398079130487052
Energy: 1.0516830557646588
Energy: 1.05262183458833
Energy: 1.1083380252728012
Energy: 1.0518639126161125
Energy: 0.9933464708264461
Energy: 1.0318293558593747
Energy: 0.994021860710168
Energy: 1.077965532616752
Energy: 1.0920854241677005
Energy: 1.0518763595056293
Energy: 1.0035213423022498
Energy: 0.9912109434268301
Energy: 0.9609943712266625
Energy: 0.9800417282456804
Energy: 1.0949929595814631
Energy: 0.9596373919618448
Energy: 0.9800754163941143
Energy: 0.8938398445591573
Energy: 0.959322441366241
Energy: 1.0531084564434277
Energy: 1.0919612256656486
Energy: 0.9621890602535256
Energy: 0.9016908985554811
Energy: 0.8996203714152999
Energy: 0.9589474174201783
Energy: 1.0773856794586334
Energy: 1.0774861473932043
Energy: 1.024118127017519
Energy: 0.9019755533025682
Energy: 0.8993846459761866
Energy: 0.9594933965799796
Energy: 1.0796977248142117
Energy: 1.0929720736892476
Energy: 1.0434476886520414
Energy: 0.8986428809152528
Energy: 0.8935532822392317
Energy: 0.899631123437186
Energy: 1.0773797105445961
Energy: 1.0751204253155027
Energy: 0.9601755316684704
Energy: 0.9037765738626515
Energy: 0.9934050583490346
Energy: 0.9594152945079891
Energy: 1.0812030466831504
Energy: 1.1051021354445527
Energy: 0.9785306997750346
Energy: 0.9810391583815574
Energy: 1.0333498354225388
Energy: 1.0507367921252855
Energy: 1.0790229864317136
Energy: 1.0927079498272503
Energy: 1.05025900486168
Energy: 1.003374753934197
Energy: 1.03786905078135
Energy: 1.0519546073871386
Energy: 1.0496196810539227
Energy: 1.122796767464542
Energy: 1.0504157807407533
Energy: 1.0127549297435454
Energy: 1.233275152353821
Energy: 1.0514244138049842
Energy: 1.0760142390704823
Energy: 1.103153951190774
Energy: 1.0498986941851334
Energy: 1.0749064098111072
Energy: 1.283523990482187
Energy: 1.1079718247870554
Energy: 1.0934720733063799
Energy: 1.1053350729705018
Energy: 1.0940154152927053
Energy: 1.128406976470002
Energy: 1.2506342015900693
Energy: 1.0938740983358513
Energy: 1.1202124496879744
Energy: 1.1067503195638224
Energy: 1.121702168199677
Energy: 1.0922663423107148
Energy: 1.2905312820177248
Energy: 1.0921297641844037
Energy: 1.1031795286102086
Energy: 1.1023987650079259
Energy: 1.094875072621187
Energy: 1.0927330162268005
Energy: 1.5517982505119374
Energy: 1.0914818284291452
Energy: 1.1310351142642276
Energy: 1.1084607680703997
Energy: 1.1219431775087199
Energy: 1.0927102049094672
Energy: 1.552545566078542
Energy: 1.107529143128683
Energy: 1.1058100051040511
Energy: 1.107171349715888
Energy: 1.1066558322451405
Energy: 1.106473983492674
Energy: 1.5498811146060656
Energy: 1.1057991836301733
Energy: 1.1054855503047247
Energy: 1.1021373897799749
Energy: 1.1064537146439117
Energy: 1.1061086881970794
Energy: 1.8690032880548981
Energy: 1.1058282284686412
Energy: 1.1056748027070402
Energy: 1.1051990097811777
Energy: 1.1076209832641388
Energy: 1.106366080347122
Energy: 1.8807602734202433
Energy: 1.1339738962559032
Energy: 1.091542474573454
Energy: 1.0940868451928616
Energy: 1.0925309958651626
Energy: 1.1094417782683628
Energy: 1.5642138821338216
Energy: 1.0930771281048914
Energy: 1.0916792152043013
Energy: 1.1031624646837466
Energy: 1.0934530877435897
Energy: 1.105903682115392
Energy: 1.8635083604628235
Energy: 1.1400805211251674
Energy: 1.1109459362994472
Energy: 1.1130641880022882
Energy: 1.1009760291482447
Energy: 1.1305897912927165
Energy: 2.0401460419971267
Energy: 1.0930429683996021
Energy: 1.1200306863052758
Energy: 1.0761256047228032
Energy: 1.0923155603567265
Energy: 1.094069656497581
Energy: 1.871143207766527
Energy: 1.0518966805520453
Energy: 1.0762880185563999
Energy: 1.0757890640276915
Energy: 1.050730025097935
Energy: 1.0927219124339205
Energy: 1.8734941317584244
Energy: 1.0529770351967194
Energy: 0.9939009304848485
Energy: 1.004217554211188
Energy: 1.0514820109037435
Energy: 1.0533183655077507
Energy: 2.040177036825612
Energy: 1.0772117728488466
Energy: 0.9941682722111551
Energy: 1.010493206026529
Energy: 1.0513316547960456
Energy: 1.0793613827907322
Energy: 2.031846987401829
Energy: 0.9939755578384096
Energy: 0.9855883583907733
Energy: 0.9816749481895182
Energy: 0.9598597931812735
Energy: 1.0786862663089747
Energy: 1.8727798865643517
Energy: 0.9641320389180248
Energy: 0.9011231110568741
Energy: 0.8959440922929768
Energy: 0.9604698220471086
Energy: 1.0924257678359153
Energy: 2.0210368429180723
Energy: 1.0785873920908544
Energy: 0.9602496772447121
Energy: 0.8994277904756628
Energy: 0.9594997313087396
Energy: 1.0778557660765338
Energy: 2.0125057960546906
Energy: 1.0782426049183973
Energy: 0.8980966922319213
Energy: 0.9011985359463038
Energy: 0.9592706673677965
Energy: 1.0780459473698878
Energy: 2.031066431015045
Energy: 0.9619373866140438
Energy: 0.8990096968060922
Energy: 0.8944874703899246
Energy: 0.9618207804913045
Energy: 1.0773538468457122

minimum gb energy = 0.8935532822392317 eV
minimum distance =  2.22840994343626 Angstroms
sigma value = 67


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

Energy: 0.34242595635348644
Energy: 0.40978054215599014
Energy: 0.42353645530289386
Energy: 0.42381286331860357
Energy: 0.40894698215773373
Energy: 0.29240740772507756
Energy: 1.4968422188831325
Energy: 0.4228090441073051
Energy: 0.4074245267810501
Energy: 0.4074440102864359
Energy: 0.42134566864292966
Energy: 0.42280201156413466
Energy: 1.4812980700332032
Energy: 0.407364419643399
Energy: 0.40727096291307696
Energy: 0.4075881158363847
Energy: 0.40676438549429844
Energy: 0.40726372285421625
Energy: 0.27619606201684543
Energy: 0.40692500637791473
Energy: 0.40761560925192386
Energy: 0.40766487560224157
Energy: 0.4064131477869044
Energy: 0.2755633013464381
Energy: 0.2754628217717654
Energy: 0.4063582147281543
Energy: 0.407093632671697
Energy: 0.4075426305861264
Energy: 0.4058303526882242
Energy: 0.2754864349966766
Energy: 1.4803923709891051
Energy: 0.4069414733121816
Energy: 0.4075979198800358
Energy: 0.40758381157625295
Energy: 0.40673541824530257
Energy: 0.40761641956003025
Energy: 0.27548361953421335
Energy: 0.42321477392589124
Energy: 0.40752017990187983
Energy: 0.407784330450731
Energy: 0.40758772392723885
Energy: 0.42296695501162757

minimum gb energy = 0.2754628217717654 eV
minimum distance =  2.40723490897801 Angstroms
sigma value = 3


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

Energy: 2.1009680225556187
Energy: 0.9645244518472501
Energy: 0.8801643216356265
Energy: 1.0514586002486042
Energy: 1.1706575987325925
Energy: 1.0756154192838727
Energy: 1.9881196377665793
Energy: 1.0139532946197807
Energy: 0.8669279050501724
Energy: 0.8695639620077931
Energy: 0.8669886589249333
Energy: 1.066114313063553
Energy: 1.722965102919756
Energy: 1.0095783083437855
Energy: 0.8723587921244104
Energy: 0.8744034041106429
Energy: 0.8719360799485515
Energy: 1.0480639054581298
Energy: 2.215069158960546
Energy: 0.9630928560896875
Energy: 0.8664689432698293
Energy: 0.8741192308282938
Energy: 0.8659989604463327
Energy: 1.0502937302040003
Energy: 2.2157191793356716
Energy: 0.962075385634028
Energy: 0.9652543804505583
Energy: 0.9691945630704468
Energy: 0.9620508240392874
Energy: 1.055082741692194
Energy: 1.6663563463267848
Energy: 1.0427507074617766
Energy: 0.9636967635113588
Energy: 0.9740736210382083
Energy: 0.9626931789612917
Energy: 1.0612177195438564
Energy: 1.9761856022623472
Energy: 1.064570310297953
Energy: 0.9688337805743736
Energy: 0.9761089939293477
Energy: 0.9722819331958873
Energy: 1.062914781292531
Energy: 1.8885943087533819
Energy: 1.0679651655863809
Energy: 1.0691736583851017
Energy: 1.1274126221881529
Energy: 1.061338859496544
Energy: 1.0803697346715841
Energy: 1.9851351085506703
Energy: 1.0681584060754157
Energy: 1.0661417675415623
Energy: 1.0697682289130317
Energy: 1.0789460663583001
Energy: 1.0638115665748222
Energy: 1.666068981496926
Energy: 1.0861831353119884
Energy: 1.0620109768052046
Energy: 1.0702738362498216
Energy: 1.0601970449569074
Energy: 1.095382069272755
Energy: 1.9183845953134133
Energy: 1.0847544871201407
Energy: 1.0997668288549827
Energy: 1.1571079544326146
Energy: 1.093496691626351
Energy: 1.0832153238047055
Energy: 1.8896992188843116
Energy: 1.0852868309591595
Energy: 1.090738930348068
Energy: 1.0980054827098484
Energy: 1.0924227968842173
Energy: 1.0954002884113925
Energy: 1.7996681265505645
Energy: 1.0930021722243963
Energy: 1.0866898594812247
Energy: 1.0817501494320276
Energy: 1.0960199334807696
Energy: 1.125801313913285
Energy: 1.8033064793265388
Energy: 1.0906145800622626
Energy: 1.1173511305043324
Energy: 1.120045592654257
Energy: 1.1050813624970246
Energy: 1.091085569845663
Energy: 1.6193992001238895
Energy: 1.0924069984483058
Energy: 1.1208124391813983
Energy: 1.1483738166926756
Energy: 1.100493954315255
Energy: 1.0915638800247764
Energy: 1.5349405686183266
Energy: 1.1203326973244236
Energy: 1.0910139984437006
Energy: 1.0906560447557947
Energy: 1.0927332181744196
Energy: 1.1078212501898634
Energy: 1.519520554407005
Energy: 1.1247617728604138
Energy: 1.0964786991752808
Energy: 1.096281317002746
Energy: 1.0938626946202732
Energy: 1.103222017634533
Energy: 1.5334625949912903
Energy: 1.085654833384513
Energy: 1.0876654122434168
Energy: 1.1333734840792136
Energy: 1.082076246462913
Energy: 1.0816890772510892
Energy: 1.5173023026480021
Energy: 1.0896875773170016
Energy: 1.0806359583636214
Energy: 1.0952446921952037
Energy: 1.0874195767930106
Energy: 1.0961407572637323
Energy: 1.2579643502555542
Energy: 1.055694860743938
Energy: 1.0854984724676289
Energy: 1.0899243899350406
Energy: 1.0812401797278581
Energy: 1.0628395746970036
Energy: 1.2439282689403923
Energy: 1.034116037490673
Energy: 1.113468370555521
Energy: 1.1104944152649256
Energy: 1.0300109629311038
Energy: 1.029734233352353
Energy: 1.2542981217303262
Energy: 1.0294085354091957
Energy: 1.0988600665239634
Energy: 1.1661951741068293
Energy: 1.0299745298086307
Energy: 1.034554538591428
Energy: 1.047863509199367
Energy: 1.0361705240923462
Energy: 1.070149954559577
Energy: 1.0865553682509281
Energy: 1.0311058538550122
Energy: 1.036076312307757
Energy: 1.050122570912172
Energy: 1.022369901184661
Energy: 1.0794816317107172
Energy: 1.0718393835734537
Energy: 1.030602013624165
Energy: 1.0242128810171494
Energy: 1.0379445869846726
Energy: 1.0072771184692046
Energy: 1.04619874860255
Energy: 1.1026854208316033
Energy: 1.000491655401783
Energy: 1.0152880554527288
Energy: 1.0245915632401212
Energy: 0.994326205541803
Energy: 1.0380869733404408
Energy: 1.0725268785253876
Energy: 1.0420161335323446
Energy: 0.997161317124106
Energy: 0.9112273293380585
Energy: 0.9057734893798103
Energy: 1.0448122566391325
Energy: 1.0733108562933706
Energy: 1.0377848058788692
Energy: 0.9068207701906745
Energy: 0.9256515818508644
Energy: 0.9183825116902291
Energy: 1.0481823900696021
Energy: 1.0853161830130162
Energy: 0.9223252096508509
Energy: 0.9295713804569464
Energy: 0.930040007394907
Energy: 0.9297064077628632
Energy: 1.059159033778523
Energy: 1.0965293661616378
Energy: 0.9288506835269029
Energy: 0.9241595670821248
Energy: 1.0196626820180585
Energy: 0.9291753976922927
Energy: 1.0498884654872636
Energy: 1.0830065803499955
Energy: 0.9297533230221396
Energy: 0.9299504672247056
Energy: 1.0031134781532967
Energy: 0.928367265058421
Energy: 1.090876454418723
Energy: 1.1476141885963391
Energy: 0.9302981581997205
Energy: 0.9288594388174188
Energy: 0.9962567725493237
Energy: 0.9283671113277866
Energy: 1.0884354474773585
Energy: 1.0858344667282172
Energy: 0.9284760157809381
Energy: 0.928500369397713
Energy: 0.992484966872593
Energy: 0.9350516069279343
Energy: 1.0604210910950138
Energy: 1.09126229749081
Energy: 1.057536936465662
Energy: 0.9356928354404442
Energy: 1.2269808780239413
Energy: 1.0642593793548905
Energy: 1.0589891732934256
Energy: 1.0779172433712219
Energy: 1.0605698625639919
Energy: 1.0611234075155553
Energy: 1.2354983916855786
Energy: 1.0574784331602893
Energy: 1.0967031198240693
Energy: 1.1275839557516774
Energy: 1.059913690434518
Energy: 1.0611876848149338
Energy: 1.2449411839100524
Energy: 1.0923613340647456
Energy: 1.1021583126622136
Energy: 1.1032389585600297
Energy: 1.0840810484979748
Energy: 1.096809540604409
Energy: 1.5279396811420773
Energy: 1.0922283072952261
Energy: 1.087392507550692
Energy: 1.0923885436231588
Energy: 1.0865014033002676
Energy: 1.1032839264330692
Energy: 1.4665489480255105
Energy: 1.090139451576426
Energy: 1.1222490489004728
Energy: 1.099652592563597
Energy: 1.1210896256045766
Energy: 1.0847467401340953
Energy: 1.5131927643761487
Energy: 1.0845422433848195
Energy: 1.1018064045164109
Energy: 1.105856701884091
Energy: 1.1083408960775254
Energy: 1.0953924405036422
Energy: 1.5379948798275345
Energy: 1.098506898119818
Energy: 1.0910655748827467
Energy: 1.088275845013665
Energy: 1.100143831606773
Energy: 1.1176241892579004
Energy: 1.7502890260806907
Energy: 1.1090940371464841
Energy: 1.09982781217411
Energy: 1.1050965382261397
Energy: 1.1006266767290867
Energy: 1.0936713057118472
Energy: 1.7544231251857838
Energy: 1.0907732743735477
Energy: 1.1045075409722398
Energy: 1.1169609881078348
Energy: 1.104927349385367
Energy: 1.0914424313711593
Energy: 1.6620185570372907
Energy: 1.1036897215413268
Energy: 1.0863395430827736
Energy: 1.086805733425637
Energy: 1.0846381358071193
Energy: 1.100133494809796
Energy: 1.9585636823514287
Energy: 1.0856732408197587
Energy: 1.0922986796205119
Energy: 1.0883131938649298
Energy: 1.093321051022473
Energy: 1.1090208586851331
Energy: 1.7609989664846284
Energy: 1.0858906491029199
Energy: 1.0919952718673815
Energy: 1.1084724187929387
Energy: 1.0925462458820445
Energy: 1.0864867333480936
Energy: 1.8660453491830875
Energy: 1.0881095611392901
Energy: 1.095921365298972
Energy: 1.0956035093772498
Energy: 1.102275757216148
Energy: 1.0923597341225948
Energy: 1.725734976331354
Energy: 1.0711424342874918
Energy: 1.07014048918473
Energy: 1.0725270076459104
Energy: 1.0590027804638287
Energy: 1.0814593987724896
Energy: 2.059635616675123
Energy: 1.0601174659779156
Energy: 1.059664217029424
Energy: 1.0816937098062607
Energy: 1.059630200939201
Energy: 1.0685504853032852
Energy: 2.0598913631335427
Energy: 1.0605176120322795
Energy: 0.9690127662004602
Energy: 0.9850493812844677
Energy: 0.9781355735407185
Energy: 1.0693704316616204
Energy: 1.7250617534392905
Energy: 1.026209312991428
Energy: 0.9600735962342312
Energy: 0.9619553345235402
Energy: 0.9589768447651739
Energy: 1.083044064586416
Energy: 2.0543931056105644
Energy: 0.9718360076803747
Energy: 0.9603962382954961
Energy: 0.982507246155155
Energy: 0.9622804714821339
Energy: 1.0688962168936824

minimum gb energy = 0.8659989604463327 eV
minimum distance =  2.22733455371726 Angstroms
sigma value = 81


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

Energy: 2.2709664112316186
Energy: 1.0965861206058811
Energy: 0.994189053288319
Energy: 0.9752888729182497
Energy: 1.1201635954603069
Energy: 1.2353251125306077
Energy: 1.7236290829634437
Energy: 1.1136833299968665
Energy: 0.9711103553215737
Energy: 0.9699841858261891
Energy: 0.9730270752704632
Energy: 1.2215355076576033
Energy: 1.7035930181130912
Energy: 1.0472634360772428
Energy: 0.9770803045622468
Energy: 0.9763623217789099
Energy: 0.9767297818125273
Energy: 1.206497658844923
Energy: 1.7276167313276338
Energy: 1.0956582069042151
Energy: 0.9735206772830679
Energy: 0.9767074039881091
Energy: 0.9734900224845695
Energy: 1.206521700665434
Energy: 1.7277331217567644
Energy: 1.0954143935519347
Energy: 1.0994963429482796
Energy: 1.1128023125748383
Energy: 1.0979469213953696
Energy: 1.2062281149571954
Energy: 1.6913746943742758
Energy: 1.0972920598959883
Energy: 1.0979016632276635
Energy: 1.11575514882498
Energy: 1.0969401525811369
Energy: 1.249044109553335
Energy: 1.7230471802266887
Energy: 1.224682989412775
Energy: 1.1036791388897378
Energy: 1.1106735573660778
Energy: 1.1014774031999353
Energy: 1.2245995839305652
Energy: 1.8005472972669527
Energy: 1.2192408645558273
Energy: 1.2670907928398174
Energy: 1.1192271171542347
Energy: 1.24380526299315
Energy: 1.2309326958793685
Energy: 1.6904294955674666
Energy: 1.2523017568971302
Energy: 1.2254801338680936
Energy: 1.2208099901882101
Energy: 1.2270314285597324
Energy: 1.2311139561116762
Energy: 1.695276988228164
Energy: 1.2327867854044463
Energy: 1.2256924835039622
Energy: 1.2313975104593806
Energy: 1.2247594563460782
Energy: 1.2403450944618435
Energy: 1.5840805709415762
Energy: 1.2330543955670352
Energy: 1.2467108678904057
Energy: 1.2420571586656444
Energy: 1.2413229675496955
Energy: 1.2324516054396355
Energy: 1.6851925190442552
Energy: 1.2434036163547209
Energy: 1.2471832262294107
Energy: 1.230350867905568
Energy: 1.2474606620809776
Energy: 1.2440451095078655
Energy: 1.5093750863457056
Energy: 1.2143781721672113
Energy: 1.2328341353072951
Energy: 1.2315850242691915
Energy: 1.2423172202382997
Energy: 1.1899303653622482
Energy: 1.4981986775926566
Energy: 1.188727381220251
Energy: 1.240854095880186
Energy: 1.2259308398178788
Energy: 1.1880783807113042
Energy: 1.1877911862072479
Energy: 1.5038808179787915
Energy: 1.188254584359324
Energy: 1.2407188194694825
Energy: 1.3232541685984522
Energy: 1.1803531219255652
Energy: 1.1832095018594913
Energy: 1.3085848168472543
Energy: 1.1881002433078667
Energy: 1.2225223372340535
Energy: 1.242081944834974
Energy: 1.1884978913874902
Energy: 1.2025856211753778
Energy: 1.2196519979522729
Energy: 1.1706869220632563
Energy: 1.1885623338120503
Energy: 1.292443068796307
Energy: 1.181298840753761
Energy: 1.1704957441914812
Energy: 1.2011752748115714
Energy: 1.1486253199587597
Energy: 1.1946879605049114
Energy: 1.2589805031805097
Energy: 1.1491567092927935
Energy: 1.149002060989675
Energy: 1.1926481112962453
Energy: 1.140311698942852
Energy: 1.1947463334046293
Energy: 1.2230704962821084
Energy: 1.195207932960188
Energy: 1.1405540082659913
Energy: 1.039419487016219
Energy: 1.0236924885889145
Energy: 1.194419225575437
Energy: 1.2226347000541034
Energy: 1.1939380343443362
Energy: 1.0240666587760099
Energy: 1.0523940885766871
Energy: 1.038334923838336
Energy: 1.1966723556264507
Energy: 1.269444737150528
Energy: 1.036939060463433
Energy: 1.039384005411856
Energy: 1.0584820217887778
Energy: 1.045059189128389
Energy: 1.2211773044656273
Energy: 1.2281821478104984
Energy: 1.0693823305216026
Energy: 1.0447915684167883
Energy: 1.0739391316350644
Energy: 1.0712933420056454
Energy: 1.2193292048673736
Energy: 1.249865852708244
Energy: 1.063416998060741
Energy: 1.071773701126761
Energy: 1.1539672361593396
Energy: 1.0542535804643225
Energy: 1.2222249957147189
Energy: 1.2869684995898871
Energy: 1.0690619268468706
Energy: 1.0565893248406437
Energy: 1.1471789659499476
Energy: 1.0532262053250794
Energy: 1.21937255982481
Energy: 1.2875138038506448
Energy: 1.0539890146822894
Energy: 1.0555174458161753
Energy: 1.1525270359858986
Energy: 1.0720727348969488
Energy: 1.2183506126541666
Energy: 1.2303939747529204
Energy: 1.2195413009646197
Energy: 1.0516849356608613
Energy: 1.4850288660777244
Energy: 1.2198987775967942
Energy: 1.2172912526765418
Energy: 1.2292333768559596
Energy: 1.2170165151509487
Energy: 1.2219521045813997
Energy: 1.3710908175576437
Energy: 1.2183831837277896
Energy: 1.2179567602915964
Energy: 1.304808958489332
Energy: 1.218940684718419
Energy: 1.2184218977513586
Energy: 1.4768408130065909
Energy: 1.2323965405030102
Energy: 1.2374809682965653
Energy: 1.244270531523076
Energy: 1.2375902190506958
Energy: 1.2353484943786532
Energy: 1.496310168443036
Energy: 1.2677751755705082
Energy: 1.2384713786920536
Energy: 1.2310201265829226
Energy: 1.2495344092309373
Energy: 1.254345220842574
Energy: 1.779612698905144
Energy: 1.2539440892799096
Energy: 1.268827964380343
Energy: 1.334601256602496
Energy: 1.2437315403819675
Energy: 1.2307467308589
Energy: 1.6982045572870972
Energy: 1.2438896778862323
Energy: 1.2284912436720627
Energy: 1.2378455676938125
Energy: 1.2541388768364718
Energy: 1.2386856561440582
Energy: 1.6893726891596217
Energy: 1.228683185387828
Energy: 1.2211140887701601
Energy: 1.25346050492164
Energy: 1.2278374634982048
Energy: 1.2449908415508262
Energy: 1.7283449529687007
Energy: 1.2299419354456258
Energy: 1.2263920328739744
Energy: 1.2559696761713954
Energy: 1.2292756979981851
Energy: 1.2329566441124642
Energy: 1.7771153070847994
Energy: 1.2208709266068047
Energy: 1.121487804226875
Energy: 1.1207503457668195
Energy: 1.1830310005747626
Energy: 1.2256587206469642
Energy: 1.7044237923980567
Energy: 1.198841376908442
Energy: 1.0942527446901154
Energy: 1.095449248343262
Energy: 1.0937162186178453
Energy: 1.2509123790113488
Energy: 1.6920836464914613
Energy: 1.162452927741138
Energy: 1.0980641857312932
Energy: 1.0976756634253957
Energy: 1.0974284085127046
Energy: 1.2180134752362826
Energy: 1.7229264027419295
Energy: 1.093903013835268
Energy: 1.104836039123136
Energy: 0.9927423374403503
Energy: 1.0954145891847205
Energy: 1.222575694112798

minimum gb energy = 0.9699841858261891 eV
minimum distance =  2.24549595261398 Angstroms
sigma value = 43


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

Energy: 1.9808409296296583
Energy: 1.1964975328213472
Energy: 1.042073270918868
Energy: 1.0419106901074882
Energy: 1.1965352617715144
Energy: 1.3472010838776416
Energy: 1.5017240043374938
Energy: 1.1908077449329462
Energy: 1.042846804362457
Energy: 1.0404236534475861
Energy: 1.045727032014541
Energy: 1.3247878815950385
Energy: 1.4730808292233415
Energy: 1.1896442679032981
Energy: 1.0471343604553813
Energy: 1.0458768333686022
Energy: 1.04717181460156
Energy: 1.3178628756116975
Energy: 1.7111068734046604
Energy: 1.1894903591873425
Energy: 1.039323695272958
Energy: 1.0388705633765165
Energy: 1.041069214253281
Energy: 1.3268364161321113
Energy: 1.713936662273297
Energy: 1.1893455217176399
Energy: 1.1999238846127984
Energy: 1.195700754423688
Energy: 1.1867554400704265
Energy: 1.333287896645215
Energy: 1.474878951033489
Energy: 1.1889583758354192
Energy: 1.1960046231551607
Energy: 1.1891573103797688
Energy: 1.1906313373716284
Energy: 1.3603439244132016
Energy: 1.5024331289347024
Energy: 1.348785115274084
Energy: 1.190347060975641
Energy: 1.1907804740942611
Energy: 1.1974689119953128
Energy: 1.340262226212835
Energy: 1.6764468468351952
Energy: 1.3316224752901364
Energy: 1.3591983073472345
Energy: 1.2615103728579946
Energy: 1.3383045470378767
Energy: 1.3319820611760516
Energy: 1.5016579280489677
Energy: 1.3579202457268704
Energy: 1.3349939017932912
Energy: 1.3230397699862666
Energy: 1.3346193499874213
Energy: 1.3363601153110514
Energy: 1.4638762531671998
Energy: 1.3394566861743211
Energy: 1.332340628541061
Energy: 1.336564797185318
Energy: 1.3341206963200176
Energy: 1.3438475243708325
Energy: 1.4639340114227437
Energy: 1.3296079949092938
Energy: 1.3542729482287037
Energy: 1.360956413501772
Energy: 1.3340137926279538
Energy: 1.3454199115523424
Energy: 1.6848902201291187
Energy: 1.3268430400395317
Energy: 1.3339067759186687
Energy: 1.3424412853572094
Energy: 1.3340776394701377
Energy: 1.3286703915363975
Energy: 1.2349837586520256
Energy: 1.213913117338804
Energy: 1.3303163504149536
Energy: 1.3318453627896072
Energy: 1.3284651730366255
Energy: 1.191321372732941
Energy: 1.2342937160223089
Energy: 1.1930149911967467
Energy: 1.3602157943507176
Energy: 1.3543791485601306
Energy: 1.3202726892698335
Energy: 1.1898510146017642
Energy: 1.2357680947501468
Energy: 1.1895023141655274
Energy: 1.3165853142343495
Energy: 1.3461012587777021
Energy: 1.2174939202097004
Energy: 1.1942001487143679
Energy: 1.0414733508372267
Energy: 1.199718258767974
Energy: 1.3207559626351497
Energy: 1.3472685694559208
Energy: 1.1890955689085647
Energy: 1.1972596925193106
Energy: 1.040969877471757
Energy: 1.042515317819689
Energy: 1.3228302753157561
Energy: 1.394952427050145
Energy: 1.1895407387119044
Energy: 1.0414612237053025
Energy: 1.0467120847425522
Energy: 1.0464054335977409
Energy: 1.3175384157510235
Energy: 1.3933605116931103
Energy: 1.0658547155583868
Energy: 1.0469024909259406
Energy: 1.0395288847221726
Energy: 1.0411559169132205
Energy: 1.1893454347214174
Energy: 1.332930618945997
Energy: 1.1888460127047937
Energy: 1.0393818209461485
Energy: 1.2782069185919533
Energy: 1.1970349955543798
Energy: 1.1898282402750777
Energy: 1.3225239949372327
Energy: 1.188929689172033
Energy: 1.1979303868561173
Energy: 1.2359924651046625
Energy: 1.1867523213570155
Energy: 1.3179549953063197
Energy: 1.340606549129671
Energy: 1.1889664848756971
Energy: 1.1895332329900838
Energy: 1.2615989267268861
Energy: 1.2001566576709546
Energy: 1.3405567460789245
Energy: 1.4542867079226574
Energy: 1.2134327859559804
Energy: 1.1972614419789522
Energy: 1.2341975878217222
Energy: 1.3437118990381833
Energy: 1.3429347066573616
Energy: 1.328345932517571
Energy: 1.3442937747810744
Energy: 1.2146718014797966
Energy: 1.4271012082882681
Energy: 1.3493645741889593
Energy: 1.334967430660634
Energy: 1.3708681220894783
Energy: 1.337434136100821
Energy: 1.3270790824624075
Energy: 1.4725485866975392
Energy: 1.349729626042838
Energy: 1.3405328202513282
Energy: 1.3495560381552913
Energy: 1.333923824174911
Energy: 1.3454720740615629
Energy: 1.4617584172192781
Energy: 1.3339025176698727
Energy: 1.3311293129666046
Energy: 1.3371064764240106
Energy: 1.3351400398249675
Energy: 1.3324822224949573
Energy: 1.425766364054456
Energy: 1.3348616918982774
Energy: 1.3268684352210383
Energy: 1.340601259419892
Energy: 1.32909327106649
Energy: 1.3343672358302252
Energy: 1.4204524765138036
Energy: 1.3276210322635014
Energy: 1.2143709072588282
Energy: 1.207359143272449
Energy: 1.3427832673405882
Energy: 1.3309055729651234
Energy: 1.4636378715726108
Energy: 1.3293732686858457
Energy: 1.190173550739752
Energy: 1.190246342783424
Energy: 1.1909362274078454
Energy: 1.361855071276712
Energy: 1.4641034166729188
Energy: 1.1930996781001895
Energy: 1.2122935457002104
Energy: 1.1883602121725965
Energy: 1.189196682572316
Energy: 1.3182973802462294
Energy: 1.92442773851173
Energy: 1.1904524027618013
Energy: 1.1973200247605849
Energy: 1.1974830213789933
Energy: 1.191916804872261
Energy: 1.3074182122755553

minimum gb energy = 1.0388705633765165 eV
minimum distance =  2.23073358611547 Angstroms
sigma value = 57


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

Energy: 1.7044108652979797
Energy: 1.3249491118367975
Energy: 1.1502314098680717
Energy: 1.1455929451929614
Energy: 1.3275888125311353
Energy: 1.4935313872835294
Energy: 1.4066465494049873
Energy: 1.3271854128978837
Energy: 1.1500402420793168
Energy: 1.1519104245169471
Energy: 1.1491290288743181
Energy: 1.4742721988661895
Energy: 1.6923496832954883
Energy: 1.3281909414894018
Energy: 1.1501595486717184
Energy: 1.1465166048325783
Energy: 1.1507183654887434
Energy: 1.4537971076184932
Energy: 1.6751978056258316
Energy: 1.3252977449810692
Energy: 1.1544046160224508
Energy: 1.1425943696924337
Energy: 1.1489457723440488
Energy: 1.4523751459295309
Energy: 1.678277089462929
Energy: 1.3214679784155137
Energy: 1.3269982110126821
Energy: 1.1606024122941876
Energy: 1.3264339399842695
Energy: 1.4511728047331496
Energy: 1.6906958049618863
Energy: 1.3277032620733753
Energy: 1.3155802233379879
Energy: 1.3217635897461109
Energy: 1.3161287458709616
Energy: 1.5025850035287236
Energy: 1.4067354719006746
Energy: 1.4808657268860923
Energy: 1.3383021691926287
Energy: 1.3295723572760747
Energy: 1.322064455022169
Energy: 1.4850330786963135
Energy: 1.4010320123461515
Energy: 1.4533934143454599
Energy: 1.488604195182066
Energy: 1.1492293804314224
Energy: 1.4974378133709754
Energy: 1.4541732044048523
Energy: 1.4043632908088048
Energy: 1.4974886200679698
Energy: 1.451168249993368
Energy: 1.4929828401291547
Energy: 1.5009472292133514
Energy: 1.4872021359936247
Energy: 1.4025667461125768
Energy: 1.3243681611403328
Energy: 1.453071284396173
Energy: 1.5900499767076328
Energy: 1.4539774737109776
Energy: 1.3299337414452612
Energy: 1.4108533943126955
Energy: 1.3294075544244768
Energy: 1.4535860271165568
Energy: 1.5220737614335613
Energy: 1.3239622328478182
Energy: 1.3450052036911548
Energy: 1.4077069371562727
Energy: 1.332559361142663
Energy: 1.322450657072646
Energy: 1.51444396295225
Energy: 1.3235609717097185
Energy: 1.332556824837113
Energy: 1.1446266895790522
Energy: 1.1460197865883728
Energy: 1.4505041732410229
Energy: 1.4502486237478407
Energy: 1.321499673548999
Energy: 1.1462588874196045
Energy: 1.1361918215697564
Energy: 1.150861558559828
Energy: 1.4547074316346627
Energy: 1.5218961867415053
Energy: 1.1654539036052696
Energy: 1.1677573423720409
Energy: 1.1386210622197939
Energy: 1.1491850427571415
Energy: 1.3425588743976278
Energy: 1.5248096546172383
Energy: 1.3418033990624234
Energy: 1.14498259013245
Energy: 1.1488112170936127
Energy: 1.3267549014609634
Energy: 1.4511955825119898
Energy: 1.451052311236946
Energy: 1.3250939083702546
Energy: 1.1484222795928554
Energy: 1.4021325007731742
Energy: 1.3278025998308398
Energy: 1.3434642926415643
Energy: 1.3291916008040734
Energy: 1.3256993490649336
Energy: 1.321567236523653
Energy: 1.4011960922999644
Energy: 1.326193791635548
Energy: 1.4920466017068155
Energy: 1.336698441159438
Energy: 1.3223929592965145
Energy: 1.3373434814302874
Energy: 1.4053913949625827
Energy: 1.3355106572852984
Energy: 1.4827004315990084
Energy: 1.4803500804826055
Energy: 1.4542190061874067
Energy: 1.3345540361926667
Energy: 1.4061503378820204
Energy: 1.4743483592494364
Energy: 1.4544599085985577
Energy: 1.4785820641558312
Energy: 1.454041906421782
Energy: 1.4990837633089336
Energy: 1.6802843441622028
Energy: 1.4761281200974312
Energy: 1.3336138604887517
Energy: 1.3295977609558265
Energy: 1.4740274349437517
Energy: 1.4512661371180482
Energy: 1.4110829297742136
Energy: 1.454275826010028
Energy: 1.331327580184284
Energy: 1.3290079614986219
Energy: 1.3213018192986832
Energy: 1.4955609238659697
Energy: 1.6906127035238574
Energy: 1.3255432683566093
Energy: 1.3597262158308487
Energy: 1.3336651004810918
Energy: 1.327632450301058
Energy: 1.4541055161938061
Energy: 1.1417004625642724
Energy: 1.3218819532907211
Energy: 1.327144242416601
Energy: 1.150546368754993
Energy: 1.3272490967450579
Energy: 1.4498284605397378

minimum gb energy = 1.1361918215697564 eV
minimum distance =  2.22994948043002 Angstroms
sigma value = 17


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

Energy: 2.323419179085119
Energy: 1.4780589407142717
Energy: 1.2811771017428615
Energy: 1.460861393210995
Energy: 1.479052143557515
Energy: 1.6365891121348493
Energy: 1.2671946745902154
Energy: 1.4911164036001738
Energy: 1.2695437944713817
Energy: 1.2694902007493265
Energy: 1.2744866981020948
Energy: 1.6394461029580036
Energy: 1.2805903408142032
Energy: 1.4877220253461159
Energy: 1.2888954236508674
Energy: 1.2611666259467813
Energy: 1.2845510521132577
Energy: 1.6466308288870806
Energy: 1.2505682061946877
Energy: 1.478352250888261
Energy: 1.2744801225289355
Energy: 1.2682641884662194
Energy: 1.4704151820781937
Energy: 1.476290242650044
Energy: 1.25079363706785
Energy: 1.4912434674794757
Energy: 1.4665757273532374
Energy: 1.2647290070324915
Energy: 1.4683433692628172
Energy: 1.4910787142964945
Energy: 1.2800046540913248
Energy: 1.4925809432386605
Energy: 1.4852392138491635
Energy: 1.224390412588108
Energy: 1.4879421498523047
Energy: 1.4803082996869927
Energy: 1.2683230070082103
Energy: 1.467003151650061
Energy: 1.4726976264764093
Energy: 1.268100410642369
Energy: 1.4747877271204264
Energy: 1.4660100854004234
Energy: 1.2714939116710846
Energy: 1.4870139240095748
Energy: 1.4952724189475757
Energy: 1.2825561991275858
Energy: 1.4867010823473645
Energy: 1.4842176095312285
Energy: 1.268811400820015
Energy: 1.4699043004187926
Energy: 1.638057503837284
Energy: 1.6297466495314625
Energy: 1.4769367678518492
Energy: 1.4687417998562742
Energy: 1.2692446312205445
Energy: 1.27850507496406
Energy: 1.4912368669107265
Energy: 1.2715343480899377
Energy: 1.468694598103541
Energy: 1.2776469340609347
Energy: 1.2574370148658114
Energy: 1.285345384850334
Energy: 1.4887994340751762
Energy: 1.2817988914883525
Energy: 1.2941809668320827
Energy: 1.2851415400756527
Energy: 1.2535946431260026
Energy: 1.2776625384461764
Energy: 1.492270920978222
Energy: 1.4500082439994129
Energy: 1.4671189881763762
Energy: 1.2744096727897478
Energy: 1.2846361034680924
Energy: 1.4768785725736837
Energy: 1.4831392157669123
Energy: 1.4506199934477488
Energy: 1.4815420951712308
Energy: 1.471176310045242
Energy: 1.2239958483974163
Energy: 1.4852901253933042
Energy: 1.4947327456323962
Energy: 1.2822141515429142
Energy: 1.4856797794814254
Energy: 1.2249965752698602
Energy: 1.268630985020285
Energy: 1.4665698584176332
Energy: 1.4668281459710222
Energy: 1.2884772070145094
Energy: 1.351903194676567
Energy: 1.466894886808527
Energy: 1.2815533210580443
Energy: 1.4871063172794035
Energy: 1.4871078799668838
Energy: 1.4680762564902377
Energy: 1.4933526015416312
Energy: 1.4734989353851853
Energy: 1.263454983677791
Energy: 1.475867750738335
Energy: 1.4671931884349523
Energy: 1.282922190207601
Energy: 1.4689222894716214
Energy: 1.6303931765498452

minimum gb energy = 1.2239958483974163 eV
minimum distance =  2.23223567245688 Angstroms
sigma value = 17


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

Energy: 1.683922222603584
Energy: 1.47866993136369
Energy: 1.3218702139058591
Energy: 1.5222041780445628
Energy: 1.3385892754077346
Energy: 1.7722515786351007
Energy: 1.33407148839658
Energy: 1.4667960339110149
Energy: 1.3144804031152089
Energy: 1.3131582068860217
Energy: 1.3164027636483016
Energy: 1.472536768687203
Energy: 1.3187749092090475
Energy: 1.4748416417491115
Energy: 1.3180431637420749
Energy: 1.3163628129833083
Energy: 1.316946208645623
Energy: 1.6616450044267304
Energy: 1.8425165511298416
Energy: 1.622643852763645
Energy: 1.321106416119182
Energy: 1.3417201856491487
Energy: 1.3186853804451
Energy: 1.6219226064008667
Energy: 1.4331375441022884
Energy: 1.700752315377349
Energy: 1.622013330168204
Energy: 1.3219367028360247
Energy: 1.702550037628067
Energy: 1.621391722466798
Energy: 1.3423620851392102
Energy: 1.3203167410700731
Energy: 1.66936360071173
Energy: 1.6882583912092417
Energy: 1.7225682904222641
Energy: 1.3361129851381996
Energy: 1.3305314553654488
Energy: 1.341647299912099
Energy: 1.6234648806606995
Energy: 1.3228101457843089
Energy: 1.4757689070678794
Energy: 1.3339242978183825
Energy: 1.3107473492377826
Energy: 1.314156421262343
Energy: 1.4726642031381358
Energy: 1.3346295676869517
Energy: 1.331202719711912
Energy: 1.318966339123056
Energy: 1.3211994798411082
Energy: 1.3287893647526783
Energy: 1.5567761116422747
Energy: 1.6244590281148965
Energy: 1.4644984355271433
Energy: 1.318203481404437
Energy: 1.50021192472895
Energy: 1.4612819429418225
Energy: 1.4693294621267752
Energy: 1.4178351574758195
Energy: 1.4674610196396953
Energy: 1.4618993699039493
Energy: 1.5014250732643863
Energy: 1.4692985178301163
Energy: 1.491279286953434
Energy: 1.3241931607931736
Energy: 1.4669975598948868
Energy: 1.465472834819399
Energy: 1.420490568512153
Energy: 1.469754947322798
Energy: 1.556359832182221
Energy: 1.418739947185858
Energy: 1.6335173936403014
Energy: 1.4678912833519138
Energy: 1.3670304158031847
Energy: 1.625624593815257
Energy: 1.6277227167928712
Energy: 1.417475188035727
Energy: 1.6255944177513366
Energy: 1.6537562887374846
Energy: 2.00644799614478
Energy: 1.5459200354562492
Energy: 1.5404663500704538
Energy: 1.2935186869374267
Energy: 1.5451243485212518
Energy: 1.7685876144364776
Energy: 1.5692407295757367
Energy: 1.5526856499098474
Energy: 1.2887971616210745
Energy: 1.2923279643172159
Energy: 1.2893266744261023
Energy: 1.6251085806266283
Energy: 1.367098518038676
Energy: 1.2992991114408903
Energy: 1.3089534304586519
Energy: 1.2952981427089454
Energy: 1.3000412349635833
Energy: 1.6658859564066557
Energy: 1.8332515342628992
Energy: 1.6494595512452865
Energy: 1.2934339014522107
Energy: 1.2930149633765708
Energy: 1.293926826123357
Energy: 1.6211539797072096
Energy: 1.8330437103896122
Energy: 1.648100441373623
Energy: 1.5608757151347445
Energy: 1.304575993763889
Energy: 1.557717594433423
Energy: 1.6199514911925175
Energy: 1.5460754737541464
Energy: 1.627207591315827
Energy: 1.6202772304315944
Energy: 1.2892967980210428
Energy: 1.6234879903694877
Energy: 1.31809977458745
Energy: 1.500538394618477
Energy: 1.4618777556914377
Energy: 1.5602120300777245
Energy: 1.4898477551007567
Energy: 1.624166860856823
Energy: 1.4582334132801356
Energy: 1.499460108760259
Energy: 1.4702027927972894
Energy: 1.468587068575532
Energy: 1.3319856305549003
Energy: 1.4677137497009884
Energy: 1.4621272902629483
Energy: 1.4601385366541626
Energy: 1.4674162131350628
Energy: 1.5743245377751478
Energy: 1.5137429598820278
Energy: 1.4610723906188765
Energy: 1.3165209893589795
Energy: 1.3137129682293132
Energy: 1.3182823952327265
Energy: 1.4667907270828497
Energy: 1.6583560310909444
Energy: 1.4699622195512843
Energy: 1.316809520120716
Energy: 1.3120910747073504
Energy: 1.3241138547549833
Energy: 1.4841338953131165
Energy: 1.3198145638704923
Energy: 1.325904968622195
Energy: 1.3164973239655868
Energy: 1.3267120464791506
Energy: 1.3157009648345224
Energy: 1.620987645231064
Energy: 1.4216675167695654
Energy: 1.620667180584665
Energy: 1.3178182249125865
Energy: 1.329697248974587
Energy: 1.7186791883714143
Energy: 1.6247189427044433
Energy: 1.417364992876834
Energy: 1.6270042027872278
Energy: 1.6870343199072912
Energy: 2.013732347119833
Energy: 1.6281953901760002
Energy: 1.7177061191960608
Energy: 1.3275567138454691
Energy: 1.7192050867932063
Energy: 1.6697827911477099
Energy: 2.0274108715628425
Energy: 1.6218032036491254
Energy: 1.3218465334159928
Energy: 1.3215252860097946
Energy: 1.3223993926067144
Energy: 1.6215054655039356
Energy: 1.3233450745294424
Energy: 1.3174362699418554
Energy: 1.3430917474766515
Energy: 1.308751829864346
Energy: 1.3180939638520353
Energy: 1.4539045731238198
Energy: 1.8328430388130281
Energy: 1.4670463426962255
Energy: 1.3193430749442232
Energy: 1.3145905461205125
Energy: 1.3154444464351944
Energy: 1.623425272552822
Energy: 1.8360570438959747
Energy: 1.4664434659315373
Energy: 1.4655613284612246
Energy: 1.4949643411628926
Energy: 1.4674852981264668
Energy: 1.6297341152466855
Energy: 1.3407038097707735
Energy: 1.4650774869351708
Energy: 1.4619084212519924
Energy: 1.3073593418782483
Energy: 1.4750582841940791
Energy: 1.4807923308081734
Energy: 1.4884342518628104
Energy: 1.5586088593380918
Energy: 1.4613586581208113
Energy: 1.4555486005108556
Energy: 1.4625452749297305
Energy: 1.5605428482496246
Energy: 1.8391179945307983
Energy: 1.6232501494500193
Energy: 1.5301230094306557
Energy: 1.3670337514607327
Energy: 1.62575277535642
Energy: 1.6238225631744185
Energy: 1.3942184255310497
Energy: 1.5611895811346435
Energy: 1.6884526368094108
Energy: 1.5444071924210936
Energy: 1.6462941650510992
Energy: 1.5596694858549467
Energy: 1.3045780768699833
Energy: 1.293326349498132
Energy: 1.634634531907391
Energy: 1.5448770818162143
Energy: 1.5546330916854112
Energy: 1.2931924018472516
Energy: 1.2902241378673867
Energy: 1.2956159575040407
Energy: 1.5877391463910937
Energy: 1.3664031519779478
Energy: 1.301553635109382
Energy: 1.2935971958845975
Energy: 1.2995412590260247
Energy: 1.293367894150625
Energy: 1.6243141792147064
Energy: 1.3159833789069597
Energy: 1.4187612610102691
Energy: 1.292130515640306
Energy: 1.37781333935316
Energy: 1.5424828936661903
Energy: 1.719040964113569
Energy: 1.6238480468920762
Energy: 1.5457994410966713
Energy: 1.3020441841211852
Energy: 1.66780749091123
Energy: 1.6244774101701203
Energy: 1.6242776919537738
Energy: 1.3714679403738366
Energy: 1.6250467070185173
Energy: 1.643491967130212
Energy: 1.4882312175650516
Energy: 1.6471276351012625
Energy: 1.466648627367617
Energy: 1.506460585635592
Energy: 1.5031859951968363
Energy: 1.555999541149554
Energy: 1.4839714680335705
Energy: 1.509779669566506
Energy: 1.461313621054938
Energy: 1.3100087543107823
Energy: 1.461733677799731
Energy: 1.575318172252806
Energy: 1.6572742804471554
Energy: 1.466345139606318
Energy: 1.465902439475923
Energy: 1.5004167015491887
Energy: 1.4641584789793907
Energy: 1.5749368718004324

minimum gb energy = 1.2887971616210745 eV
minimum distance =  2.16750641254605 Angstroms
sigma value = 57


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

Energy: 1.9554504638448518
Energy: 1.6926146441352456
Energy: 1.3545085163550676
Energy: 1.5243666439631578
Energy: 1.6836429638426136
Energy: 1.8131796764142267
Energy: 1.3398764242767887
Energy: 1.5203832921541314
Energy: 1.370646675221189
Energy: 1.3314584386170758
Energy: 1.3791700412923138
Energy: 1.5219111949620436
Energy: 1.3528138096244533
Energy: 1.570860752733591
Energy: 1.360783601931714
Energy: 1.3298057238562542
Energy: 1.3595176844079202
Energy: 1.6919393114800656
Energy: 1.6440762357808165
Energy: 1.6830771823204893
Energy: 1.4023475191785975
Energy: 1.3667411129196378
Energy: 1.3607248578733933
Energy: 1.6864589530385974
Energy: 1.6564601143035051
Energy: 1.6677043966221436
Energy: 1.6852375508646658
Energy: 1.6532563237985458
Energy: 1.6685770866031555
Energy: 1.666540433147867
Energy: 1.3596610544514087
Energy: 1.3835113078129186
Energy: 1.6495980753807518
Energy: 1.6448892355706588
Energy: 1.7305041457572183
Energy: 1.3666554841538305
Energy: 1.3383687375972502
Energy: 1.3443997274775183
Energy: 1.6813922573721793
Energy: 1.6681009587097804
Energy: 1.549629466239552
Energy: 1.3505547892729246
Energy: 1.3408566624393192
Energy: 1.3482642916472731
Energy: 1.5637745816968152
Energy: 1.3502910517064102
Energy: 1.3458534610814559
Energy: 1.3535432372967937
Energy: 1.3458257426893079
Energy: 1.3571424760144604
Energy: 1.6723717619080072
Energy: 1.515956717097777
Energy: 1.5395385132852573
Energy: 1.3558800162452154
Energy: 1.6547791600714343
Energy: 1.5195068683051254
Energy: 1.5239655040800968
Energy: 1.3423967509473052
Energy: 1.522450698098187
Energy: 1.5368012471224828
Energy: 1.362005180982283
Energy: 1.5175213056594785
Energy: 1.5637110255811015
Energy: 1.3629833182896962
Energy: 1.5174871679852961
Energy: 1.5128918520653434
Energy: 1.355718782117556
Energy: 1.5410184261863387
Energy: 1.5182086109113715
Energy: 1.3407815808572805
Energy: 1.5223855248859766
Energy: 1.5446591335717685
Energy: 1.3713659242495686
Energy: 1.5205601778147482
Energy: 1.5184081156287874
Energy: 1.3498598867254876
Energy: 1.520939028017334
Energy: 1.5483836424482498
Energy: 1.9450321623423013
Energy: 1.6340766234860078
Energy: 1.5984400263465213
Energy: 1.3623168524480944
Energy: 1.5984933260073944
Energy: 1.8165856760817236
Energy: 1.3708818471881066
Energy: 1.5228084723420314
Energy: 1.3623627751199685
Energy: 1.3370448730719968
Energy: 1.3752110268170974
Energy: 1.5213052850623354
Energy: 1.3543411325361725
Energy: 1.5816189479026834
Energy: 1.3535824778780916
Energy: 1.3251869194897477
Energy: 1.3570041643586632
Energy: 1.6944865441946162
Energy: 1.6435733503216337
Energy: 1.6810549691547707
Energy: 1.3546934339631505
Energy: 1.358247376237451
Energy: 1.3484515637301568
Energy: 1.6766513405006207
Energy: 1.6573053937194164
Energy: 1.6842115336130816
Energy: 1.6929840312081184
Energy: 1.3608638223144538
Energy: 1.685381925605519
Energy: 1.6700969253049316
Energy: 1.3419749894835
Energy: 1.729653456812878
Energy: 1.6484820167032612
Energy: 1.6457443812707522
Energy: 1.7312913495656588
Energy: 1.355255208217365
Energy: 1.3365275955596596
Energy: 1.3546869675996989
Energy: 1.668975274515951
Energy: 1.6574140135645072
Energy: 1.546264046391357
Energy: 1.3335774177971305
Energy: 1.3354480459332618
Energy: 1.3519171040932578
Energy: 1.5560568365737477
Energy: 1.357722554119262
Energy: 1.3650607406986146
Energy: 1.3355046115506486
Energy: 1.3421022560363212
Energy: 1.3597083828591545
Energy: 1.6711065621628265
Energy: 1.5469680971824389
Energy: 1.520649310368636
Energy: 1.3498698920777314
Energy: 1.3654214584913746
Energy: 1.5258138361286013
Energy: 1.5215979572761045
Energy: 1.3447123968808428
Energy: 1.519011570929692
Energy: 1.5469509866816649
Energy: 1.3661565302638328
Energy: 1.5199362656983786
Energy: 1.5924614508165589
Energy: 1.3651539529380101
Energy: 1.5204432696080314
Energy: 1.5138559457355354
Energy: 1.3601571179530771
Energy: 1.5478927644017972
Energy: 1.5199424201396023
Energy: 1.3459678782691422
Energy: 1.5722916688498532
Energy: 1.549358374357475
Energy: 1.3729702182935666
Energy: 1.51514617750316
Energy: 1.518841005336177
Energy: 1.3361260884793165
Energy: 1.5252924192882387
Energy: 1.495703428468658
Energy: 1.9382304948464784
Energy: 1.530999672592408
Energy: 1.61012425611033
Energy: 1.3573816110567858
Energy: 1.5561965487746487
Energy: 1.65411606610543

minimum gb energy = 1.3251869194897477 eV
minimum distance =  2.17444663907997 Angstroms
sigma value = 43


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

Energy: 1.4022650907676233
Energy: 1.395210444892759
Energy: 1.381915387781989
Energy: 1.3822932882067445
Energy: 1.6337436627295578
Energy: 1.7532685947352766
Energy: 1.4079996243763302
Energy: 1.3848440707053657
Energy: 1.3803783335066873
Energy: 1.3715177361879038
Energy: 1.390164084443223
Energy: 1.5300573069723644
Energy: 1.5124437558009425
Energy: 1.695199175573823
Energy: 1.378690833980674
Energy: 1.3731703552423773
Energy: 1.3817836472323908
Energy: 1.6652506354654408
Energy: 1.5106891838352032
Energy: 1.6686394638947089
Energy: 1.395100091262242
Energy: 1.3909799128946982
Energy: 1.548515094910874
Energy: 1.6658096686928576
Energy: 1.611521376422325
Energy: 1.6648489989909254
Energy: 1.6621719518798965
Energy: 1.4087348045519044
Energy: 1.663304264836684
Energy: 1.6655034004322926
Energy: 1.3595193537757448
Energy: 1.368507247610377
Energy: 1.7587539448756775
Energy: 1.3253891658578134
Energy: 1.5834208890565098
Energy: 1.3691418177499795
Energy: 1.3420322503224307
Energy: 1.3531377592995157
Energy: 1.6624921328009001
Energy: 1.449130553223052
Energy: 1.3452534609089764
Energy: 1.348919143525692
Energy: 1.3424633020064591
Energy: 1.3471879645909544
Energy: 1.5460490709231116
Energy: 1.445490765388802
Energy: 1.3463264728279698
Energy: 1.345188270895387
Energy: 1.3650610890294421
Energy: 1.3692248358564343
Energy: 1.667032817528642
Energy: 1.5325875467514751
Energy: 1.717614708965728
Energy: 1.359842340765676
Energy: 1.716879653949706
Energy: 1.6657880879920701
Energy: 1.6656259797743531
Energy: 1.4476234791490694
Energy: 1.6618416096619237
Energy: 1.6658659854944808
Energy: 1.8285378389622726
Energy: 1.661790808490612
Energy: 1.3906456259198972
Energy: 1.3905198798991258
Energy: 1.5379013365080327
Energy: 1.6158592262694687
Energy: 1.615885442859246
Energy: 1.6946378646997233
Energy: 1.3776141960986283
Energy: 1.3753860395455024
Energy: 1.3780137825463783
Energy: 1.6654889830654427
Energy: 1.5193551548863877
Energy: 1.376649076789099
Energy: 1.3740502633596288
Energy: 1.3727782882414603
Energy: 1.3729670165104202
Energy: 1.5804904818487944
Energy: 1.6123588201419599
Energy: 1.5618053509632503
Energy: 1.3894970977126933
Energy: 1.3891107692281137
Energy: 1.3944156082484376
Energy: 1.5732126690357877
Energy: 1.4499430591483995
Energy: 1.5295660683358245
Energy: 1.5292309023178987
Energy: 1.3744584657477286
Energy: 1.527360796985836
Energy: 1.5270203317118027
Energy: 1.6156340849563218
Energy: 1.5256530071963446
Energy: 1.526804063064331
Energy: 1.3726359309072071
Energy: 1.5279610890181157
Energy: 1.5259468478137368
Energy: 1.6149612118300032
Energy: 1.5289445811172535
Energy: 1.5298815689266423
Energy: 1.5136992497653545
Energy: 1.4871812041998826
Energy: 1.524035796670478
Energy: 1.6135171405787188
Energy: 1.5265511032689696
Energy: 1.5258066776548924
Energy: 1.408061885732249
Energy: 1.5265251100219173
Energy: 1.5272436137131329
Energy: 1.5678312666016638
Energy: 1.6357174874026705
Energy: 1.3781683594558172
Energy: 1.7515721973497038
Energy: 1.5566282723226108
Energy: 1.3825688290740894
Energy: 1.3707670926857398
Energy: 1.3983908650459773
Energy: 1.5274595513029237
Energy: 1.4074430865687217
Energy: 1.3800932251945792
Energy: 1.374981456645706
Energy: 1.3712773939983331
Energy: 1.3767992395446798
Energy: 1.6874026476844401
Energy: 1.5150765691518842
Energy: 1.3853433218070954
Energy: 1.3779286977865766
Energy: 1.3895996794883352
Energy: 1.394298510400494
Energy: 1.6660896140985144
Energy: 1.4697839209626051
Energy: 1.66084790422457
Energy: 1.3942299244160865
Energy: 1.4081715657672496
Energy: 1.6614792543719579
Energy: 1.6666444075159101
Energy: 1.3742248430052244
Energy: 1.6665503997471445
Energy: 1.6606703269887737
Energy: 1.8222810544769306
Energy: 1.5838446578116632
Energy: 1.3769356233662207
Energy: 1.367703292240038
Energy: 1.5834298823914135
Energy: 1.7615655522819602
Energy: 1.4532265058837444
Energy: 1.5461938768685755
Energy: 1.345301430594059
Energy: 1.3435248109828974
Energy: 1.3447578214351148
Energy: 1.6977824832767008
Energy: 1.44767077152427
Energy: 1.5455290112828572
Energy: 1.3443975815671911
Energy: 1.343592764988426
Energy: 1.3458566150495614
Energy: 1.7509680211330563
Energy: 1.606912881956124
Energy: 1.6665808304188792
Energy: 1.3716805446979277
Energy: 1.3610790889671238
Energy: 1.3670200946007742
Energy: 1.6406391774707485
Energy: 1.5457792059767057
Energy: 1.6622940686921315
Energy: 1.6661723598755376
Energy: 1.375522353329011
Energy: 1.6649397715814878
Energy: 1.6617384969226126
Energy: 1.3883617593606388
Energy: 1.3945405041660004
Energy: 1.669347947042819
Energy: 1.620287113374366
Energy: 1.693474245289007
Energy: 1.3905850878863655
Energy: 1.374975340484646
Energy: 1.3889165968691841
Energy: 1.6642223433491385
Energy: 1.6150446242061822
Energy: 1.5636124230226658
Energy: 1.376908986605124
Energy: 1.3713350054786493
Energy: 1.3735224521279317
Energy: 1.5288350961989867
Energy: 1.4127598202482794
Energy: 1.3735437169562545
Energy: 1.3754638898617806
Energy: 1.3916182274597564
Energy: 1.3883645591987717
Energy: 1.720383939879001
Energy: 1.5061916562335296
Energy: 1.3921572730100957
Energy: 1.3969208227372223
Energy: 1.6240146009133711
Energy: 1.5298007663256439
Energy: 1.525976854301558
Energy: 1.4478372296851998
Energy: 1.5264947536435
Energy: 1.528509909069438
Energy: 1.404117639998318
Energy: 1.5280567206356879
Energy: 1.5281920145774126
Energy: 1.6181372770558786
Energy: 1.5895529395284433
Energy: 1.5249558908851222
Energy: 1.5127885163917043
Energy: 1.5256259258589917
Energy: 1.5271620760359548
Energy: 1.3733961593468957
Energy: 1.5259858395721984
Energy: 1.5476729373984108
Energy: 1.4059797181807325
Energy: 1.527186109578488
Energy: 1.5287698083600632
Energy: 1.3740113659941804
Energy: 1.526397059084349
Energy: 1.580848951875993

minimum gb energy = 1.3253891658578134 eV
minimum distance =  2.20114249579416 Angstroms
sigma value = 81


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

Energy: 1.3460189502514575
Energy: 1.6250977712426151
Energy: 1.5601755506650563
Energy: 1.5600069174845799
Energy: 1.6234271504697462
Energy: 1.3732259147350372
Energy: 1.3976617016399848
Energy: 1.4320401553018542
Energy: 1.3796550817390902
Energy: 1.381169649170091
Energy: 1.3903983699790259
Energy: 1.431229248134068
Energy: 1.441464726692771
Energy: 1.4329681832377998
Energy: 1.377170889311198
Energy: 1.3810710251253775
Energy: 1.3797840959338121
Energy: 1.4307447359684842
Energy: 1.4402660150113318
Energy: 1.4309418065991906
Energy: 1.3794997302444787
Energy: 1.3797350382393287
Energy: 1.4317939571689002
Energy: 1.4348229911314045
Energy: 1.439108560814186
Energy: 1.4342501478514638
Energy: 1.4310656034769627
Energy: 1.372891580068482
Energy: 1.4341903463858638
Energy: 1.4336214166998769
Energy: 1.3963778985611117
Energy: 1.5556152555295941
Energy: 1.3739907433540834
Energy: 1.3533893628143197
Energy: 1.4315525335255619
Energy: 1.3851643620952816
Energy: 1.391389554755331
Energy: 1.397739676769647
Energy: 1.4305792344057358
Energy: 1.3804967962796562
Energy: 1.5600033045844646
Energy: 1.3834691194107878
Energy: 1.39163127285162
Energy: 1.3784948772161254
Energy: 1.4305121991568563
Energy: 1.4320293140372664
Energy: 1.4307047386694078
Energy: 1.3870112372495804
Energy: 1.5637956150628083
Energy: 1.3832909749663793
Energy: 1.4315051011384656
Energy: 1.438304072282317
Energy: 1.4339710698445292
Energy: 1.3818952972069005
Energy: 1.3818144031467794
Energy: 1.4344075513342431
Energy: 1.430809089893803
Energy: 1.431658916893384
Energy: 1.4341666103594746
Energy: 1.4304515860926141

minimum gb energy = 1.3460189502514575 eV
minimum distance =  2.24528190618561 Angstroms
sigma value = 3


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

Energy: 1.6347763945658482
Energy: 1.4956495450284684
Energy: 1.636174690035781
Energy: 1.5591130840876315
Energy: 1.4916258648843335
Energy: 1.7713114540212864
Energy: 1.5112249138829357
Energy: 1.3532052126416387
Energy: 1.496228965828501
Energy: 1.4914718248675998
Energy: 1.3553613217523235
Energy: 1.5446391681435465
Energy: 1.5175240025977292
Energy: 1.4237716643957896
Energy: 1.3545901139314092
Energy: 1.4909487733790903
Energy: 1.3600135714038113
Energy: 1.4915593287017117
Energy: 1.488708853011137
Energy: 1.5232566786865833
Energy: 1.3693073609296917
Energy: 1.5133810071476161
Energy: 1.5121511205337534
Energy: 1.5168359910359757
Energy: 1.4875936107171293
Energy: 1.5216255842059438
Energy: 1.6311790021255046
Energy: 1.7091538123510923
Energy: 1.5519721469436154
Energy: 1.5083777796422235
Energy: 1.610779311766662
Energy: 1.4887676305974675
Energy: 1.6096686416324928
Energy: 1.6806350124950455
Energy: 1.509272679098557
Energy: 1.560737693228936
Energy: 1.624473604935608
Energy: 1.5202800553831008
Energy: 1.7394955986117278
Energy: 1.5142307651463527
Energy: 1.6937862635232768
Energy: 1.5253372556771776
Energy: 1.6252887333343526
Energy: 1.5252752739683095
Energy: 1.3672883224805348
Energy: 1.3618060647112573
Energy: 1.3594326012550018
Energy: 1.5235087610151814
Energy: 1.7125663298897136
Energy: 1.3587761605187658
Energy: 1.3561710495745674
Energy: 1.337827552175996
Energy: 1.3575521291292874
Energy: 1.7031332178315262
Energy: 1.7132778237389628
Energy: 1.3566468128115472
Energy: 1.3561063141350043
Energy: 1.3634173950862016
Energy: 1.3528386156157166
Energy: 1.6257228475416068
Energy: 1.605459932622963
Energy: 1.6011440802730106
Energy: 1.6189785327216548
Energy: 1.331065639244814
Energy: 1.6203358323655246
Energy: 1.7315452750182434
Energy: 1.712582214528792
Energy: 1.6733890269349452
Energy: 1.3613416467581432
Energy: 1.7425586001402023
Energy: 1.7269149589397175
Energy: 1.736773145835063
Energy: 1.3286368055409636
Energy: 1.3576585507125118
Energy: 1.358613727549224
Energy: 1.7431424899790704
Energy: 1.3565565410262763
Energy: 1.3670443418264462
Energy: 1.3256109001905654
Energy: 1.3543318752587636
Energy: 1.3619754115511813
Energy: 1.7120757189736793
Energy: 1.3574567940295807
Energy: 1.3445860920620398
Energy: 1.3288265386148792
Energy: 1.3577574965013657
Energy: 1.3622544298318933
Energy: 1.6994265196060248
Energy: 1.4973253998573663
Energy: 1.3627834907435359
Energy: 1.357442918475082
Energy: 1.5806151161533035
Energy: 1.7385553887879353
Energy: 1.6999356851486536
Energy: 1.5762605270348444
Energy: 1.5125789355083992
Energy: 1.6671973808097778
Energy: 1.4999699815232974
Energy: 1.7205152683874154
Energy: 1.6177253131153664
Energy: 1.5037778729605853
Energy: 1.3628137125100628
Energy: 1.7457645709921576
Energy: 1.3556668848918945
Energy: 1.5098192468923592
Energy: 1.4919865357974362
Energy: 1.354575946989952
Energy: 1.6767794316786457
Energy: 1.511373494876839
Energy: 1.5142992722517714
Energy: 1.519853889035759
Energy: 1.5151082133707972
Energy: 1.5208793283754398
Energy: 1.4926430567983373
Energy: 1.48852392315009
Energy: 1.3626275226827556
Energy: 1.361723191465674
Energy: 1.4951417130064713
Energy: 1.3530045213163886
Energy: 1.518783829404154
Energy: 1.4870601411049797
Energy: 1.5201664960042982
Energy: 1.5136791563301533
Energy: 1.5132487842736553
Energy: 1.5199684194296645
Energy: 1.5249456247018929
Energy: 1.490273500627427
Energy: 1.493190080941877
Energy: 1.5860910497303367
Energy: 1.5333080521649027
Energy: 1.4990990555275463
Energy: 1.4914091026948146
Energy: 1.6982041105292247
Energy: 1.5140013917142665
Energy: 1.632064322584424
Energy: 1.7094152647728285
Energy: 1.6970020769970393
Energy: 1.7206359407155694
Energy: 1.6274823833290788
Energy: 1.7454037678258678
Energy: 1.37200389517158
Energy: 1.3661539138451357
Energy: 1.607204286180338
Energy: 1.6788445455286027
Energy: 1.6985210746206885
Energy: 1.4971271101970687
Energy: 1.352879156428195
Energy: 1.355983498274111
Energy: 1.3583520001272094
Energy: 1.7204395536293084
Energy: 1.7143326863828041
Energy: 1.3538125633146343
Energy: 1.3588893416708694
Energy: 1.352999180871975
Energy: 1.3545548611462808
Energy: 1.4663444412890407
Energy: 1.6063535845538288
Energy: 1.603263038396913
Energy: 1.3656744192346308
Energy: 1.369857639734344
Energy: 1.5357884041206697
Energy: 1.7342056342286476
Energy: 1.7133261240517152
Energy: 1.5361894799482598
Energy: 1.5376567537424923
Energy: 1.743320584144613
Energy: 1.5348976525637992
Energy: 1.6671121630041694
Energy: 1.328929691656056
Energy: 1.3615392335670609
Energy: 1.765409784272953
Energy: 1.3221215826562176
Energy: 1.5879550540867748
Energy: 1.3679808408269483
Energy: 1.3279429641408793
Energy: 1.3560449812747863
Energy: 1.353209860889232
Energy: 1.712991029804714
Energy: 1.3548491419267348
Energy: 1.3527073796860847
Energy: 1.3298573555022946
Energy: 1.35733284405563
Energy: 1.4976113235243245
Energy: 1.7039368969483624
Energy: 1.3562592528646908
Energy: 1.357079114104728
Energy: 1.3598013878101303
Energy: 1.5132899053008049
Energy: 1.7365204259378928
Energy: 1.7389407156045056
Energy: 1.5730388290409636
Energy: 1.3709961558699126
Energy: 1.6728681150765587
Energy: 1.6319594747140076
Energy: 1.508536409719152
Energy: 1.6995754948457926
Energy: 1.3544237024806733
Energy: 1.6761612106329866

minimum gb energy = 1.3221215826562176 eV
minimum distance =  2.22119279966608 Angstroms
sigma value = 67


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

Energy: 2.0222917914548817
Energy: 1.8345638402464965
Energy: 1.5856000344074794
Energy: 1.5512510972092965
Energy: 1.5477802264858767
Energy: 1.4627111768247927
Energy: 1.5016639575199
Energy: 1.4022143264194458
Energy: 1.5098336434836088
Energy: 1.5019315048737998
Energy: 1.497065962434077
Energy: 1.579023194872
Energy: 1.5023098308697749
Energy: 1.3575970726525455
Energy: 1.5475057715605987
Energy: 1.5047033140578316
Energy: 1.403825119523679
Energy: 1.5046992313564702
Energy: 1.5157540643034915
Energy: 1.5532072367200238
Energy: 1.4303976498400635
Energy: 1.445522452496025
Energy: 1.389209889491711
Energy: 1.5447674726935385
Energy: 1.5042128229507885
Energy: 1.5647709643819139
Energy: 1.5989820748802164
Energy: 1.4505483676150197
Energy: 1.5974037039263074
Energy: 1.5291365442332865
Energy: 1.5479828358290624
Energy: 1.5571048642514158
Energy: 1.860636114751451
Energy: 1.4036878620870048
Energy: 1.5130714755624033
Energy: 1.5561236350619996
Energy: 1.733987305743618
Energy: 1.5568377280343977
Energy: 1.761224502813511
Energy: 1.4278302369338678
Energy: 1.5693385168535297
Energy: 1.5514212341079545
Energy: 1.6649505345921627
Energy: 1.5528400087200072
Energy: 1.4057622908745029
Energy: 1.3823383346514104
Energy: 1.3833152359433696
Energy: 1.7902297348242988
Energy: 1.6476958871296945
Energy: 1.2826068991867596
Energy: 1.3947654548361572
Energy: 1.37900846791163
Energy: 1.402566680810326
Energy: 1.5946384258963935
Energy: 1.5957224246770372
Energy: 1.4487385807266622
Energy: 1.4475441058638225
Energy: 1.378986668114637
Energy: 1.286046988295484
Energy: 1.3493874700927067
Energy: 1.595694264477998
Energy: 1.7379829417602444
Energy: 1.747218968520303
Energy: 1.3804091768846334
Energy: 1.747886143616392
Energy: 1.4685679171634045
Energy: 1.592374487319938
Energy: 1.6022990402271418
Energy: 1.2807636321932632
Energy: 1.680952191379069
Energy: 1.2835344407583236
Energy: 1.4978269125507258
Energy: 1.3959061687424805
Energy: 1.2793293450496743
Energy: 1.2797050782391453
Energy: 1.6550943530794622
Energy: 1.2799099011050774
Energy: 1.27825860308975
Energy: 1.3901342085385482
Energy: 1.4517798908523516
Energy: 1.4503331732377809
Energy: 1.5647839855807628
Energy: 1.4503633113727317
Energy: 1.4515163756080531
Energy: 1.386287559177885
Energy: 1.4434759372163182
Energy: 1.6562024926865577
Energy: 1.5681010730220075
Energy: 1.47139839443804
Energy: 1.280153126336117
Energy: 1.387917635253969
Energy: 1.4389244907654415
Energy: 1.6234372886998631
Energy: 1.5683916170630183
Energy: 1.618674028059414
Energy: 1.3882108017362995
Energy: 1.691475362571255
Energy: 1.481110504017986
Energy: 1.5982549807743998
Energy: 1.5727918416035487
Energy: 1.569400408469057
Energy: 1.748761055631346
Energy: 1.6911070967591855
Energy: 1.4808003559691845
Energy: 1.761387077359563
Energy: 1.662056826976749
Energy: 1.564032317048955
Energy: 1.3208064090387845
Energy: 1.3137141749129546
Energy: 1.3143487876704336
Energy: 1.7887891579624744
Energy: 1.790242605969075
Energy: 1.8426919246429725
Energy: 1.343851073586667
Energy: 1.3099828899126211
Energy: 1.3216410907522305
Energy: 1.318996102667493
Energy: 1.6706418358615864
Energy: 1.3389481415476596
Energy: 1.3250246606277383
Energy: 1.3156912644685288
Energy: 1.3225306846855647
Energy: 1.4215823798279326
Energy: 1.6501397258736077
Energy: 1.3223640019589515
Energy: 1.3248876580134157
Energy: 1.3219715466771977
Energy: 1.3757615384459367
Energy: 1.8418232875071483
Energy: 1.502304721186153
Energy: 1.6880006139261967
Energy: 1.3531285721332758
Energy: 1.5700112800427033
Energy: 1.4490827951164664
Energy: 1.5327763555362135
Energy: 1.7193569618825426
Energy: 1.4036505665677794
Energy: 1.403198215785134

minimum gb energy = 1.27825860308975 eV
minimum distance =  2.23122131933205 Angstroms
sigma value = 33


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

Energy: 1.8574755187999532
Energy: 1.7436484129508403
Energy: 1.6036805650720618
Energy: 1.5954710590419334
Energy: 1.5876096411392917
Energy: 1.8777055022331846
Energy: 1.34601235610251
Energy: 1.4113011704218563
Energy: 1.5915384633825906
Energy: 1.5550145126111976
Energy: 1.4719620098594208
Energy: 1.477131976345272
Energy: 1.3484440449646777
Energy: 1.3711582540981475
Energy: 1.586283262419048
Energy: 1.463294733238669
Energy: 1.4730731882043948
Energy: 1.3469031048519144
Energy: 1.3344675982210497
Energy: 1.362945463660522
Energy: 1.3681193183048195
Energy: 1.55401639216612
Energy: 1.3429774730930348
Energy: 1.3605097713550094
Energy: 1.3466541391091895
Energy: 1.3481126858376398
Energy: 1.4690161903704881
Energy: 1.4797902432239707
Energy: 1.4069641707160345
Energy: 1.3484450941489632
Energy: 1.3483655216609969
Energy: 1.5071778400983706
Energy: 1.698523308779965
Energy: 1.6282298110938196
Energy: 1.694244252061959
Energy: 1.3653268095438824
Energy: 1.6065422553964877
Energy: 1.378292878601905
Energy: 1.6934385528381506
Energy: 1.4832991867468117
Energy: 1.6653061796966693
Energy: 1.4363084467405673
Energy: 1.6060058120931562
Energy: 1.368546569005721
Energy: 1.3411308462646971
Energy: 1.346544610125721
Energy: 1.3402004989970697
Energy: 1.4912010233254593
Energy: 1.5842394015234738
Energy: 1.2485344284440159
Energy: 1.370551998691988
Energy: 1.3321662104766514
Energy: 1.363749973225425
Energy: 1.532910007227749
Energy: 1.5466793311105984
Energy: 1.3633505134387496
Energy: 1.375564877666227
Energy: 1.333699892789722
Energy: 1.3398010444708432
Energy: 1.5475481006312686
Energy: 1.5467407569045397
Energy: 1.6424673819518625
Energy: 1.3596688087086972
Energy: 1.3506804680233762
Energy: 1.4385770003925866
Energy: 1.6389470811750915
Energy: 1.5531709166030903
Energy: 1.5484879687601163
Energy: 1.2444148943272169
Energy: 1.4889335469140106
Energy: 1.340223084848725
Energy: 1.5497040317311734
Energy: 1.683592848176217
Energy: 1.7574693909988477
Energy: 1.246448760638698
Energy: 1.4884161151576873
Energy: 1.2405904802480245
Energy: 1.6221764563047498
Energy: 1.6914007453235413
Energy: 1.838418599377512
Energy: 1.2469628181739234
Energy: 1.2379035673596535
Energy: 1.3482508929244907
Energy: 1.7833091798589802
Energy: 1.6589298713405665
Energy: 1.2473277449549565
Energy: 1.2520458260879954
Energy: 1.243728847613391
Energy: 1.2484293865153893
Energy: 1.5634195073118293
Energy: 1.643651772745024
Energy: 1.236963047082297
Energy: 1.241748979803916
Energy: 1.2340914065510449
Energy: 1.263178383652248
Energy: 1.6237242347239382
Energy: 1.5585092836905803
Energy: 1.6634245499723923
Energy: 1.2666326818847786
Energy: 1.2445902043620671
Energy: 1.2757693045948733
Energy: 1.6383449720285501
Energy: 1.6835550723647787
Energy: 1.4756951683649422
Energy: 1.4813662669570882
Energy: 1.3462113401755347
Energy: 1.6608929508188555
Energy: 1.5479245398218884
Energy: 1.585141877568334
Energy: 1.5925603186188353
Energy: 1.4505735896000806
Energy: 1.8754069544795868
Energy: 1.725995230477803
Energy: 1.5657757681924447
Energy: 1.5521493954598955
Energy: 1.4781394828034473
Energy: 1.4135032902896534
Energy: 1.4465872976360825
Energy: 1.4799694075435221
Energy: 1.5487637551939446
Energy: 1.4313663613106622
Energy: 1.58656482373665
Energy: 1.338057038614006
Energy: 1.350042255969088
Energy: 1.4380262297727284
Energy: 1.6302487713642526
Energy: 1.5548408009283154
Energy: 1.3613066641996239
Energy: 1.3635464583673584
Energy: 1.3644960496576466
Energy: 1.3621351147329757
Energy: 1.5505823228581068
Energy: 1.4821561444446194
Energy: 1.3629678931112357
Energy: 1.3449802174507894
Energy: 1.346595806623288
Energy: 1.3832422635821218
Energy: 1.6660735189006586
Energy: 1.6776815604553292
Energy: 1.8287258768073436
Energy: 1.3671797644970751
Energy: 1.3499777764540208
Energy: 1.340866880173201
Energy: 1.8333492338708632
Energy: 1.4825133040953289
Energy: 1.6825905491852098
Energy: 1.3547282409400856
Energy: 1.5136121481944937
Energy: 1.375791302271861
Energy: 1.6518985485659619
Energy: 1.3489073176739643
Energy: 1.3471647758396381
Energy: 1.87481400410655
Energy: 1.6912994430682669
Energy: 1.314437119585536
Energy: 1.347700313476978
Energy: 1.3333208182809135
Energy: 1.359848615903448
Energy: 1.4156827998335173
Energy: 1.5828564097870081
Energy: 1.3766604336348887
Energy: 1.363379143047155
Energy: 1.33239290590494
Energy: 1.3385153640673029
Energy: 1.485472435216593
Energy: 1.5477312319600312
Energy: 1.3614407915190474
Energy: 1.3652860432057892
Energy: 1.3465776535769474
Energy: 1.3775917329534078
Energy: 1.6325755498865426
Energy: 1.6397933870820158
Energy: 1.645343640961772
Energy: 1.3432212969031794
Energy: 1.5310572384371852
Energy: 1.3367402350129889
Energy: 1.5494384350083756
Energy: 1.5491295991324143
Energy: 1.5473887158582855
Energy: 1.3374624334891676
Energy: 1.5698681273547161
Energy: 1.251629329875277
Energy: 1.6216018630152176
Energy: 1.679796246812604
Energy: 1.7568685908105073
Energy: 1.3557457345211104
Energy: 1.3451093679556057
Energy: 1.4526601872280027
Energy: 1.6375237355002814
Energy: 1.6973403531576732
Energy: 1.634138116715761
Energy: 1.3554372355366882
Energy: 1.2374838281615863
Energy: 1.2543219304149353
Energy: 1.431182601524304
Energy: 1.6583750700881026
Energy: 1.2440708057023357
Energy: 1.2499263454745335
Energy: 1.230580135016664
Energy: 1.2438681035715136
Energy: 1.2475517111220213
Energy: 1.6663157977106677
Energy: 1.2359301158389893
Energy: 1.2374842986802828
Energy: 1.2430256165977764
Energy: 1.2687972523415505
Energy: 1.5899621592780389
Energy: 1.5745968372869594
Energy: 1.3706891534271883
Energy: 1.2607258857674253
Energy: 1.3403806985227293
Energy: 1.6589391943461433
Energy: 1.6430053513158644
Energy: 1.6853833473415196
Energy: 1.474997642221384
Energy: 1.3499931807065488
Energy: 1.5958768950756574
Energy: 1.3916218758374912
Energy: 1.6232198343773951
Energy: 1.6719351590308347
Energy: 1.7258678821535716
Energy: 1.8772308688095476

minimum gb energy = 1.230580135016664 eV
minimum distance =  2.22110809816896 Angstroms
sigma value = 41


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

Energy: 1.899041867859641
Energy: 1.7537640325646098
Energy: 1.3387551469379602
Energy: 1.354506586858652
Energy: 1.341973812807942
Energy: 1.750739746300777
Energy: 1.3292559638357617
Energy: 1.0985166372306827
Energy: 1.0981366370794852
Energy: 1.3755711724869593
Energy: 1.1000620857536225
Energy: 1.3643845538273955
Energy: 1.3284351828546213
Energy: 1.1002523080464495
Energy: 1.1181255493190876
Energy: 1.0395732131561883
Energy: 1.102736313175668
Energy: 1.3734499808400884
Energy: 1.3691430563097553
Energy: 1.4231105004345965
Energy: 1.1001583473923058
Energy: 1.326241897216
Energy: 1.1042348547578398
Energy: 1.4208877578965964
Energy: 1.3269662529616901
Energy: 1.3529330947376745
Energy: 1.4563457341470796
Energy: 1.3370608887808113
Energy: 1.4264716387916614
Energy: 1.3482867940739875
Energy: 1.3370427055590528
Energy: 1.3516871796910688
Energy: 1.730500947446868
Energy: 1.401510477970852
Energy: 1.7307575056892652
Energy: 1.3538939918259716
Energy: 1.599013516431882
Energy: 1.4268513292689176
Energy: 1.1036785659909822
Energy: 1.3407348748157444
Energy: 1.4615309501759302
Energy: 1.6284857664861874
Energy: 1.6005670697361694
Energy: 1.4323602613157473
Energy: 1.3553304709981029
Energy: 1.332352379307343
Energy: 1.1014830930453128
Energy: 1.7567635513763138
Energy: 1.3348651200419617
Energy: 1.102465323104209
Energy: 1.0997069949832279
Energy: 1.040369660274988
Energy: 1.107548520994011
Energy: 1.3571247397712376
Energy: 1.3407884475720162
Energy: 1.104846273895512
Energy: 1.0995814638693004
Energy: 1.376795863042948
Energy: 1.1022881071195711
Energy: 1.3617832038361741
Energy: 1.3389491065751518
Energy: 1.4279694678469859
Energy: 1.0998102485437862
Energy: 1.3690863015495252
Energy: 1.4439765499661399
Energy: 1.4207208139543364
Energy: 1.3320409538425126
Energy: 1.353574594653882
Energy: 1.1013509936857004
Energy: 1.3365610325030814
Energy: 1.103295470945846
Energy: 1.3475175016821699
Energy: 1.3286043838493518
Energy: 1.3607495088853812
Energy: 1.1009837461799785
Energy: 1.386277045252709
Energy: 1.1031995679346323
Energy: 1.350089197212694
Energy: 1.6004636228920675
Energy: 1.4214700734015657
Energy: 1.361274034725903
Energy: 1.3671386266742687
Energy: 1.3596222671587366
Energy: 1.753415904595663

minimum gb energy = 1.0395732131561883 eV
minimum distance =  2.22019002176569 Angstroms
sigma value = 11


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

Energy: 1.7972091758938262
Energy: 1.5623037372016908
Energy: 1.4919808063068785
Energy: 1.479405041729178
Energy: 1.4470075478871636
Energy: 1.9145611136851932
Energy: 1.2868528211121444
Energy: 1.4791757613452707
Energy: 1.4390392719086502
Energy: 1.6215226726128191
Energy: 1.4807159889540624
Energy: 1.3010840307701264
Energy: 1.2730363825044482
Energy: 1.2997119255272442
Energy: 1.4491182773634659
Energy: 1.5847746255088386
Energy: 1.4499427283568886
Energy: 1.2774405095737735
Energy: 1.272218809095248
Energy: 1.2967338282489964
Energy: 1.3008440368546665
Energy: 1.5412106923669697
Energy: 1.30295484593826
Energy: 1.2953176024411448
Energy: 1.2669788300060125
Energy: 1.2780558401919238
Energy: 1.2979253702712696
Energy: 1.4882117566313127
Energy: 1.2992452139161916
Energy: 1.2846289404711384
Energy: 1.2725944503464142
Energy: 1.278189870713948
Energy: 1.7481241690823344
Energy: 1.6364474180413486
Energy: 1.7474224724411647
Energy: 1.2785191934486728
Energy: 1.3720070401694515
Energy: 1.3981915552711695
Energy: 1.5633124716981295
Energy: 1.5619085068857148
Energy: 1.6197720383928136
Energy: 1.4361016562722078
Energy: 1.65124782569251
Energy: 1.4293433359380423
Energy: 1.451712201918128
Energy: 1.449310959862307
Energy: 1.4494433894805243
Energy: 1.740123356893875
Energy: 1.2751492117968806
Energy: 1.2851059011062218
Energy: 1.438135113997459
Energy: 1.7596467059872936
Energy: 1.397783382533167
Energy: 1.2777299905487236
Energy: 1.3710641988925336
Energy: 1.3941953011160912
Energy: 1.399247579845617
Energy: 1.7580851821520918
Energy: 1.4025232695502183
Energy: 1.3731215964988055
Energy: 1.3882634680199037
Energy: 1.431251742301881
Energy: 1.3228804585926301
Energy: 1.3733018608555223
Energy: 1.396837728634394
Energy: 1.4280624982018322
Energy: 1.386890956610853
Energy: 1.3238252171458618
Energy: 1.4288709872433463
Energy: 1.3877570930248324
Energy: 1.3978940735916947
Energy: 1.409827107720137
Energy: 1.3715854231220912
Energy: 1.4307530953663483
Energy: 1.4083910792331484
Energy: 1.383421099151912
Energy: 1.42874070708136
Energy: 1.4269489781992357
Energy: 1.618769381163293
Energy: 1.3989430705628334
Energy: 1.3934256121149542
Energy: 1.3727074821784007
Energy: 1.3966978494951632
Energy: 1.4471819584454788
Energy: 1.5241214427710286
Energy: 1.3994928655295233
Energy: 1.2789860535041975
Energy: 1.285742353588344
Energy: 1.4094877557075816
Energy: 1.4366645126961253
Energy: 1.4499695759480333
Energy: 1.4493385049030985
Energy: 1.4820901845335868
Energy: 1.9222483430455217
Energy: 1.5471850420689601
Energy: 1.453587932304214
Energy: 1.488098537003982
Energy: 1.4397677040872892
Energy: 1.4754495489105055
Energy: 1.2634252136605173
Energy: 1.4855016107646701
Energy: 1.5323727960107283
Energy: 1.5067817238563546
Energy: 1.4506995429127298
Energy: 1.2845808966838146
Energy: 1.2710192023664306
Energy: 1.2982673947619585
Energy: 1.5666813066145773
Energy: 1.5619478451464874
Energy: 1.3008726754139381
Energy: 1.2966185773482415
Energy: 1.275315725709914
Energy: 1.2981243463949557
Energy: 1.471864593561727
Energy: 1.5614694953151291
Energy: 1.2963988138191662
Energy: 1.293070612945859
Energy: 1.2784237797542666
Energy: 1.292630374133184
Energy: 1.467821982921177
Energy: 1.636347692836733
Energy: 1.7472826816196632
Energy: 1.2861543258028219
Energy: 1.2787032188895247
Energy: 1.2979779489860113
Energy: 1.748579122211351
Energy: 1.4879680837919003
Energy: 1.5619593952009152
Energy: 1.3997168264766364
Energy: 1.3683948759060267
Energy: 1.399437442581422
Energy: 1.5632265843374786
Energy: 1.447436054968576
Energy: 1.4493994481278643
Energy: 1.7403444548173057
Energy: 1.6295441725662028
Energy: 1.5587573766590812
Energy: 1.4510825370266298
Energy: 1.756581531882116
Energy: 1.4813866408741008
Energy: 1.2808300513796795
Energy: 1.2767426062431826
Energy: 1.3999634097076683
Energy: 1.285036178208908
Energy: 1.7589950090973085
Energy: 1.4011301981194126
Energy: 1.373648657175714
Energy: 1.3731082940398185
Energy: 1.392194513077775
Energy: 1.9701188110692058
Energy: 1.3717818699278455
Energy: 1.4041882761393198
Energy: 1.447030268518979
Energy: 1.392166584738025
Energy: 1.436592273488774
Energy: 1.4288450767408996
Energy: 1.387149280359982
Energy: 1.4551920018648075
Energy: 1.3979536735266498
Energy: 1.3898993115931206
Energy: 1.32360857504965
Energy: 1.4449499618712864
Energy: 1.3852735236087046
Energy: 1.4332237040955909
Energy: 1.3201700380858408
Energy: 1.4266931338325208
Energy: 1.429606467884433
Energy: 1.4096918532156713
Energy: 1.3722866216681775
Energy: 1.4035840300888986
Energy: 1.3988999144263483
Energy: 1.5581276029640974
Energy: 1.4052645684857352
Energy: 1.3752813110513058
Energy: 1.2682101538868247
Energy: 1.4493289438792742
Energy: 1.4421167051677755
Energy: 1.6510946584021828
Energy: 1.39884649249735
Energy: 1.2870702754744248
Energy: 1.7008182667553777
Energy: 1.4377155624569078
Energy: 1.450007462683555
Energy: 1.5681584020977857
Energy: 1.4302245402172897
Energy: 1.4792361619151484

minimum gb energy = 1.2634252136605173 eV
minimum distance =  2.19559540698347 Angstroms
sigma value = 57


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

Energy: 2.210180349946638
Energy: 1.9128597458142396
Energy: 1.4591990236570085
Energy: 1.4575495605856208
Energy: 1.557090072259972
Energy: 1.9376639800627173
Energy: 1.3207257001171722
Energy: 1.3765481021935824
Energy: 1.3764643519495265
Energy: 1.3209887073365962
Energy: 1.3949736582713725
Energy: 1.3843768546951778
Energy: 1.3186269589509065
Energy: 1.3406808192269155
Energy: 1.3621804973005454
Energy: 1.3408541809235612
Energy: 1.3615904742826275
Energy: 1.3478117477626916
Energy: 1.3176625429819133
Energy: 1.3635862490834814
Energy: 1.509070973255765
Energy: 1.3162961686511587
Energy: 1.3579730559002001
Energy: 1.336513628262572
Energy: 1.315881061042546
Energy: 1.3516735792773782
Energy: 1.3777765543116112
Energy: 1.3211005490409307
Energy: 1.3743171308541997
Energy: 1.3387684891522573
Energy: 1.3198025491679175
Energy: 1.3794668404516777
Energy: 1.6516927155924626
Energy: 1.3218992582401823
Energy: 1.6481070239839768
Energy: 1.3187580057257362
Energy: 1.390016804533838
Energy: 1.3919043197811132
Energy: 1.3207198765589936
Energy: 1.315546991327823
Energy: 1.3836025461472463
Energy: 1.3613100844667236
Energy: 1.3914689589639837
Energy: 1.3603699725585119
Energy: 1.3158532403556322
Energy: 1.3230492300839312
Energy: 1.348668156763327
Energy: 1.3616996493044327
Energy: 1.3151076075100945
Energy: 1.3338189960774887
Energy: 1.689436299024987
Energy: 1.3028767787002262
Energy: 1.6429393739567497
Energy: 1.3224400881477278
Energy: 1.3140080538173209
Energy: 1.3530452221056715
Energy: 1.343217218667137
Energy: 1.3026600837523468
Energy: 1.3932062245505703
Energy: 1.3324500636260403
Energy: 1.3018512921582936
Energy: 1.3616093767781343
Energy: 1.3778648922057326
Energy: 1.3242069007447599
Energy: 1.371973159885933
Energy: 1.3611302062301096
Energy: 1.3042804642833379
Energy: 1.393175040523772
Energy: 1.33832219743664
Energy: 1.3171661395551821
Energy: 1.3686223422124548
Energy: 1.3918455411392907
Energy: 1.3149679745639151
Energy: 1.5064611452923313
Energy: 1.3556840142299125
Energy: 1.3348766952810704
Energy: 1.3585602678679567
Energy: 1.3251186635631864
Energy: 1.3206755082362576
Energy: 1.3631036202475135
Energy: 1.3155418847453773
Energy: 1.3179543277757109
Energy: 1.3736169129345897
Energy: 1.6440073029408537
Energy: 1.3206621539581977
Energy: 1.3974849552485265
Energy: 1.3725826209784233
Energy: 1.3227869564084322
Energy: 1.3774730822853711
Energy: 1.3171628476252937
Energy: 1.5337133354469448
Energy: 1.3424698796091163
Energy: 1.3414453470412995
Energy: 1.6344284494561652
Energy: 1.342912307518729
Energy: 1.5656583485235547
Energy: 1.302071316130632
Energy: 1.3814045460974278
Energy: 1.3762973840141626
Energy: 1.31482904302752
Energy: 1.3941217615264063
Energy: 1.3366329904760086

minimum gb energy = 1.3018512921582936 eV
minimum distance =  2.22484819645209 Angstroms
sigma value = 9


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

Energy: 2.3903367806125475
Energy: 1.5070814012322815
Energy: 1.4771574979962112
Energy: 1.4743594401256097
Energy: 1.4751735935545285
Energy: 2.0364956638548737
Energy: 1.352555548770509
Energy: 1.458649941552812
Energy: 1.4159336163429668
Energy: 1.387676426491746
Energy: 1.534930531089204
Energy: 1.4309628940000616
Energy: 1.3531220186011168
Energy: 1.3570252778163372
Energy: 1.4462007127492433
Energy: 1.444108720639371
Energy: 1.4657702542207272
Energy: 1.355397334846687
Energy: 1.3752347484145913
Energy: 1.4513676624574017
Energy: 1.388459840884999
Energy: 1.357456441198878
Energy: 1.4292592198889553
Energy: 1.3798679519326749
Energy: 1.378119912356097
Energy: 1.398746541265781
Energy: 1.3851191374339913
Energy: 1.37701758479041
Energy: 1.3833101108189578
Energy: 1.3989105503068802
Energy: 1.3580076541303374
Energy: 1.3852650217659819
Energy: 1.3989591288194088
Energy: 1.3812747014371984
Energy: 1.4151779667644333
Energy: 1.3802281103980973
Energy: 1.3861181438559351
Energy: 1.468255815963047
Energy: 1.3834226011407356
Energy: 1.3892008542290115
Energy: 1.3803003185975025
Energy: 1.4267107213095584
Energy: 1.3860694748323386
Energy: 1.516655630566961
Energy: 1.3589227365394436
Energy: 1.3533260021058895
Energy: 1.362160437649163
Energy: 1.5225409938093148
Energy: 1.359465223763621
Energy: 1.3788358334192554
Energy: 1.5171168076892574
Energy: 1.3846527792853829
Energy: 1.5112815732979812
Energy: 1.3577476010867717
Energy: 1.3518529139364495
Energy: 1.362181135509121
Energy: 1.5193833587377703
Energy: 1.3851323441510592
Energy: 1.511898566107225
Energy: 1.432178352843309
Energy: 1.3423703155923243
Energy: 1.5134455072287414
Energy: 1.3673564730002226
Energy: 1.351708623846639
Energy: 1.3562664379576856
Energy: 1.5458582409084185
Energy: 1.3479319501636955
Energy: 1.5338662832841143
Energy: 1.3812393790186197
Energy: 1.3882177028921885
Energy: 1.4073609388929527
Energy: 1.4455087864618263
Energy: 1.352104773878634
Energy: 1.3565992036784658
Energy: 1.521976489673235
Energy: 1.399605400233033
Energy: 1.4616086193421738
Energy: 1.3573055777357503
Energy: 1.3896014679551552
Energy: 1.3785791295388912
Energy: 1.4627190316928336
Energy: 1.3983996752263312
Energy: 1.4736460512968608
Energy: 1.3808716021241827
Energy: 1.3749091903652182
Energy: 1.401321533321179
Energy: 1.3787198518884693
Energy: 1.3576431472483803
Energy: 1.3844541996695379
Energy: 1.4010664857410242
Energy: 1.3752251067591847
Energy: 1.3853587908574903
Energy: 1.397105055643541
Energy: 1.401390666984677
Energy: 1.4101090649655996
Energy: 1.384577931464794
Energy: 1.3576444646757069
Energy: 1.4261324948573133
Energy: 1.3777156761725724
Energy: 1.3763927958273798
Energy: 1.4592175004939425
Energy: 1.4242232732426983
Energy: 1.3871787335781582
Energy: 1.4725273035743656
Energy: 1.3569663215577323
Energy: 1.3550123570643526
Energy: 1.3589202893431855
Energy: 1.7425812154902998
Energy: 1.3945636980924974
Energy: 1.3810229369788976
Energy: 1.493548193213707
Energy: 1.3581952231464351
Energy: 1.529628656216795
Energy: 1.3797463605507985
Energy: 1.3601205056615473
Energy: 1.359334089906079
Energy: 1.4213351362729882
Energy: 1.7270255226689986
Energy: 1.3691701620953802
Energy: 1.3588053537800366
Energy: 1.341783502198571
Energy: 1.5292414223998811
Energy: 1.3805892951791954
Energy: 1.351972800625655
Energy: 1.4587512116991554
Energy: 1.3797916152496512

minimum gb energy = 1.341783502198571 eV
minimum distance =  2.23368420849597 Angstroms
sigma value = 27


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

Energy: 1.5425000676759522
Energy: 1.4242255519765235
Energy: 1.4162958171501498
Energy: 1.4155947902211041
Energy: 1.4180160895521494
Energy: 1.3462559520259623
Energy: 1.3449786637047294
Energy: 1.4600542478149727
Energy: 1.3731465731623416
Energy: 1.3518272177074762
Energy: 1.5692831170520805
Energy: 1.3742876143588472
Energy: 1.3523302151794347
Energy: 1.3558574523560114
Energy: 1.5199960620196251
Energy: 1.5115324206022454
Energy: 1.4558023688512607
Energy: 1.3553924235992332
Energy: 1.348963798441011
Energy: 1.5182909172549768
Energy: 1.449590810870258
Energy: 1.3530566825842578
Energy: 1.483900912392179
Energy: 1.354455072035481
Energy: 1.351670634478426
Energy: 1.3929396597756882
Energy: 1.3664147109125837
Energy: 1.3564864971388175
Energy: 1.365864608228655
Energy: 1.4421167676034958
Energy: 1.3361872451982786
Energy: 1.4656741026469517
Energy: 1.389185980387518
Energy: 1.3562447626059924
Energy: 1.3903389734508367
Energy: 1.3390089961643987
Energy: 1.3458114382274584
Energy: 1.4061592709931017
Energy: 1.3662060779453502
Energy: 1.3666368355974052
Energy: 1.365336966129309
Energy: 1.4418423197535604
Energy: 1.3476311438012805
Energy: 1.4407424087829543
Energy: 1.4450588806141267
Energy: 1.349873803754417
Energy: 1.390232178799355
Energy: 1.4390299659165455
Energy: 1.3410920951958547
Energy: 1.3545547617031504
Energy: 1.485854735534364
Energy: 1.3502828452976405
Energy: 1.4850969613911902
Energy: 1.3573049878150765
Energy: 1.3439866475723852
Energy: 1.424637695534734
Energy: 1.5861775377886524
Energy: 1.3512645542624524
Energy: 1.5851403843058687
Energy: 1.4239189908965126
Energy: 1.3457541455616562
Energy: 1.5845607741663357
Energy: 1.353972638073711
Energy: 1.351226978895972
Energy: 1.3540588968326548
Energy: 1.767685027127749
Energy: 1.3467931500638648
Energy: 1.5873190902174166
Energy: 1.4107036750783886
Energy: 1.3430752799407986
Energy: 1.352519906160059
Energy: 1.5967603575110865
Energy: 1.413954856762981
Energy: 1.3444197539203453
Energy: 1.514068976876781
Energy: 1.3297291493092953
Energy: 1.3740537464019056
Energy: 1.349116588040179
Energy: 1.3504920361708797
Energy: 1.3748290516135673
Energy: 1.5949457157983764
Energy: 1.3506198057582708
Energy: 1.5818693122440206
Energy: 1.3528719379959695
Energy: 1.3303570226585548
Energy: 1.454212739335333
Energy: 1.3542521059175634
Energy: 1.3451378808481147
Energy: 1.423196652331956
Energy: 1.5281347774654417
Energy: 1.3299863627379414
Energy: 1.5222877939142154
Energy: 1.3545587883785524
Energy: 1.353292728737688
Energy: 1.3539781435025102
Energy: 1.485617136267456
Energy: 1.3515144937089283
Energy: 1.3639524260182632
Energy: 1.441227046486081
Energy: 1.3665242895184833
Energy: 1.3921207428593596
Energy: 1.4452082153129489
Energy: 1.3541351165708215
Energy: 1.3671237655438764
Energy: 1.4657380223375527
Energy: 1.3530976308412515
Energy: 1.4653260316924033
Energy: 1.364958427762046
Energy: 1.3539824615962155
Energy: 1.3658456448967926
Energy: 1.4658846812919288
Energy: 1.3357274635902359
Energy: 1.475453775079363
Energy: 1.3645368836223633
Energy: 1.3509074860343129
Energy: 1.391362730026476
Energy: 1.4398800791029267
Energy: 1.445430922552576
Energy: 1.4407617322373492
Energy: 1.4450003284681667
Energy: 1.3505220475065776
Energy: 1.4827837124962635
Energy: 1.355020212406842
Energy: 1.3536009907936843
Energy: 1.48324007497064
Energy: 1.4836939605152708
Energy: 1.3947967326992248
Energy: 1.4576584441713272
Energy: 1.3592733490216982
Energy: 1.3445421305384206
Energy: 1.357998193611119
Energy: 1.7754247204779108
Energy: 1.3516788781722
Energy: 1.353064873829394
Energy: 1.57139476086233
Energy: 1.346459834242073
Energy: 1.584745214099528
Energy: 1.3528585983134676
Energy: 1.3431892110045376
Energy: 1.4122225240727182
Energy: 1.4462029873497222
Energy: 1.405086765640949
Energy: 1.3752691476654393
Energy: 1.3491081462920747
Energy: 1.3561180811528137
Energy: 1.5868396925182644
Energy: 1.4267031962181091
Energy: 1.3447644662096538
Energy: 1.3737471226364275
Energy: 1.512319984994676

minimum gb energy = 1.3297291493092953 eV
minimum distance =  2.215535209026 Angstroms
sigma value = 19


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

Energy: 1.6391143335113714
Energy: 1.4411385618734183
Energy: 1.437355897940344
Energy: 1.4357963891529213
Energy: 1.4363114754351574
Energy: 1.3271841317551099
Energy: 1.3081219901165722
Energy: 1.4663315096355267
Energy: 1.357131267600865
Energy: 1.3438090065420853
Energy: 1.6279502536459889
Energy: 1.486410761441337
Energy: 1.3022657189599078
Energy: 1.35356038858031
Energy: 1.5375585960892528
Energy: 1.5367247686446726
Energy: 1.3523881726567757
Energy: 1.3528153773891718
Energy: 1.3049709506128184
Energy: 1.5343703241230422
Energy: 1.4819645669042427
Energy: 1.3437798130643113
Energy: 1.482089265820665
Energy: 1.3537931073309644
Energy: 1.2823191244201877
Energy: 1.4829501929364006
Energy: 1.3589503078611027
Energy: 1.342343174062744
Energy: 1.3635529389389565
Energy: 1.4827894611139707
Energy: 1.3044920312465682
Energy: 1.4056593524906136
Energy: 1.3615561356662733
Energy: 1.3095999670375256
Energy: 1.3606730960557927
Energy: 1.3078564140658484
Energy: 1.3127329079695953
Energy: 1.3717410434699442
Energy: 1.3679629404976477
Energy: 1.368358338263285
Energy: 1.3809247425075046
Energy: 1.3728788514104655
Energy: 1.3128604405694773
Energy: 1.3723710716412132
Energy: 1.4939338679861909
Energy: 1.3048059025541496
Energy: 1.3723082230855328
Energy: 1.3728039693038643
Energy: 1.3294672390612505
Energy: 1.3711503982509379
Energy: 1.4255556583867235
Energy: 1.315787036407254
Energy: 1.3714833164108395
Energy: 1.3708589995004994
Energy: 1.3131563673836246
Energy: 1.436770290845255
Energy: 1.4905777228848973
Energy: 1.3029485272835624
Energy: 1.4913403554719478
Energy: 1.3766441235599232
Energy: 1.2894389991812594
Energy: 1.3776466969150671
Energy: 1.3206859436868237
Energy: 1.3199373357741766
Energy: 1.3213398290199798
Energy: 1.5725811011361166
Energy: 1.3136677206976488
Energy: 1.5656507099439887
Energy: 1.4048759438767433
Energy: 1.3070195690455597
Energy: 1.3770788687616378
Energy: 1.5656536508337193
Energy: 1.312817022472027
Energy: 1.3569374095662494
Energy: 1.3170353346450956
Energy: 1.3395448203906895
Energy: 1.402153679779729
Energy: 1.3136752223175847
Energy: 1.2706165472337634
Energy: 1.3641920815024253
Energy: 1.5420541948863649
Energy: 1.304868348976808
Energy: 1.5448841023927977
Energy: 1.2718238804210047
Energy: 1.286569792803353
Energy: 1.2971100558071318
Energy: 1.3076439139203657
Energy: 1.3067468787002476
Energy: 1.3065632679136072
Energy: 1.542438911939231
Energy: 1.271739106448077
Energy: 1.5436366251523566
Energy: 1.3348166887852793
Energy: 1.3065205888387768
Energy: 1.2929275527828428
Energy: 1.540545525308777
Energy: 1.271143119891033
Energy: 1.3444006920860494
Energy: 1.5941080474502172
Energy: 1.662853175865124
Energy: 1.5503949655298568
Energy: 1.3447577166720135
Energy: 1.3066348205296718
Energy: 1.4296816451488774
Energy: 1.4928229845477385
Energy: 1.315598575366828
Energy: 1.4930985458848225
Energy: 1.3545596221184133
Energy: 1.2818105326131308
Energy: 1.4753063075159674
Energy: 1.424485602681887
Energy: 1.3075931469220634
Energy: 1.4323597882481345
Energy: 1.4764385892611311
Energy: 1.3064871782100853
Energy: 1.5059646460015945
Energy: 1.3329921694993965
Energy: 1.3329085666187286
Energy: 1.332061737523363
Energy: 1.399743355878994
Energy: 1.3060923001686449
Energy: 1.4983870770368752
Energy: 1.3762863257485944
Energy: 1.3812415958775075
Energy: 1.3799134919706317
Energy: 1.442724867513829
Energy: 1.307308600770167
Energy: 1.3784192557336485
Energy: 1.4533254450019517
Energy: 1.303940609236308
Energy: 1.4479518746308042
Energy: 1.379445925845071
Energy: 1.3058917461014747
Energy: 1.3635446463097807
Energy: 1.4827799152213166
Energy: 1.3033035192639622
Energy: 1.4075777550026727
Energy: 1.3642665059216559
Energy: 1.3147912772147634
Energy: 1.3641786377172602
Energy: 1.4817444084337155
Energy: 1.304290879422711
Energy: 1.4826447069298805
Energy: 1.3636107292469668
Energy: 1.3146545675339787
Energy: 1.4802599906810783
Energy: 1.3516635667260517
Energy: 1.304209968690064
Energy: 1.3474616235007928
Energy: 1.480562254808974
Energy: 1.2895038587613221
Energy: 1.4632034904388111
Energy: 1.349406558590628
Energy: 1.3009959541295875
Energy: 1.3492785473322157
Energy: 1.6377841599363445
Energy: 1.3445904448391817
Energy: 1.3642695842693733
Energy: 1.6398782378506984
Energy: 1.300062620731081
Energy: 1.63415287248481
Energy: 1.3147455041429306
Energy: 1.302272726426724
Energy: 1.3419840327911128
Energy: 1.406459694947837
Energy: 1.3376493440427273
Energy: 1.3656989412209024
Energy: 1.3040095419703481
Energy: 1.3391494716611974
Energy: 1.6373386141346948
Energy: 1.4580006085659742
Energy: 1.407395312084042
Energy: 1.421455223552924
Energy: 1.6263010459510767

minimum gb energy = 1.2706165472337634 eV
minimum distance =  2.21910359161282 Angstroms
sigma value = 101


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

Energy: 2.047899442767802
Energy: 1.339398264489107
Energy: 1.3427980421488883
Energy: 1.3411491636841784
Energy: 1.3445482423801032
Energy: 1.553673614777335
Energy: 1.2280505283198127
Energy: 1.4348693238657324
Energy: 1.4029030628716261
Energy: 1.2516812377411328
Energy: 1.6224077905048278
Energy: 1.399183405730668
Energy: 1.246300706840263
Energy: 1.3080461079277645
Energy: 1.5618991135888498
Energy: 1.5551241597706953
Energy: 1.310038557336781
Energy: 1.2503993449843551
Energy: 1.2468902336780516
Energy: 1.5617701625596307
Energy: 1.394186695430338
Energy: 1.229142491655309
Energy: 1.4777787842265617
Energy: 1.3111230476419127
Energy: 1.2206698527658881
Energy: 1.3928366984115557
Energy: 1.3216591574009775
Energy: 1.230869806741911
Energy: 1.3239678169964486
Energy: 1.400072264218086
Energy: 1.2474161183047912
Energy: 1.3549482875005459
Energy: 1.3241127266563724
Energy: 1.2255372291178122
Energy: 1.3219588397757285
Energy: 1.2475887635512641
Energy: 1.2470472737573857
Energy: 1.3014953588597802
Energy: 1.355232522997329
Energy: 1.3591328750996596
Energy: 1.3698889199857236
Energy: 1.3009367502239835
Energy: 1.2352138092181646
Energy: 1.3028988856832437
Energy: 1.2252507544528686
Energy: 1.2257264661828247
Energy: 1.3019269510195444
Energy: 1.3012065005444184
Energy: 1.265416067536985
Energy: 1.3026686881898355
Energy: 1.3549826474056
Energy: 1.25211142908244
Energy: 1.3207686685863131
Energy: 1.3015305945098663
Energy: 1.2469975080471767
Energy: 1.4191903456988566
Energy: 1.3548522672755494
Energy: 1.2261319827732688
Energy: 1.3547402384599252
Energy: 1.3313797121556994
Energy: 1.2462825449969546
Energy: 1.3191160187310431
Energy: 1.2602048593996629
Energy: 1.2613322726352152
Energy: 1.3227783454191369
Energy: 1.4813492500170222
Energy: 1.246373541330966
Energy: 1.4765410703276518
Energy: 1.3865114633666369
Energy: 1.2593641811139549
Energy: 1.3196248084608388
Energy: 1.4769922528793713
Energy: 1.247572629049878
Energy: 1.3115805815980814
Energy: 1.307924852425443
Energy: 1.2430911253948058
Energy: 1.3077652304772012
Energy: 1.2476480702977826
Energy: 1.22796005345443
Energy: 1.3873378760216193
Energy: 1.6248006385037652
Energy: 1.2425633766311894
Energy: 1.6298001854749489
Energy: 1.387912910930056
Energy: 1.257327771938322
Energy: 1.3167058838307926
Energy: 1.2547663340082034
Energy: 1.252126531467919
Energy: 1.226820307867518
Energy: 1.430713919952335
Energy: 1.2559167446433088
Energy: 1.618647721494563
Energy: 1.388680585435832
Energy: 1.2286376899008304
Energy: 1.3184236143246462
Energy: 1.3180679969410787
Energy: 1.3172761484417461
Energy: 1.2303823008841686
Energy: 1.264314362707032
Energy: 1.5525349579059649
Energy: 1.3131788866349359
Energy: 1.3186977275926834
Energy: 1.2518276127831631
Energy: 1.4029118953928161
Energy: 1.6207851262264348
Energy: 1.2219357442126864
Energy: 1.6284010165720213
Energy: 1.3191147325410104
Energy: 1.2642350880082618
Energy: 1.5144381335081727
Energy: 1.2930178951382754
Energy: 1.2289440708091848
Energy: 1.3090186930462142
Energy: 1.5686161973278971
Energy: 1.2630993367904282
Energy: 1.5342037651596983
Energy: 1.3148730675642237
Energy: 1.2469122564014328
Energy: 1.3110285059063898
Energy: 1.394606387449576
Energy: 1.2244059919647283
Energy: 1.388611516867279
Energy: 1.479375131143594
Energy: 1.3948927522364474
Energy: 1.4648717671429605
Energy: 1.3852791238370266
Energy: 1.2257946301720202
Energy: 1.3247959997394017
Energy: 1.3811238714728638
Energy: 1.247607601711699
Energy: 1.3239305480117693
Energy: 1.31993472726429
Energy: 1.252295663344884
Energy: 1.3540753824796723
Energy: 1.364619520448651
Energy: 1.2351647878113978
Energy: 1.3652709361704911
Energy: 1.3575700415721546
Energy: 1.226344841023867
Energy: 1.3221737373784037
Energy: 1.3007500141925146
Energy: 1.248475624795689
Energy: 1.3028731031655318
Energy: 1.3411636573804206
Energy: 1.2248117392111897
Energy: 1.3212230947021
Energy: 1.3009445551697199
Energy: 1.3025323673560885
Energy: 1.3011759335450996
Energy: 1.3227644215132879
Energy: 1.2515761307173003
Energy: 1.3564308550202067
Energy: 1.4180321774826152
Energy: 1.2481663804116034
Energy: 1.425442338521742
Energy: 1.3556128795466091
Energy: 1.225727910222435
Energy: 1.322256956150499
Energy: 1.3229712196809469
Energy: 1.247399743660296
Energy: 1.3234946595291581
Energy: 1.260745609147421
Energy: 1.2592735626745917
Energy: 1.3200828500127635
Energy: 1.4783872004544454
Energy: 1.2470084850898553
Energy: 1.4771717156854756
Energy: 1.3862154495015397
Energy: 1.2429671143605843
Energy: 1.5347730209514332
Energy: 1.314698742135823
Energy: 1.2485822803520996
Energy: 1.3151749271724889
Energy: 1.5350615381396848
Energy: 1.2432951514192858
Energy: 1.3085491483929033
Energy: 1.2286153208077732
Energy: 1.293379999204395
Energy: 1.2926884032956183
Energy: 1.6273255578575587
Energy: 1.2517889750181366
Energy: 1.3173665844511053
Energy: 1.440500558457187
Energy: 1.2558637888214323
Energy: 1.3170122849108077
Energy: 1.253905222582299
Energy: 1.2291622841965018
Energy: 1.387888478444196
Energy: 1.6285058405847281
Energy: 1.2492658549807683
Energy: 1.226490923258879
Energy: 1.235593689536622
Energy: 1.263239524309421
Energy: 1.2255144682162413
Energy: 1.2925668916126782
Energy: 1.317459212129537
Energy: 1.2932717557538675
Energy: 1.5556424601253764

minimum gb energy = 1.2206698527658881 eV
minimum distance =  2.21164426694681 Angstroms
sigma value = 33


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

Energy: 0.014034170650003591
Energy: 0.09403492397120196
Energy: 0.08974163919341739
Energy: 0.08982230261055982
Energy: 0.09077417284356303
Energy: 0.014613013635153757
Energy: 0.10371799998487838
Energy: 0.10416940755589707
Energy: 0.10429250861897257
Energy: 0.10496654503985534
Energy: 0.10368588866825357
Energy: 0.10636139021625042
Energy: 0.8648056803254873
Energy: 0.0927043291095607
Energy: 0.014728878253481377
Energy: 0.016145606679856293
Energy: 0.09169944134286738
Energy: 0.08947609002093346
Energy: 0.014129627747965025
Energy: 0.10416940755518617
Energy: 0.10429250861826166
Energy: 0.10496654504052674
Energy: 0.10368588866754265
Energy: 0.1063613902155395

minimum gb energy = 0.014034170650003591 eV
minimum distance =  2.44460860013496 Angstroms
sigma value = 1