Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Al__MO_060567868558_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.050199627876282
cohesive_energy=3.5802838199389533
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.12357297600262e-19, 2.8429823282013e-19, 3.31371784503684e-19, 3.6913028123716197e-19, 4.0317012600312595e-19, 4.3350093186138e-19, 4.590892948829939e-19, 4.799672586006479e-19, 4.96903867798662e-19, 5.107226412669119e-19, 5.220820736019719e-19, 5.31483646090284e-19, 5.393070745941059e-19, 5.458631813804339e-19, 5.51401906004172e-19, 5.56126724897838e-19, 5.60186640488394e-19, 5.636809877271479e-19, 5.66661036266388e-19, 5.69129990459382e-19, 5.71073430716424e-19, 5.724689265646379e-19, 5.73302058414318e-19, 5.735792349719999e-19, 5.7328763882461195e-19, 5.72364785083428e-19, 5.7076741497933e-19, 5.68489119805782e-19, 5.65142172817356e-19, 5.603084059125779e-19, 5.5382439707478e-19, 5.455203155807579e-19, 5.352135132942359e-19, 5.226828898397219e-19, 5.07651268659534e-19, 4.89726116478342e-19, 4.6834026276771e-19, 4.426477582648859e-19, 4.11427744374762e-19, 3.73031581340952e-19, 3.2537323518598797e-19, 2.6584916887962e-19, 1.9120696385482797e-19, 9.712603038270419e-20, -2.2567458978207e-20, -1.76742513203076e-19, -3.7763944134033597e-19, -6.432739185509999e-19, -1.0025363938993559e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010999736019921656
Energy: 0.04666890349705245
Energy: 0.1970908827448737
Energy: 0.011717580493499927
Energy: 0.04666890349605312
Energy: 0.14931039248365083
Energy: 0.011717580493028018
Energy: 0.14931039248365083
Energy: 0.19709088274584527
Energy: 0.011717580493499927
Energy: 0.010999736019921656
Energy: 0.04666890349605312
Energy: 0.011717580493028018
Energy: 0.14931039248365083
Energy: 0.04666890349705245
Energy: 0.14931039248365083

minimum gb energy = 0.010999736019921656 eV
minimum distance =  2.81563440866351 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 0.431039203786624
Energy: 0.346467049982001
Energy: 0.34717792022444705
Energy: 0.3191145675657473
Energy: 0.3203554026350104
Energy: 0.34729605683189974
Energy: 0.3207300990094091
Energy: 0.3472960568312937
Energy: 0.34707176717821037
Energy: 0.3462967729853574
Energy: 0.4710920610901566
Energy: 0.34629677298475137
Energy: 0.3199256069416919
Energy: 0.3162424270117779
Energy: 0.3204920368622351
Energy: 0.3162424270111719
Energy: 0.40084016070645234
Energy: 0.31570310642086646
Energy: 0.31706036703799334
Energy: 0.31570310642086646
Energy: 0.3191406171127464
Energy: 0.3215547364280082
Energy: 0.3214163683617432
Energy: 0.3215547364286142
Energy: 0.3222307603254574
Energy: 0.32224380725990026
Energy: 0.40078626717003923
Energy: 0.3222438072592943
Energy: 0.32057032618872194
Energy: 0.32578747298356686
Energy: 0.3301082724151107
Energy: 0.32578747298356686
Energy: 0.3500621701271341
Energy: 0.31405214848699387
Energy: 0.32955085522484684
Energy: 0.31405214848699387
Energy: 0.340877846467015
Energy: 0.3200845966023896
Energy: 0.31714259672080347
Energy: 0.3200845966023896
Energy: 0.3157126856434586
Energy: 0.3139764531592068
Energy: 0.3506489420574207
Energy: 0.31397645315799483
Energy: 0.32204931469696574
Energy: 0.3143534633238883
Energy: 0.32899771541039213
Energy: 0.31435346332449426
Energy: 0.3220829482182511
Energy: 0.32253769998425064
Energy: 0.3193251030089937
Energy: 0.32253769998303866
Energy: 0.32329592853620653
Energy: 0.32152516903589384
Energy: 0.3247253933394271
Energy: 0.3215251690352879
Energy: 0.31914135763285395
Energy: 0.31572726457277156
Energy: 0.3162522995474061
Energy: 0.3157272645733775
Energy: 0.3175305061641595
Energy: 0.3160154978565125
Energy: 0.3203513698016212
Energy: 0.3160154978559065
Energy: 0.3462408570943164
Energy: 0.34576324247851087
Energy: 0.31740330219983826
Energy: 0.3457632424779049
Energy: 0.31667948249138006
Energy: 0.3157337807786214
Energy: 0.319436968943946
Energy: 0.3157337807780154
Energy: 0.3190720906658919
Energy: 0.3458197061292344
Energy: 0.34808754192633734
Energy: 0.3458197061286284
Energy: 0.31794862871264457
Energy: 0.3156469584234537
Energy: 0.32041775490771723
Energy: 0.3156469584252716
Energy: 0.31838268602799025
Energy: 0.3156387026436227
Energy: 0.40027348477762975
Energy: 0.3156387026436227
Energy: 0.3225682240223676
Energy: 0.341348888056812
Energy: 0.31899379259776806
Energy: 0.341348888056812
Energy: 0.40053919608318395
Energy: 0.3221091947297228
Energy: 0.32268401790125634
Energy: 0.3221091947297228
Energy: 0.3320292237352164
Energy: 0.31879836477861206
Energy: 0.3196634312502508
Energy: 0.3187983647792181
Energy: 0.32739273454014045
Energy: 0.3142564380825964
Energy: 0.350109597776422
Energy: 0.31425643808199044
Energy: 0.3181183224584364
Energy: 0.3129619773111826
Energy: 0.34187597010149473
Energy: 0.3129619773117886
Energy: 0.3506577572188638
Energy: 0.3140424693122706
Energy: 0.3159543617754103
Energy: 0.3140424693110586
Energy: 0.3284783907422998
Energy: 0.3137673687371406
Energy: 0.3209987046237216
Energy: 0.31376736873774663
Energy: 0.319253236674133
Energy: 0.3168836779817349
Energy: 0.3217022007484638
Energy: 0.31688367798112893
Energy: 0.31247850689504436
Energy: 0.3202022602716854
Energy: 0.32137502686939456
Energy: 0.3202022602716854
Energy: 0.3162386689995097
Energy: 0.3152951836215767
Energy: 0.3189863353199667
Energy: 0.31529518362218273
Energy: 0.3200772334566922
Energy: 0.31571784986805335
Energy: 0.31771331317940427
Energy: 0.3157178498686594
Energy: 0.31746875656777285
Energy: 0.3161437971569424
Energy: 0.34615452613539527
Energy: 0.31614379715633645

minimum gb energy = 0.31247850689504436 eV
minimum distance =  2.49925738975808 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 0.4960701754772251
Energy: 0.35798507190868384
Energy: 0.35922389948757727
Energy: 0.3254998741265151
Energy: 0.32643824398535964
Energy: 0.35565699195745204
Energy: 0.32692309404321385
Energy: 0.35565699195880257
Energy: 0.3589202027381821
Energy: 0.35717449266063217
Energy: 0.451921518169853
Energy: 0.3571744926613231
Energy: 0.3255972243021916
Energy: 0.3235478203503468
Energy: 0.32715714422552306
Energy: 0.3235478203475831
Energy: 0.4522222288059549
Energy: 0.32293452104042775
Energy: 0.3244663104233135
Energy: 0.32293452103973685
Energy: 0.32714444743168936
Energy: 0.33151485698238753
Energy: 0.3280178898803459
Energy: 0.3315148569927201
Energy: 0.33555559978505056
Energy: 0.3324975507861257
Energy: 0.37848786100447246
Energy: 0.3324975507888895
Energy: 0.3281689358782438
Energy: 0.32640369203461034
Energy: 0.3398293219738295
Energy: 0.32640369203461034
Energy: 0.37899020144356566
Energy: 0.32673031849481954
Energy: 0.3475595059449334
Energy: 0.3267303184996561
Energy: 0.3391213088807785
Energy: 0.32697394089281856
Energy: 0.3268474980622843
Energy: 0.3269739408962732
Energy: 0.32654625969179546
Energy: 0.3325137585555229
Energy: 0.3356226576175531
Energy: 0.33251375855275916
Energy: 0.3266228121646336
Energy: 0.331458586279021
Energy: 0.3300103576132025
Energy: 0.33145858627833
Energy: 0.32399037037572753
Energy: 0.322903507472065
Energy: 0.32591873063711035
Energy: 0.32290350747068314
Energy: 0.32635387273067196
Energy: 0.32327273525689315
Energy: 0.32497923452566957
Energy: 0.3232727352603478
Energy: 0.32314936633843666
Energy: 0.35695154347525526
Energy: 0.35784961812103877
Energy: 0.35695154347732805
Energy: 0.32630571916838147
Energy: 0.3234206035605306
Energy: 0.3269570958281973
Energy: 0.3234206035543122
Energy: 0.357804097317202
Energy: 0.3567547343366972
Energy: 0.3256042617266819
Energy: 0.3567547343429156
Energy: 0.32576917457158294
Energy: 0.3233364204360365
Energy: 0.3255462142452787
Energy: 0.32333642043880023
Energy: 0.3263213677573707
Energy: 0.32320654924131964
Energy: 0.3259841283293321
Energy: 0.3232065492420106
Energy: 0.32640693774936724
Energy: 0.3228462187156746
Energy: 0.3286259362342162
Energy: 0.3228462187142927
Energy: 0.3345779085954753
Energy: 0.33291641446101133
Energy: 0.37816837306697343
Energy: 0.33291641446650744
Energy: 0.32751888106352045
Energy: 0.3318872882087082
Energy: 0.34128293514213504
Energy: 0.33188728820248975
Energy: 0.37916680292862753
Energy: 0.3272432753161788
Energy: 0.34377156184586016
Energy: 0.3272432753244701
Energy: 0.3392572060950621
Energy: 0.3261342642426614
Energy: 0.3289635057857399
Energy: 0.326134264247498
Energy: 0.326382515907632
Energy: 0.33221261147542014
Energy: 0.3355327663275671
Energy: 0.33221261147749287
Energy: 0.3267196179497127
Energy: 0.33040934833513513
Energy: 0.32842307195996134
Energy: 0.33040934833651703
Energy: 0.32375179958702904
Energy: 0.32285797723632514
Energy: 0.3257555484147829
Energy: 0.3228579772370161
Energy: 0.3262255913672102
Energy: 0.3227543713577966
Energy: 0.3237756814527615
Energy: 0.3227543713598694
Energy: 0.32291835110331935
Energy: 0.32400215458974874
Energy: 0.35738223278377795
Energy: 0.3240021545938943

minimum gb energy = 0.3227543713577966 eV
minimum distance =  2.49004317967681 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 0.4729700863230158
Energy: 0.36924988855292773
Energy: 0.3689722141462205
Energy: 0.32944805681997646
Energy: 0.33337516606842194
Energy: 0.36212596654291485
Energy: 0.33368026901147807
Energy: 0.36212596654291485
Energy: 0.36937638877970813
Energy: 0.36865033391284724
Energy: 0.4249177141017529
Energy: 0.36865033391284724
Energy: 0.3313772710237529
Energy: 0.32974005897887904
Energy: 0.33343271459404145
Energy: 0.32974005897807585
Energy: 0.33223024344067015
Energy: 0.3298897735650852
Energy: 0.32994068787043984
Energy: 0.3298897735658884
Energy: 0.3373352231396463
Energy: 0.3567282593274472
Energy: 0.33331630524485534
Energy: 0.3567282593274472
Energy: 0.3392586088605676
Energy: 0.34412628883659124
Energy: 0.3549598357027779
Energy: 0.34412628883659124
Energy: 0.33607505534803345
Energy: 0.3407104413280379
Energy: 0.3351261000028946
Energy: 0.3407104413288411
Energy: 0.3563622472584776
Energy: 0.3436682073189316
Energy: 0.3340072013770473
Energy: 0.3436682073189316
Energy: 0.3369044107356835
Energy: 0.3430002312485506
Energy: 0.33254487671592486
Energy: 0.3430002312485506
Energy: 0.3272568982223267
Energy: 0.3301735818051975
Energy: 0.32914030613188033
Energy: 0.33017358180359113
Energy: 0.32713424433806404
Energy: 0.330634796365261
Energy: 0.3330144141362554
Energy: 0.33063479636686743
Energy: 0.36797529506198606
Energy: 0.36788799924827265
Energy: 0.3265097593253759
Energy: 0.36788799924827265
Energy: 0.3335625930851039
Energy: 0.3301548777709782
Energy: 0.33363905119878584
Energy: 0.3301548777709782
Energy: 0.33221670693148225
Energy: 0.3681567363969128
Energy: 0.3702725397419432
Energy: 0.3681567363969128
Energy: 0.3358046184058743
Energy: 0.3294345177981788
Energy: 0.331155575147631
Energy: 0.329434517798982
Energy: 0.33222040792286844
Energy: 0.32934039864859854
Energy: 0.33159624680925404
Energy: 0.32934039864779546
Energy: 0.3299423479743835
Energy: 0.32948263626248303
Energy: 0.3387257677193801
Energy: 0.3294826362616798
Energy: 0.35485265053927534
Energy: 0.34552077456994196
Energy: 0.33902540456416924
Energy: 0.34552077456994196
Energy: 0.33528455196796336
Energy: 0.34400827259389477
Energy: 0.33750922107769493
Energy: 0.344008272594698
Energy: 0.33374369538677434
Energy: 0.34401510438921973
Energy: 0.3563694326346544
Energy: 0.344015104390023
Energy: 0.3334485266804863
Energy: 0.34304269774728485
Energy: 0.33650991511136974
Energy: 0.34304269774728485
Energy: 0.33102247365300635
Energy: 0.33027131792426
Energy: 0.3274105041565288
Energy: 0.33027131792426
Energy: 0.33280690178030203
Energy: 0.3300397741677207
Energy: 0.32719992482609767
Energy: 0.3300397741669175
Energy: 0.3262075382136835
Energy: 0.33213123025346475
Energy: 0.36806133411971176
Energy: 0.3321312302526615

minimum gb energy = 0.3262075382136835 eV
minimum distance =  2.49246184745398 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 0.4386367408806848
Energy: 0.3796635285350142
Energy: 0.37989500078630684
Energy: 0.3283916202957972
Energy: 0.34638144976484553
Energy: 0.36395619796235285
Energy: 0.346439765647448
Energy: 0.3639561979633111
Energy: 0.38039362706126034
Energy: 0.3792163984054796
Energy: 0.3783378193737187
Energy: 0.3792163984045215
Energy: 0.3386915214928875
Energy: 0.3418538461247078
Energy: 0.3470076673348257
Energy: 0.3418538461237497
Energy: 0.33692590521608934
Energy: 0.34107887071208115
Energy: 0.33767553462954614
Energy: 0.3410788707130393
Energy: 0.3707949597442003
Energy: 0.3663895214201451
Energy: 0.3406327467792498
Energy: 0.36638952141822884
Energy: 0.3468432164586465
Energy: 0.3599094504285838
Energy: 0.3395505781698293
Energy: 0.3599094504285838
Energy: 0.3397178116390207
Energy: 0.3605901501637675
Energy: 0.3704763842481037
Energy: 0.3605901501628093
Energy: 0.3367232640813153
Energy: 0.34208881007757697
Energy: 0.3250525125867568
Energy: 0.34208881007853514
Energy: 0.3455277677652508
Energy: 0.3419353738338074
Energy: 0.3244916976029783
Energy: 0.34193537383572375
Energy: 0.3231172438251227
Energy: 0.3777674320862405
Energy: 0.37773238077503635
Energy: 0.37776743208528224
Energy: 0.34868849076531727
Energy: 0.3419337488458015
Energy: 0.339431537349367
Energy: 0.3419337488486542
Energy: 0.38153070605864686
Energy: 0.37798721639204735
Energy: 0.3780108547915862
Energy: 0.37798721639204735
Energy: 0.3376455600879597
Energy: 0.36513756074199316
Energy: 0.333569911033258
Energy: 0.36513756074199316
Energy: 0.3369466332290701
Energy: 0.34122165376748215
Energy: 0.3365936535719251
Energy: 0.34122165376748215
Energy: 0.33873518571574884
Energy: 0.34076917190103606
Energy: 0.3370269594221884
Energy: 0.34076917189911976
Energy: 0.34835126867499616
Energy: 0.36119861969441325
Energy: 0.33976774447787106
Energy: 0.36119861969537137
Energy: 0.3490573428371463
Energy: 0.3606500989413986
Energy: 0.3396212055050505
Energy: 0.36065009894235683
Energy: 0.33613905073261985
Energy: 0.3421316657364502
Energy: 0.32442304372670233
Energy: 0.3421316657383665
Energy: 0.33967560497720745
Energy: 0.34213300367067817
Energy: 0.3244893767026722
Energy: 0.34213300367067817
Energy: 0.3227493716479705
Energy: 0.34259309242160585
Energy: 0.3778907242783769
Energy: 0.342593092422564

minimum gb energy = 0.3227493716479705 eV
minimum distance =  2.47162202615966 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 0.3914116940148358
Energy: 0.38805439781093526
Energy: 0.38891321434018034
Energy: 0.32229843530053476
Energy: 0.3317818517888629
Energy: 0.3490398789045065
Energy: 0.3296831322148976
Energy: 0.3490398789045065
Energy: 0.3881072207709465
Energy: 0.387953269709093
Energy: 0.3172219709007818
Energy: 0.387953269709093
Energy: 0.31909809073525913
Energy: 0.3489070581554273
Energy: 0.3298865546802865
Energy: 0.3489070581554273
Energy: 0.3506851700486287
Energy: 0.3544548223041453
Energy: 0.3304867883216985
Energy: 0.3544548223041453
Energy: 0.31878348115667965
Energy: 0.35455398350444134
Energy: 0.32990646258649287
Energy: 0.3545539835032564
Energy: 0.3163985323585734
Energy: 0.35445001080671135
Energy: 0.3517754164317339
Energy: 0.3544500108055264
Energy: 0.31643995074993075
Energy: 0.35379815285722943
Energy: 0.33131409994772376
Energy: 0.35379815285841437
Energy: 0.3869488388130728
Energy: 0.3861718170973741
Energy: 0.31587712877234303
Energy: 0.3861718170950042
Energy: 0.3308079392895007
Energy: 0.3500242823276265
Energy: 0.3167859815421244
Energy: 0.3500242823276265
Energy: 0.31756467332860244
Energy: 0.38750708122066296
Energy: 0.39110319616149564
Energy: 0.38750708122066296
Energy: 0.3174930770291978
Energy: 0.35001272468870875
Energy: 0.3191344536917463
Energy: 0.35001272468870875
Energy: 0.3303072146543044
Energy: 0.35438531533219036
Energy: 0.35102092799046314
Energy: 0.3543853153310055
Energy: 0.33016756112376644
Energy: 0.35446102109771604
Energy: 0.3197908732874261
Energy: 0.35446102109653116
Energy: 0.3542286633381102
Energy: 0.3539295230920704
Energy: 0.31633167908080884
Energy: 0.3539295230920704
Energy: 0.3300893575686131
Energy: 0.35434824115212715
Energy: 0.31657173958552315
Energy: 0.35434824115212715
Energy: 0.31590870339142474
Energy: 0.3582744947744053
Energy: 0.3858257556809372
Energy: 0.3582744947732204

minimum gb energy = 0.31587712877234303 eV
minimum distance =  2.55316748798507 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 0.5458340748207693
Energy: 0.43320710027202675
Energy: 0.4330926971668919
Energy: 0.39187193389202724
Energy: 0.34866487614809466
Energy: 0.3508796725868924
Energy: 0.3494841975377989
Energy: 0.35087967258555025
Energy: 0.35688894880278094
Energy: 0.3570018802765852
Energy: 0.37144059190744677
Energy: 0.3570018802759141
Energy: 0.3493224331818714
Energy: 0.3798481468384141
Energy: 0.3490878647313079
Energy: 0.37984814683707196
Energy: 0.37784039097956645
Energy: 0.38387167817619616
Energy: 0.36735761220662366
Energy: 0.38387167817619616
Energy: 0.3503424091064222
Energy: 0.3844821257713832
Energy: 0.34975406226727507
Energy: 0.3844821257713832
Energy: 0.3743290197022453
Energy: 0.3564186617647211
Energy: 0.35833621642583374
Energy: 0.3564186617647211
Energy: 0.37091483445653567
Energy: 0.3528697406216567
Energy: 0.34945175222674796
Energy: 0.3528697406209857
Energy: 0.43744439580089445
Energy: 0.43351691099603457
Energy: 0.3713783398016749
Energy: 0.4335169109953635
Energy: 0.4230374407911209
Energy: 0.37578218252899465
Energy: 0.348947657171121
Energy: 0.37578218252832357
Energy: 0.3762391040298913
Energy: 0.35270002474628187
Energy: 0.33622210001770003
Energy: 0.35270002474628187
Energy: 0.3745911307798952
Energy: 0.35276677875869394
Energy: 0.3497295937674362
Energy: 0.35276677875869394
Energy: 0.3721772815661608
Energy: 0.35245501856174155
Energy: 0.3490396305668827
Energy: 0.35245501856174155
Energy: 0.3722189461570054
Energy: 0.3529219431586619
Energy: 0.3367753865385
Energy: 0.3529219431579908
Energy: 0.43348629418657936
Energy: 0.3946746509177964
Energy: 0.3702234883571923
Energy: 0.39467465091846754
Energy: 0.4408338948966038
Energy: 0.3885915590118446
Energy: 0.37107632393594797
Energy: 0.38859155901117354
Energy: 0.3707238194151543
Energy: 0.34904362463903893
Energy: 0.3562298603670195
Energy: 0.34904362463836786
Energy: 0.37094872586790734
Energy: 0.3488977725186788
Energy: 0.3565681074865422
Energy: 0.34889777252002097
Energy: 0.35295995952306575
Energy: 0.3843982742468281
Energy: 0.37497977030730756
Energy: 0.3843982742468281
Energy: 0.36953860090327745
Energy: 0.3851906863639847
Energy: 0.35043314171621814
Energy: 0.3851906863639847
Energy: 0.3506382826211156
Energy: 0.35134312236080933
Energy: 0.3712801825635152
Energy: 0.3513431223614804
Energy: 0.35602651968158855
Energy: 0.3565221084663378
Energy: 0.3700742358212573
Energy: 0.3565221084656668
Energy: 0.34832257396857985
Energy: 0.3693105694300984
Energy: 0.34932665522674394
Energy: 0.3693105694321117
Energy: 0.3714494629175942
Energy: 0.4337151260776346
Energy: 0.4335392293429051
Energy: 0.4337151260789768
Energy: 0.3479563184506538
Energy: 0.3527740604788957
Energy: 0.37231529299309746
Energy: 0.3527740604782246
Energy: 0.34980109521636693
Energy: 0.35270878159131613
Energy: 0.3753106016610563
Energy: 0.3527087815919872
Energy: 0.33615069191270214
Energy: 0.34874922612847264
Energy: 0.3718642251207071
Energy: 0.34874922609961556
Energy: 0.34993661142760346
Energy: 0.35283172450546624
Energy: 0.3723243732029598
Energy: 0.3528317245061373
Energy: 0.34812582195200853
Energy: 0.353526152753461
Energy: 0.3711848914818137
Energy: 0.35352615275279
Energy: 0.37128540641176
Energy: 0.4330832243261768
Energy: 0.43250639819908904
Energy: 0.43308322432550567

minimum gb energy = 0.33615069191270214 eV
minimum distance =  2.58914935501711 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 0.5015302344310981
Energy: 0.3835983221637482
Energy: 0.38505797913542883
Energy: 0.3049614564498368
Energy: 0.3713764678299487
Energy: 0.3247759603738016
Energy: 0.3835913486986736
Energy: 0.3247759603738016
Energy: 0.38399810558235864
Energy: 0.38358350828086063
Energy: 0.37315423353134936
Energy: 0.38358350827931564
Energy: 0.3733687274163738
Energy: 0.32551130336195006
Energy: 0.36788651565487335
Energy: 0.32551130336195006
Energy: 0.3769521628409809
Energy: 0.3248365792325828
Energy: 0.29608805104321867
Energy: 0.32483657922949283
Energy: 0.366655099285018
Energy: 0.32675286786184776
Energy: 0.29614634464669054
Energy: 0.3267528678649377
Energy: 0.44165007538248086
Energy: 0.38251321486777695
Energy: 0.38338460172107414
Energy: 0.3825132148693219
Energy: 0.4424226607005077
Energy: 0.32598858748830334
Energy: 0.38261209870594465
Energy: 0.3259885874898483
Energy: 0.38451034068500733
Energy: 0.3832755473714859
Energy: 0.3733536253621775
Energy: 0.3832755473699409
Energy: 0.37269829387036285
Energy: 0.3251692819903006
Energy: 0.37258944523546095
Energy: 0.3251692819918455
Energy: 0.37725472378711833
Energy: 0.3274329860475233
Energy: 0.3052380134654923
Energy: 0.32743298604906823
Energy: 0.37290462215584014
Energy: 0.3245779509205824
Energy: 0.2982524639036629
Energy: 0.3245779509190374
Energy: 0.44279064881928176
Energy: 0.3261666474514164
Energy: 0.3815973372389291
Energy: 0.3261666474514164

minimum gb energy = 0.29608805104321867 eV
minimum distance =  2.58536290355007 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 0.49090699951118255
Energy: 0.45231286705975765
Energy: 0.4528133400947295
Energy: 0.4038685361192821
Energy: 0.3867341151992843
Energy: 0.3467660987062049
Energy: 0.47779820358011915
Energy: 0.34676609870677677
Energy: 0.3499167027943076
Energy: 0.34554488328082317
Energy: 0.439434950863075
Energy: 0.3455448832791077
Energy: 0.34751172767220473
Energy: 0.3463860132672
Energy: 0.4690784421423648
Energy: 0.3463860132672
Energy: 0.3467627818158365
Energy: 0.34517422660436425
Energy: 0.4662498193875033
Energy: 0.3451742266032206
Energy: 0.3453962144509696
Energy: 0.347823398548337
Energy: 0.46561834745766656
Energy: 0.3478233985471934
Energy: 0.4644897975002253
Energy: 0.43672731296488154
Energy: 0.44238788432909415
Energy: 0.43672731296602524
Energy: 0.4673098161783982
Energy: 0.34577646529114214
Energy: 0.43532383926879037
Energy: 0.3457764652894266
Energy: 0.37365730490856114
Energy: 0.38468586979893465
Energy: 0.37570997466051054
Energy: 0.38468586979893465
Energy: 0.34288471650355884
Energy: 0.3783751970195009
Energy: 0.4323977987783444
Energy: 0.37837519701778544
Energy: 0.37367291119630774
Energy: 0.3675740793483409
Energy: 0.48634475504526614
Energy: 0.36757407934776903
Energy: 0.3724876300310123
Energy: 0.37350592354252815
Energy: 0.46741032121199416
Energy: 0.3735059235430999
Energy: 0.47485589526379524
Energy: 0.36725625341296
Energy: 0.39847062751063217
Energy: 0.3672562534135318
Energy: 0.48441129875178207
Energy: 0.37414295462909064
Energy: 0.37609156107668673
Energy: 0.3741429546285188
Energy: 0.4341918545114984
Energy: 0.3833043058834744
Energy: 0.37926189001115895
Energy: 0.38330430588175896
Energy: 0.40773135994468446
Energy: 0.3812600573717126
Energy: 0.3802516211207503
Energy: 0.38126005737056895
Energy: 0.43768318642355636
Energy: 0.3460239692873148
Energy: 0.38128290745010773
Energy: 0.34602396928788665
Energy: 0.4537292291450374
Energy: 0.4331299001525492
Energy: 0.4615735307033107
Energy: 0.4331299001525492
Energy: 0.4428034121091792
Energy: 0.34613765408409713
Energy: 0.4128635022261067
Energy: 0.34613765408409713
Energy: 0.4493579731080469
Energy: 0.345584570830548
Energy: 0.34553529677207334
Energy: 0.345584570830548
Energy: 0.4706549082899976
Energy: 0.34626938109625804
Energy: 0.34810476533375506
Energy: 0.3462693810956862
Energy: 0.4649349171612089
Energy: 0.3455290703447137
Energy: 0.34595604463438245
Energy: 0.3455290703452855
Energy: 0.46613802252743985
Energy: 0.3461314525902518
Energy: 0.3455879128492656
Energy: 0.3461314525913954
Energy: 0.44358751940037966
Energy: 0.4357510603889751
Energy: 0.4649471103894163
Energy: 0.43575106038783146
Energy: 0.43560053672640325
Energy: 0.3456980624640073
Energy: 0.46517012837835964
Energy: 0.3456980624634355
Energy: 0.37625527075608406
Energy: 0.3864051803240491
Energy: 0.3741864139940934
Energy: 0.38640518032290544
Energy: 0.4319966719739311
Energy: 0.3469654625416533
Energy: 0.34261594577657145
Energy: 0.34696546254108146
Energy: 0.48509789677735665
Energy: 0.3679606601048689
Energy: 0.37417820315299666
Energy: 0.3679606601048689
Energy: 0.4616404015719778
Energy: 0.3800565752983674
Energy: 0.3729859133477149
Energy: 0.38005657529893927
Energy: 0.43799717962260876
Energy: 0.36695008687065866
Energy: 0.4652979112241142
Energy: 0.3669500868712305
Energy: 0.3782367573606749
Energy: 0.3730791858627041
Energy: 0.4382493960644154
Energy: 0.3730791858644195
Energy: 0.3773064584599859
Energy: 0.3797350162056996
Energy: 0.4352108385631641
Energy: 0.37973501620512784
Energy: 0.37848574769416105
Energy: 0.38213872796729625
Energy: 0.40782919449467975
Energy: 0.38213872796958354
Energy: 0.3729834848345181
Energy: 0.3459841511768864
Energy: 0.399995620794978
Energy: 0.3459841511768864
Energy: 0.46821692606909365
Energy: 0.43363337464385954
Energy: 0.43927704343641016
Energy: 0.43363337464271595

minimum gb energy = 0.34261594577657145 eV
minimum distance =  2.49160853453279 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 0.5348995604295183
Energy: 0.4362566082680771
Energy: 0.43558120052554056
Energy: 0.3846854831687545
Energy: 0.35715134182921227
Energy: 0.38762592534902096
Energy: 0.4095115788835046
Energy: 0.3876259253499282
Energy: 0.35460821297348505
Energy: 0.35531593175918913
Energy: 0.4252501260246385
Energy: 0.3553159317582819
Energy: 0.3544761343098643
Energy: 0.35572839804583045
Energy: 0.4637805026733772
Energy: 0.35572839804492323
Energy: 0.3592677922992063
Energy: 0.3571280062370308
Energy: 0.45787925338680885
Energy: 0.35712800623612356
Energy: 0.38721030287626196
Energy: 0.3576555936178495
Energy: 0.4573038797062598
Energy: 0.357655593619664
Energy: 0.4006194897162433
Energy: 0.42316872025812224
Energy: 0.43417643001065515
Energy: 0.42316872025812224
Energy: 0.4000195481529737
Energy: 0.3547447857068371
Energy: 0.428618927558762
Energy: 0.3547447857068371
Energy: 0.3890488506338152
Energy: 0.39278950310930133
Energy: 0.42775574985187986
Energy: 0.39278950310930133
Energy: 0.3720078117676195
Energy: 0.35205421385713026
Energy: 0.4220422432046941
Energy: 0.35205421385894475
Energy: 0.38086270207971196
Energy: 0.34506242144292937
Energy: 0.45135638218409546
Energy: 0.34506242144292937
Energy: 0.37193086336691766
Energy: 0.34760677098891246
Energy: 0.4440288067811775
Energy: 0.34760677098800524
Energy: 0.4254932522858018
Energy: 0.3925580775443069
Energy: 0.36919598407542975
Energy: 0.3925580775424924
Energy: 0.42346799165618393
Energy: 0.3481372447980216
Energy: 0.3782445307055652
Energy: 0.3481372447989289
Energy: 0.4302591119342827
Energy: 0.38481088564954036
Energy: 0.3673280421582094
Energy: 0.38481088564954036
Energy: 0.458165136401309
Energy: 0.3687910042298939
Energy: 0.368526967065861
Energy: 0.3687910042298939
Energy: 0.4574668562365348
Energy: 0.382750468756987
Energy: 0.4018251666197462
Energy: 0.3827504687578942
Energy: 0.43812828707021007
Energy: 0.41731833847813943
Energy: 0.4003246388273679
Energy: 0.41731833847813943
Energy: 0.411871198815484
Energy: 0.38200049223608656
Energy: 0.3999979396971356
Energy: 0.3820004922369938
Energy: 0.4113723683823256
Energy: 0.39045222371398103
Energy: 0.4095816176786606
Energy: 0.3904522237148883
Energy: 0.41247921906089435
Energy: 0.38389513275491916
Energy: 0.3725838371768236
Energy: 0.3838951327567337
Energy: 0.4532857936365973
Energy: 0.3838881861877045
Energy: 0.41072715790376607
Energy: 0.38388818618679726

minimum gb energy = 0.34506242144292937 eV
minimum distance =  2.5194632953626 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 0.6551680890787887
Energy: 0.4457897171651743
Energy: 0.44929634678362274
Energy: 0.387242156390169
Energy: 0.36784029529316636
Energy: 0.36270880506741876
Energy: 0.4395644512518432
Energy: 0.36270880507255093
Energy: 0.35821772261154733
Energy: 0.36366717458618836
Energy: 0.40217212139911884
Energy: 0.3636671745829808
Energy: 0.36027121403281015
Energy: 0.36017993808117954
Energy: 0.4562442488765765
Energy: 0.3601799380824625
Energy: 0.3675855166390649
Energy: 0.3648544482995588
Energy: 0.43955630006073454
Energy: 0.3648544483014834
Energy: 0.40297283912985216
Energy: 0.366137849265064
Energy: 0.43979118225949004
Energy: 0.3661378492631394
Energy: 0.4578351276837246
Energy: 0.3649221074939669
Energy: 0.3722067870919736
Energy: 0.36492210749524995
Energy: 0.45412512194489185
Energy: 0.36606112739637786
Energy: 0.364766843732247
Energy: 0.3660611273944533
Energy: 0.43943960687250616
Energy: 0.3611586917037439
Energy: 0.3588987866595636
Energy: 0.36115869170631
Energy: 0.4449834056954709
Energy: 0.3945499243620708
Energy: 0.36610706464266635
Energy: 0.39454992436142927
Energy: 0.4520423401062106
Energy: 0.3593777544738397
Energy: 0.4511813488313304
Energy: 0.3593777544770473
Energy: 0.41577469923641924
Energy: 0.40403766787497764
Energy: 0.45294408784083584
Energy: 0.4040376678788267
Energy: 0.41099893690028855
Energy: 0.3875363571464163
Energy: 0.4134752371134037
Energy: 0.38753635714256723
Energy: 0.4048802988852669
Energy: 0.3850265350480863
Energy: 0.3663088934594933
Energy: 0.38502653504872775
Energy: 0.4148010655067623
Energy: 0.3876529750101415
Energy: 0.3741878934625273
Energy: 0.3876529750107831
Energy: 0.45536471320686805
Energy: 0.40380713662938605
Energy: 0.41336701622885147
Energy: 0.4038071366287445
Energy: 0.4524869617769265
Energy: 0.35965833354387067
Energy: 0.4563749762308843
Energy: 0.3596583335451537
Energy: 0.3711444240131021
Energy: 0.3946089256443963
Energy: 0.40304962057496735
Energy: 0.39460892564696237
Energy: 0.35948583553927926
Energy: 0.3612682932880008
Energy: 0.45523113365190565
Energy: 0.3612682932931329
Energy: 0.3651190579188178
Energy: 0.36689649432156746
Energy: 0.4294288802618366
Energy: 0.36689649432413346
Energy: 0.37230420644556184
Energy: 0.3646079520680865
Energy: 0.43971813034576734
Energy: 0.3646079520642374
Energy: 0.45464882422815805
Energy: 0.3662393333019511
Energy: 0.402802938037382
Energy: 0.3662393333038464
Energy: 0.45550057952412987
Energy: 0.3648387431244309
Energy: 0.3653586841657735
Energy: 0.3648387431244309
Energy: 0.4547776613841115
Energy: 0.36117669094917276
Energy: 0.36007174202701864
Energy: 0.36117669095045574
Energy: 0.442734390958118
Energy: 0.3635651518050574
Energy: 0.3583325119206318
Energy: 0.3635651518044159
Energy: 0.4484577370588799
Energy: 0.3614697635302781
Energy: 0.36472092091939196
Energy: 0.3614697635334857
Energy: 0.44672834406115525
Energy: 0.44554343250078016
Energy: 0.5489496651774249
Energy: 0.4455434325020632
Energy: 0.41275512727462255
Energy: 0.394343738254925
Energy: 0.4130334932650144
Energy: 0.39434373824918056
Energy: 0.40351771146078935
Energy: 0.394920601526521
Energy: 0.4072759397845699
Energy: 0.39492060153165315
Energy: 0.41241031937120853
Energy: 0.3857295864034737
Energy: 0.36601900622183803
Energy: 0.38572958640539823
Energy: 0.4556217607680782
Energy: 0.41266821295004447
Energy: 0.4184453439786235
Energy: 0.4126682129468369

minimum gb energy = 0.35821772261154733 eV
minimum distance =  2.5653709941779 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.3353939598190336
Energy: 0.43184507153791013
Energy: 0.417578475699473
Energy: 0.3360948968778754
Energy: 0.3541523217734898
Energy: 0.3878963870740092
Energy: 0.3529546302858294
Energy: 0.38789638707465474
Energy: 0.3543051021266758
Energy: 0.3705725528249162
Energy: 0.34917047753223857
Energy: 0.3705725528251396
Energy: 0.3550409937480753
Energy: 0.379631876038798
Energy: 0.3716240182172763
Energy: 0.37963187603902143
Energy: 0.35289131739491036
Energy: 0.3540516272157372
Energy: 0.3354625803069408
Energy: 0.35405162721509165
Energy: 0.37103788484949846
Energy: 0.38528622375435284
Energy: 0.3353954025338943
Energy: 0.38528622375412935
Energy: 0.3502609424692307
Energy: 0.3639709916749543
Energy: 0.355369206486277
Energy: 0.36397099168523334
Energy: 0.35299898326799645
Energy: 0.34472088979508514
Energy: 0.3632815437002321
Energy: 0.34472088979486165
Energy: 0.3618719883374081
Energy: 0.3445707128751421
Energy: 0.35198532658449827
Energy: 0.3445707128720882

minimum gb energy = 0.3353939598190336 eV
minimum distance =  2.55548543546901 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 0.5757751577481739
Energy: 0.42786183516746423
Energy: 0.4284030545052162
Energy: 0.34100113420491057
Energy: 0.41730718903106895
Energy: 0.3470691555265321
Energy: 0.40791161251097585
Energy: 0.3470691555265321
Energy: 0.420532072251314
Energy: 0.38013645253570083
Energy: 0.4235831901630247
Energy: 0.38013645253570083
Energy: 0.3924838038782562
Energy: 0.3477051466159213
Energy: 0.4182886218158778
Energy: 0.3477051466189512
Energy: 0.39915292905153665
Energy: 0.3470241464510143
Energy: 0.39375222344730265
Energy: 0.34702414645040836
Energy: 0.34889897839424105
Energy: 0.36416516573243307
Energy: 0.3947076985817511
Energy: 0.3641651657336451
Energy: 0.34719457849681856
Energy: 0.3475644686244804
Energy: 0.41811583956209214
Energy: 0.3475644686299344
Energy: 0.3632237013852627
Energy: 0.34803086173816966
Energy: 0.4549671811320408
Energy: 0.3480308617351397
Energy: 0.41042883109970624
Energy: 0.3601936939771703
Energy: 0.43284496802116684
Energy: 0.36019369397777634
Energy: 0.4611901093313209
Energy: 0.3391665509403524
Energy: 0.34742904996725354
Energy: 0.3391665509391404
Energy: 0.4065924571355335
Energy: 0.33961127083857184
Energy: 0.34255534081601946
Energy: 0.33961127083917775
Energy: 0.4542393636026039
Energy: 0.342699355958931
Energy: 0.34444508182839123
Energy: 0.34269935595711304
Energy: 0.4553801764926748
Energy: 0.3392624026322353
Energy: 0.3820447962626449
Energy: 0.33926240263102336
Energy: 0.4045891838384777
Energy: 0.3328317412945959
Energy: 0.4562269710907024
Energy: 0.3328317412945959
Energy: 0.3714319863587736
Energy: 0.332647233595586
Energy: 0.4527408589081767
Energy: 0.3326472336004339
Energy: 0.3750754721591181
Energy: 0.33206612162785804
Energy: 0.3928649241176487
Energy: 0.33206612162846405
Energy: 0.361341037003425
Energy: 0.332329960526538
Energy: 0.354360809296171
Energy: 0.33232996052593194
Energy: 0.4132598759822733
Energy: 0.3322080964241951
Energy: 0.39704580686578334
Energy: 0.33220809642358906
Energy: 0.4442777623136886
Energy: 0.3658722559937284
Energy: 0.3901847129907056
Energy: 0.3658722559967583
Energy: 0.4200484617660044
Energy: 0.3875955441978999
Energy: 0.39226694733211737
Energy: 0.38759554419971787
Energy: 0.39538596388962416
Energy: 0.3541795134443512
Energy: 0.3665935946625901
Energy: 0.3541795134455632
Energy: 0.3931941864887757
Energy: 0.34993270424660766
Energy: 0.3501320258301111
Energy: 0.3499327042447897
Energy: 0.42782086118044044
Energy: 0.35009004938650384
Energy: 0.3509302572906097
Energy: 0.35009004938832183
Energy: 0.45479421843615114
Energy: 0.3498673596126762
Energy: 0.354209229749631
Energy: 0.3498673596126762
Energy: 0.45170655605187704
Energy: 0.3616816215904449
Energy: 0.39652425348865555
Energy: 0.3616816215910509
Energy: 0.3461955031699094
Energy: 0.34022324235683593
Energy: 0.4513232137375672
Energy: 0.340223242354412
Energy: 0.3426405057655203
Energy: 0.3364811505736777
Energy: 0.40227457834679226
Energy: 0.3364811505742837
Energy: 0.3456723007278626
Energy: 0.3402716395509297
Energy: 0.38948479796449775
Energy: 0.3402716395521417
Energy: 0.41229088527584534
Energy: 0.33635905764190277
Energy: 0.4577457745394167
Energy: 0.3363590576449326
Energy: 0.45630605727795304
Energy: 0.35626627445155656
Energy: 0.39379125928135317
Energy: 0.35626627445337455
Energy: 0.4550391568048909
Energy: 0.34668612224706047
Energy: 0.3499795847964379
Energy: 0.3466861222488785
Energy: 0.41816958411118893
Energy: 0.3467697785314632
Energy: 0.3491246635682173
Energy: 0.34676977853025126
Energy: 0.35148319939539074
Energy: 0.34683195721516635
Energy: 0.3469186652910015
Energy: 0.3468319572175903

minimum gb energy = 0.33206612162785804 eV
minimum distance =  2.49429345625813 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 0.5711080227768711
Energy: 0.327301197542825
Energy: 0.4140541625346836
Energy: 0.3190706506354243
Energy: 0.42868240928403395
Energy: 0.32306595949584477
Energy: 0.4085575589758103
Energy: 0.32306595949668265
Energy: 0.40859265466882416
Energy: 0.36487796751949214
Energy: 0.41077452540710424
Energy: 0.36487796751781626
Energy: 0.335217226276651
Energy: 0.323090411370999
Energy: 0.4315681614107374
Energy: 0.323090411370999
Energy: 0.3995251189277683
Energy: 0.3225778389796409
Energy: 0.4058695692480829
Energy: 0.3225778389771272
Energy: 0.3233056862154879
Energy: 0.3246184471185851
Energy: 0.40585815330558733
Energy: 0.3246184471194229
Energy: 0.32220795123779766
Energy: 0.32237068032352995
Energy: 0.4323176006863361
Energy: 0.32237068032352995
Energy: 0.32336197849032944
Energy: 0.3232312936663094
Energy: 0.4594671918716575
Energy: 0.3232312936671473
Energy: 0.4175524282424536
Energy: 0.34195070631605323
Energy: 0.45981119969165046
Energy: 0.3419507063143775
Energy: 0.40604485023874387
Energy: 0.329260659746503
Energy: 0.3229493608797798
Energy: 0.32926065974901664
Energy: 0.4331172603460666
Energy: 0.322765625926174
Energy: 0.32277733217158056
Energy: 0.3227656259278498
Energy: 0.45599796384405616
Energy: 0.32794224091202107
Energy: 0.3242787170074938
Energy: 0.32794224091285895
Energy: 0.4593882121203377
Energy: 0.32283496164947717
Energy: 0.32287323017975594
Energy: 0.3228349616461257
Energy: 0.4313284416248183
Energy: 0.32289823614605584
Energy: 0.4099924663049434
Energy: 0.32289823614605584
Energy: 0.3369761158778707
Energy: 0.36442179567267435
Energy: 0.4098139347579298
Energy: 0.3644217956718366
Energy: 0.33275690138341
Energy: 0.32308798285055923
Energy: 0.4315478448270797
Energy: 0.3230879828488835
Energy: 0.3291070947300315
Energy: 0.3267228525182704
Energy: 0.42034447778734185
Energy: 0.32672285251910826
Energy: 0.330231390696165
Energy: 0.32912049415541395
Energy: 0.4135330417542313
Energy: 0.32912049415457606
Energy: 0.3263301994867138
Energy: 0.32674231004813165
Energy: 0.45998538882222817
Energy: 0.3267423100498074
Energy: 0.33862257994268374
Energy: 0.33702641658889676
Energy: 0.46310787612916793
Energy: 0.33702641658973453
Energy: 0.40641699495091294
Energy: 0.33735549582780666
Energy: 0.43217354581167544
Energy: 0.33735549582780666
Energy: 0.4076001971793053
Energy: 0.3230722294647315
Energy: 0.32419289362492026
Energy: 0.3230722294672452
Energy: 0.43119095994636947
Energy: 0.3223872620961158
Energy: 0.32397241468039806
Energy: 0.32238726209862945
Energy: 0.45800402219784336
Energy: 0.3229638049507236
Energy: 0.32334968300526107
Energy: 0.3229638049515614

minimum gb energy = 0.3190706506354243 eV
minimum distance =  2.5207744427117 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 0.6285928986611531
Energy: 0.41829177022521663
Energy: 0.42050973021400884
Energy: 0.3211401854214047
Energy: 0.3853103297477425
Energy: 0.32719589703617386
Energy: 0.3893337194538846
Energy: 0.327195897035656
Energy: 0.44793203470008575
Energy: 0.32695188656708357
Energy: 0.3950674494419825
Energy: 0.3269518865681193
Energy: 0.4537706418670281
Energy: 0.34706651252773124
Energy: 0.3863573251851931
Energy: 0.3470665125282491
Energy: 0.4197105219390229
Energy: 0.31884842089122684
Energy: 0.48895396981306666
Energy: 0.3188484208901911
Energy: 0.31915307890026207
Energy: 0.3185494018773669
Energy: 0.4276396818157192
Energy: 0.3185494018773669
Energy: 0.3195224584659903
Energy: 0.3186608594519365
Energy: 0.3604657943027233
Energy: 0.31866085945038286
Energy: 0.3247724751041457
Energy: 0.31890794177108867
Energy: 0.43641591078020503
Energy: 0.31890794177160653
Energy: 0.4214008074863438
Energy: 0.3186964608287945
Energy: 0.41666279436985265
Energy: 0.31869646083138387
Energy: 0.39416238726987596
Energy: 0.3483631350225739
Energy: 0.38294481532181385
Energy: 0.3483631350225739
Energy: 0.41999223980205286
Energy: 0.3270430764383552
Energy: 0.33369413341496074
Energy: 0.3270430764378373
Energy: 0.46656257622482356
Energy: 0.32762181368334525
Energy: 0.3750192693859708
Energy: 0.32762181368334525
Energy: 0.48508535840986955
Energy: 0.3273769361249987
Energy: 0.32726117973012464
Energy: 0.3273769361239629
Energy: 0.38984952888323815
Energy: 0.3269356304481527
Energy: 0.32826836421788014
Energy: 0.3269356304486706
Energy: 0.4495689111866187
Energy: 0.3273809016258321
Energy: 0.3327686561387343
Energy: 0.3273809016247964
Energy: 0.4255122064645013
Energy: 0.33601862854996245
Energy: 0.3785064539686552
Energy: 0.3360186285504804
Energy: 0.33630509528931474
Energy: 0.3296646521438523
Energy: 0.4441275567589153
Energy: 0.329664652144888
Energy: 0.32971110984692265
Energy: 0.32731107811536403
Energy: 0.42239261844023485
Energy: 0.3273110781148461
Energy: 0.3523817669680319
Energy: 0.3276544863099038
Energy: 0.4147169699309974
Energy: 0.3276544863099038
Energy: 0.3332738481456587
Energy: 0.32716637061136505
Energy: 0.43294297913573143
Energy: 0.3271663706108472
Energy: 0.3881080635964692
Energy: 0.3269299383988714
Energy: 0.39788128473062706
Energy: 0.3269299383993422
Energy: 0.3953223593008449
Energy: 0.33099977770430355
Energy: 0.44907161007238167
Energy: 0.33099977770430355
Energy: 0.3482178040276065
Energy: 0.3763774440104494
Energy: 0.4506711851307191
Energy: 0.3763774440104494
Energy: 0.4421328411090912
Energy: 0.3189828686785599
Energy: 0.36653146602351205
Energy: 0.3189828686790778
Energy: 0.42426937589729274
Energy: 0.32016409793461365
Energy: 0.31823250740953596
Energy: 0.3201640979340958
Energy: 0.3602324753142553
Energy: 0.3188070169381639
Energy: 0.3253864931815503
Energy: 0.31880701693712815
Energy: 0.42770208025895506
Energy: 0.31950150925904336
Energy: 0.32782444678932404
Energy: 0.3195015092600791
Energy: 0.4560554954585348
Energy: 0.3188347952685033
Energy: 0.4231350682668034
Energy: 0.31883479526746755
Energy: 0.3806219298732929
Energy: 0.3473318753568305
Energy: 0.39486077022075317
Energy: 0.3473318753589021
Energy: 0.3344967600015405
Energy: 0.32647458636903653
Energy: 0.41792199954272646
Energy: 0.32647458636903653
Energy: 0.37495491668774955
Energy: 0.32565998553815395
Energy: 0.46930064192473664
Energy: 0.32565998553867187
Energy: 0.3272837439890366
Energy: 0.32638448041730206
Energy: 0.42107739154283513
Energy: 0.32638448041730206
Energy: 0.3268553770187953
Energy: 0.32670910173682216
Energy: 0.39078384804895566
Energy: 0.32670910173733997
Energy: 0.3328340971834432
Energy: 0.32766057206471816
Energy: 0.452080662534787
Energy: 0.327660572065236
Energy: 0.37777344618038733
Energy: 0.3380088811143376
Energy: 0.43308360622555825
Energy: 0.3380088811164091
Energy: 0.43737648282467373
Energy: 0.3276994618310606
Energy: 0.32731966187942174
Energy: 0.3276994618310606
Energy: 0.37862328214272023
Energy: 0.3272600784336611
Energy: 0.3290323483469442
Energy: 0.3272600784336611
Energy: 0.4319433885351717
Energy: 0.3277448849069382
Energy: 0.3281709736778436
Energy: 0.3277448849059024

minimum gb energy = 0.31823250740953596 eV
minimum distance =  2.51438535956431 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 0.6797402781302985
Energy: 0.2928972906163891
Energy: 0.29338023353188064
Energy: 0.3160047818403169
Energy: 0.29401201729063536
Energy: 0.3263366586928048
Energy: 0.29400930683516246
Energy: 0.3263366586928048
Energy: 0.28877645255991424
Energy: 0.32585210171179224
Energy: 0.3068081729541364
Energy: 0.32585210171314727
Energy: 0.29101567088619407
Energy: 0.32744714179359
Energy: 0.29319823435836007
Energy: 0.32744714179359
Energy: 0.2927986496162819
Energy: 0.2924933770096071
Energy: 0.3043930217697331
Energy: 0.29249337701096206
Energy: 0.2929132909730064
Energy: 0.2929955041405589
Energy: 0.30377854925739867
Energy: 0.2929955041392039
Energy: 0.29423994536755776
Energy: 0.29221352700681075
Energy: 0.29346815029225043
Energy: 0.29221352700681075
Energy: 0.2930502537519672
Energy: 0.2931779818086752
Energy: 0.2892761101736788
Energy: 0.2931779818086752
Energy: 0.2939742240539704
Energy: 0.29255596000460016
Energy: 0.28956642644868225
Energy: 0.29255596000460016
Energy: 0.30694708604685494
Energy: 0.3277669614433341
Energy: 0.3077913780592745
Energy: 0.3277669614433341
Energy: 0.2937452212363232
Energy: 0.32500504142596676
Energy: 0.28897164488490645
Energy: 0.32500504142596676
Energy: 0.3038008033305282
Energy: 0.2938854992335101
Energy: 0.2935515327952988
Energy: 0.29388549923215507
Energy: 0.33127312092793465
Energy: 0.29288953847967625
Energy: 0.29346507862228705
Energy: 0.29288953847967625
Energy: 0.29317253156753265
Energy: 0.29301830813151103
Energy: 0.29281538647302785
Energy: 0.29301830813151103
Energy: 0.28949124184170366
Energy: 0.29300333793043776
Energy: 0.2950716432037928
Energy: 0.29300333793043776

minimum gb energy = 0.28877645255991424 eV
minimum distance =  2.55946592157909 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 0.5914028538033018
Energy: 0.29198913334575866
Energy: 0.39485555425228924
Energy: 0.29848109918449495
Energy: 0.41250722561259057
Energy: 0.2885953805050358
Energy: 0.36552556488559723
Energy: 0.2885953805004923
Energy: 0.3098864202839732
Energy: 0.2886423520009207
Energy: 0.35674600274589047
Energy: 0.2886423520009207
Energy: 0.41745889257705565
Energy: 0.28924306083402174
Energy: 0.4007200401274537
Energy: 0.28924306082891027
Energy: 0.4022649295789509
Energy: 0.2891129479242676
Energy: 0.3624155280028929
Energy: 0.28911294792710734
Energy: 0.3581721753591223
Energy: 0.2886284348812283
Energy: 0.3626148973337074
Energy: 0.2886284348903154
Energy: 0.35691221185435407
Energy: 0.2885045956080496
Energy: 0.41342770761652925
Energy: 0.2885045956103214
Energy: 0.348451148394713
Energy: 0.2897965992679856
Energy: 0.3596043936544682
Energy: 0.2897965992685535
Energy: 0.29644906671811505
Energy: 0.2897913298644699
Energy: 0.3580945318772664
Energy: 0.28979132986390194
Energy: 0.29406581486381744
Energy: 0.2887475361978521
Energy: 0.35938931225243254
Energy: 0.2887475361938765
Energy: 0.30039123727405986
Energy: 0.29017610068834376
Energy: 0.592054433187251
Energy: 0.2901761006911835
Energy: 0.35240575510269034
Energy: 0.28910180213099856
Energy: 0.3593070140537921
Energy: 0.28910180213383835
Energy: 0.36149452623490963
Energy: 0.3056157168757247
Energy: 0.3645295341799214
Energy: 0.3056157168768606
Energy: 0.40073498903369503
Energy: 0.3069521711241404
Energy: 0.41770711573319685
Energy: 0.30695217111959683
Energy: 0.3598232181200949
Energy: 0.28916078480150953
Energy: 0.400914392701505
Energy: 0.289160784796966
Energy: 0.35906457434611927
Energy: 0.2890410077835268
Energy: 0.2929243091244316
Energy: 0.28904100778807035
Energy: 0.3999390271516214
Energy: 0.2892977254831781
Energy: 0.2917769013146239
Energy: 0.28929772547636284
Energy: 0.3084489669280606
Energy: 0.2894581491608427
Energy: 0.2929645982978574
Energy: 0.28945814916481827
Energy: 0.39342028225242004
Energy: 0.289291519968429
Energy: 0.34353373361146294
Energy: 0.28929151996729313
Energy: 0.359362456925464
Energy: 0.28845783960061866
Energy: 0.3617013029895102
Energy: 0.28845783960516225
Energy: 0.42988202976080164
Energy: 0.2901666031268125
Energy: 0.3547173480473585
Energy: 0.29016660312908427
Energy: 0.35877323297071173
Energy: 0.3124108113743947
Energy: 0.3613883824603348
Energy: 0.3124108113772345
Energy: 0.35802345839384614
Energy: 0.2889245555926034
Energy: 0.3624371327402108
Energy: 0.28892455559146746
Energy: 0.29266141979516574
Energy: 0.28857285210819017
Energy: 0.4007826704599375
Energy: 0.2885728521070543
Energy: 0.3456385714442209
Energy: 0.28940660115709665
Energy: 0.35902350451834536
Energy: 0.2894066011588005
Energy: 0.29014013710810077
Energy: 0.2886454788817646
Energy: 0.357962425803609
Energy: 0.2886454788806287
Energy: 0.2890708885351808
Energy: 0.2890933497433837
Energy: 0.40300350433197757
Energy: 0.2890933497428157
Energy: 0.2888021045409138
Energy: 0.2898344747959973
Energy: 0.3084518291677446
Energy: 0.2898344747994049
Energy: 0.3528596411671969
Energy: 0.28972796379043636
Energy: 0.39407406929766425
Energy: 0.28972796378702864
Energy: 0.36178033002182636
Energy: 0.30685092051734436
Energy: 0.413022715559846
Energy: 0.30685092052188795
Energy: 0.4001485419732817
Energy: 0.3085297065634974
Energy: 0.4311169517175227
Energy: 0.3085297065572499
Energy: 0.3585713662868818
Energy: 0.2890252155229103
Energy: 0.40076310761110256
Energy: 0.2890252155212064
Energy: 0.35977533429645414
Energy: 0.2895471190712008
Energy: 0.29476174433697017
Energy: 0.28954711906665725
Energy: 0.40081818585204215
Energy: 0.28913095350661816
Energy: 0.28959651130751324
Energy: 0.28913095351002577
Energy: 0.39365529070832317
Energy: 0.28939325687534306
Energy: 0.29229486093563184
Energy: 0.2893932568736392

minimum gb energy = 0.28845783960061866 eV
minimum distance =  2.54790963048899 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 0.5026872674542721
Energy: 0.26392816680500863
Energy: 0.26354222568348606
Energy: 0.29271262999775405
Energy: 0.46016794017985124
Energy: 0.2634629374922285
Energy: 0.37123247726819636
Energy: 0.2634629374912514
Energy: 0.44959661018790315
Energy: 0.2638693628809764
Energy: 0.36262429075404257
Energy: 0.26386936288195356
Energy: 0.44903900707853556
Energy: 0.2959832780157116
Energy: 0.3589110770693274
Energy: 0.2959832780157116
Energy: 0.4588833568752596
Energy: 0.2976139354763921
Energy: 0.35904822220612304
Energy: 0.2976139354763921
Energy: 0.26095870475656296
Energy: 0.26364953090881693
Energy: 0.35782046933220507
Energy: 0.26364953090881693
Energy: 0.2611713453681237
Energy: 0.26384301678349775
Energy: 0.45877526812366126
Energy: 0.2638430167844748
Energy: 0.2708973860887152
Energy: 0.2649396791541273
Energy: 0.4564953352433665
Energy: 0.2649396791541273
Energy: 0.26428237883956346
Energy: 0.2646442517783116
Energy: 0.45419220941967775
Energy: 0.2646442517783116
Energy: 0.27571234945805106
Energy: 0.2641709770399085
Energy: 0.44971514096766096
Energy: 0.2641709770399085
Energy: 0.2635422256688292
Energy: 0.29271262999775405
Energy: 0.5026872674542721
Energy: 0.2639281668040315
Energy: 0.37123247726819636
Energy: 0.2634629374912514
Energy: 0.4601679401788741
Energy: 0.2634629374912514
Energy: 0.3626242907530654
Energy: 0.26386936288293067
Energy: 0.44959661018790315
Energy: 0.26386936288293067
Energy: 0.35891107707030456
Energy: 0.2959832780147345
Energy: 0.44903900707853556
Energy: 0.2959832780157116
Energy: 0.35904822220612304
Energy: 0.2976139354763921
Energy: 0.4588833568762367
Energy: 0.297613935475415
Energy: 0.35782046932927364
Energy: 0.26364953090881693
Energy: 0.2609587047575401
Energy: 0.26364953090881693
Energy: 0.4587752681246384
Energy: 0.26384301678349775
Energy: 0.2611713453681237
Energy: 0.26384301678349775
Energy: 0.45649533524238933
Energy: 0.2649396791541273
Energy: 0.2708973860896923
Energy: 0.2649396791541273
Energy: 0.454192209421632
Energy: 0.2646442517792887
Energy: 0.26428237883858635
Energy: 0.2646442517792887
Energy: 0.44971514096766096
Energy: 0.2641709770399085
Energy: 0.275712349457074
Energy: 0.26417097704088566

minimum gb energy = 0.26095870475656296 eV
minimum distance =  2.5605876572415 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.6263962179004512
Energy: 0.24626968406258587
Energy: 0.24492536814980082
Energy: 0.2712647266936706
Energy: 0.4707804125842908
Energy: 0.2448409386167177
Energy: 0.325337591645324
Energy: 0.2448409386167177
Energy: 0.5390360749880184
Energy: 0.24439435257351003
Energy: 0.3248329287198244
Energy: 0.24439435257427305
Energy: 0.41979242508200454
Energy: 0.24416801807257954
Energy: 0.41056365494349434
Energy: 0.2441680180733425
Energy: 0.41042800477366653
Energy: 0.27055748283161146
Energy: 0.47074788166481735
Energy: 0.27055748283161146
Energy: 0.39983094853815004
Energy: 0.2698699541323191
Energy: 0.47048202058056404
Energy: 0.2698699541323191
Energy: 0.4013213328345452
Energy: 0.27114483525074334
Energy: 0.4095157036530555
Energy: 0.27114483525074334
Energy: 0.32280587522584786
Energy: 0.24622026340346015
Energy: 0.46849730341118817
Energy: 0.24622026340346015
Energy: 0.3241011221724649
Energy: 0.24421974704702737
Energy: 0.47039156041948876
Energy: 0.24421974704702737
Energy: 0.3254768864804689
Energy: 0.2452394235453588
Energy: 0.47095655845504736
Energy: 0.24523942354612183
Energy: 0.24433016341098016
Energy: 0.2460788803648211
Energy: 0.5228771127451434
Energy: 0.2460788803640581
Energy: 0.24731506872526404
Energy: 0.24457158995582495
Energy: 0.47092564721043234
Energy: 0.24457158995582495
Energy: 0.24620869293071157
Energy: 0.2451190046867412
Energy: 0.4025029384376482
Energy: 0.24511900468750417
Energy: 0.32336245422550514
Energy: 0.24532638369216628
Energy: 0.534204426886652
Energy: 0.24532638369445528
Energy: 0.32434769286224574
Energy: 0.24392736593496775
Energy: 0.4720200149207053
Energy: 0.24392736593573078
Energy: 0.3256230023478673
Energy: 0.24429958437468657
Energy: 0.5368459161793974
Energy: 0.24429958437468657
Energy: 0.41235986272436587
Energy: 0.2456231590686294
Energy: 0.5369222097238807
Energy: 0.2456231590701554
Energy: 0.33216282457211577
Energy: 0.2705407527637328
Energy: 0.4120726704344428
Energy: 0.2705407527637328
Energy: 0.4699877538520627
Energy: 0.2700193583784882
Energy: 0.40074790507274644
Energy: 0.2700193583777253
Energy: 0.47098722450129393
Energy: 0.2699107852073264
Energy: 0.3999400838556584
Energy: 0.2699107852096154
Energy: 0.5239487915866349
Energy: 0.24508661415261396
Energy: 0.32480108538755087
Energy: 0.24508661415108796
Energy: 0.4709676299937913
Energy: 0.24436896090793728
Energy: 0.24452017876696494
Energy: 0.24436896090793728
Energy: 0.46855891095488633
Energy: 0.24496267486762088
Energy: 0.3224487273189606
Energy: 0.24496267486762088
Energy: 0.46744303756789163
Energy: 0.24548854634395834
Energy: 0.24573247997037392
Energy: 0.24548854634395834
Energy: 0.47195913414944546
Energy: 0.24431382973462368
Energy: 0.24468218207320427
Energy: 0.24431382973462368
Energy: 0.5345563753047174
Energy: 0.24495023617161574
Energy: 0.24551839017809557
Energy: 0.2449502361700897

minimum gb energy = 0.24392736593496775 eV
minimum distance =  2.56317855834382 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 0.7061435770962718
Energy: 0.231885804650014
Energy: 0.23178113295647756
Energy: 0.25401890518494646
Energy: 0.5376527421236953
Energy: 0.22986751499315541
Energy: 0.298223558743466
Energy: 0.22986751499503205
Energy: 0.5982076018819137
Energy: 0.2294809880263164
Energy: 0.2982033487208873
Energy: 0.22948098802756747
Energy: 0.4771176222749345
Energy: 0.22965427274828512
Energy: 0.3691629442296416
Energy: 0.22965427274828512
Energy: 0.48467141030530264
Energy: 0.2802958059551166
Energy: 0.4241898432545668
Energy: 0.28029580595636766
Energy: 0.47989241907842606
Energy: 0.31714130971251925
Energy: 0.42147320454795106
Energy: 0.3171413097131448
Energy: 0.48298904995174924
Energy: 0.31861117166559405
Energy: 0.4864967702156574
Energy: 0.3186111716662196
Energy: 0.420139303627974
Energy: 0.27904173876217564
Energy: 0.4300431450892185
Energy: 0.27904173876280114
Energy: 0.3614659203230986
Energy: 0.3164205430506757
Energy: 0.5391514861036412
Energy: 0.3164205430500502
Energy: 0.3611045825517603
Energy: 0.2797298541309575
Energy: 0.5375092207840699
Energy: 0.2797298541309575
Energy: 0.29663303602688706
Energy: 0.2307773834205577
Energy: 0.6176535305323229
Energy: 0.2307773834193066
Energy: 0.2978621739666359
Energy: 0.231702778029218
Energy: 0.5374155832040116
Energy: 0.23170277802796688
Energy: 0.2964025304612267
Energy: 0.22973081284385308
Energy: 0.5361109287307928
Energy: 0.22973081284322755
Energy: 0.22979537679418752
Energy: 0.23042936437415332
Energy: 0.535031712381718
Energy: 0.23042936437415332
Energy: 0.23082218059742485
Energy: 0.22951884773039702
Energy: 0.48560082694940176
Energy: 0.2295188477297715
Energy: 0.23323568693296992
Energy: 0.23006518500354972
Energy: 0.47751444685352723
Energy: 0.2300651850041753
Energy: 0.2944865239337849
Energy: 0.23043746564608786
Energy: 0.4790419013485313
Energy: 0.23043746564546233
Energy: 0.3010911296093254
Energy: 0.23001341347894141
Energy: 0.4841486090373746
Energy: 0.23001341347956697
Energy: 0.3011919677432774
Energy: 0.22969212872333997
Energy: 0.48078943291096343
Energy: 0.22969212872518815
Energy: 0.4229097770170846
Energy: 0.2299376846930259
Energy: 0.4798949683144284
Energy: 0.22993768469240033
Energy: 0.4503190191793471
Energy: 0.2817231455035751
Energy: 0.48571602703529004
Energy: 0.28172314550420063
Energy: 0.4229753445501358
Energy: 0.28127310612000295
Energy: 0.4788292215691415
Energy: 0.28127310611875184
Energy: 0.5395433624811131
Energy: 0.31746764659440974
Energy: 0.47870924716872965
Energy: 0.3174676465950353
Energy: 0.4243054888370532
Energy: 0.2811183352740063
Energy: 0.4224026589892811
Energy: 0.2811183352740063
Energy: 0.5382899533887135
Energy: 0.282134064805569
Energy: 0.3698978440819019
Energy: 0.2821340648043179
Energy: 0.5384970731678856
Energy: 0.22978695342988467
Energy: 0.422610736671628
Energy: 0.22978695342988467
Energy: 0.5363412619330221
Energy: 0.22963447753410118
Energy: 0.3021917459777072
Energy: 0.2296344774790535
Energy: 0.4839990304893764
Energy: 0.2301237499019411
Energy: 0.30172350788438934
Energy: 0.2301237499019411
Energy: 0.535709904196215
Energy: 0.23009468666787017
Energy: 0.3002320907542197
Energy: 0.23009468666849572
Energy: 0.5386769985343738
Energy: 0.2301409073980195
Energy: 0.23410406113887394
Energy: 0.23014090739676846
Energy: 0.48394769598501775
Energy: 0.22967404606136627
Energy: 0.23048178811866904
Energy: 0.22967404606136627
Energy: 0.48034953134472713
Energy: 0.23069988250969004
Energy: 0.23034640037903956
Energy: 0.23069988250843895

minimum gb energy = 0.2294809880263164 eV
minimum distance =  2.57976174433244 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 0.6452667438292417
Energy: 0.22404692423231995
Energy: 0.343751126214798
Energy: 0.24322337172506925
Energy: 0.5869989844035172
Energy: 0.22016901456413232
Energy: 0.27976776413923093
Energy: 0.22016901457102128
Energy: 0.6117230842617862
Energy: 0.22147492415718842
Energy: 0.2797594047783661
Energy: 0.22147492415718842
Energy: 0.5596294337407878
Energy: 0.22084168959529815
Energy: 0.3903278428166801
Energy: 0.22084168959741785
Energy: 0.5419655725631207
Energy: 0.26370286578736396
Energy: 0.3864065519407265
Energy: 0.2637028657836545
Energy: 0.5649354703699503
Energy: 0.30071677033436195
Energy: 0.3851074890126282
Energy: 0.30071677034072103
Energy: 0.46328389364642
Energy: 0.26822962995093313
Energy: 0.4891808787464393
Energy: 0.26822962995146304
Energy: 0.49291287679814755
Energy: 0.3049738481659271
Energy: 0.41414222490033015
Energy: 0.304973848166457
Energy: 0.4622175302169332
Energy: 0.3013425742423095
Energy: 0.4867525059030256
Energy: 0.3013425742460189
Energy: 0.46079238316404786
Energy: 0.3008325745430922
Energy: 0.58591608412091
Energy: 0.300832574544682
Energy: 0.3887303442859391
Energy: 0.2222862041144553
Energy: 0.5709592179384653
Energy: 0.22228620411021593
Energy: 0.3591764874959714
Energy: 0.22130627974559275
Energy: 0.5856114873599579
Energy: 0.22130627974612269
Energy: 0.3851204454128549
Energy: 0.22111767927526083
Energy: 0.6126909764171107
Energy: 0.22111767926678205
Energy: 0.2755299184384908
Energy: 0.22201522222034636
Energy: 0.5178273621444487
Energy: 0.22201522221875658
Energy: 0.2789123963044933
Energy: 0.22012368180498412
Energy: 0.5371543591572902
Energy: 0.22012368180816366
Energy: 0.27563831809939776
Energy: 0.218683953030802
Energy: 0.6138107183005054
Energy: 0.21868395303239177
Energy: 0.25347911626407804
Energy: 0.21779255960202776
Energy: 0.539720923848994
Energy: 0.2177925596057372
Energy: 0.2471206635132175
Energy: 0.21877179787838918
Energy: 0.539791078342234
Energy: 0.21877179788156872
Energy: 0.254133928303671
Energy: 0.21790156358877952
Energy: 0.5405646317381909
Energy: 0.21790156359142912
Energy: 0.3089828142652815
Energy: 0.21770083140793448
Energy: 0.6390093473456536
Energy: 0.21770083140581478
Energy: 0.30557098059885035
Energy: 0.2192257410795833
Energy: 0.5414306265651713
Energy: 0.21922574107269427
Energy: 0.3076323579373302
Energy: 0.21766625327791547
Energy: 0.5598805366783962
Energy: 0.21766625328215483
Energy: 0.3806996950215937
Energy: 0.2199738401788126
Energy: 0.5622776799401774
Energy: 0.21997384017563307
Energy: 0.38544139924568027
Energy: 0.28893097527784
Energy: 0.5356751845179271
Energy: 0.2889309752736006
Energy: 0.38482484286654445
Energy: 0.26712083575019346
Energy: 0.46776329725800886
Energy: 0.26712083574754386
Energy: 0.4884156235526302
Energy: 0.28804848630462504
Energy: 0.5356981200898167
Energy: 0.28804848630621477
Energy: 0.410369277595708
Energy: 0.30125568386875845
Energy: 0.48614602158931586
Energy: 0.3012556838676986
Energy: 0.49065305880534144
Energy: 0.23802536500252477
Energy: 0.46839619299507845
Energy: 0.2380253650004051
Energy: 0.5158323379214522
Energy: 0.3047634990533677
Energy: 0.46742805411761945
Energy: 0.3047634990549575
Energy: 0.5132450338925253
Energy: 0.3013015900618594
Energy: 0.3851113559616172
Energy: 0.30130159006556884
Energy: 0.5417498919621231
Energy: 0.2208522670124823
Energy: 0.3593179592247933
Energy: 0.22085226700771304
Energy: 0.5172259489634055
Energy: 0.2219432703077889
Energy: 0.3797415152640356
Energy: 0.2219432703152078
Energy: 0.6132426835954795
Energy: 0.22224819717793665
Energy: 0.2803969974686765
Energy: 0.22224819717581695
Energy: 0.5863946719256182
Energy: 0.22020715399966698
Energy: 0.2792420829510864
Energy: 0.22020715400390634
Energy: 0.5398052176082483
Energy: 0.221356982513104
Energy: 0.23695317740047936
Energy: 0.22135698250833474
Energy: 0.560951997822587
Energy: 0.21963229147187446
Energy: 0.22409847049184728
Energy: 0.21963229147028468
Energy: 0.6106317637632904
Energy: 0.21958770808315023
Energy: 0.22466887377509234
Energy: 0.2195877080820904

minimum gb energy = 0.21766625327791547 eV
minimum distance =  2.5708639344312 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 0.6515839161571814
Energy: 0.19620821694567814
Energy: 0.19602457611214003
Energy: 0.2157628307500235
Energy: 0.6083913740294282
Energy: 0.19614835125654378
Energy: 0.24880428663516854
Energy: 0.19614835125564548
Energy: 0.5646989640685169
Energy: 0.19689749923706268
Energy: 0.24821835547072665
Energy: 0.19689749923660307
Energy: 0.4734873492253832
Energy: 0.19636191101305853
Energy: 0.3410311315108454
Energy: 0.19636191101351813
Energy: 0.5686175534745046
Energy: 0.19657362745105422
Energy: 0.3421961056801087
Energy: 0.19657362745105422
Energy: 0.4753453577911656
Energy: 0.1961157943417843
Energy: 0.341938069354062
Energy: 0.1961157943399459
Energy: 0.4741445345153688
Energy: 0.1970327594396471
Energy: 0.4313693687636741
Energy: 0.1970327594405663
Energy: 0.5215462447155125
Energy: 0.19595848766024676
Energy: 0.34308782271547617
Energy: 0.19595848765886795
Energy: 0.47584283139342537
Energy: 0.27544665645537175
Energy: 0.4316723417699498
Energy: 0.2754466564549122
Energy: 0.47820754404052507
Energy: 0.27499665650882454
Energy: 0.520920320738094
Energy: 0.27499665650882454
Energy: 0.431962842444807
Energy: 0.274009010502438
Energy: 0.4672272134322061
Energy: 0.274009010502438
Energy: 0.38782472300471443
Energy: 0.275141989839284
Energy: 0.5208030862103457
Energy: 0.275141989839284
Energy: 0.43103924287983525
Energy: 0.273847463718518
Energy: 0.5205065007384335
Energy: 0.273847463718518
Energy: 0.34024160271752607
Energy: 0.19685697665718857
Energy: 0.4293005743858271
Energy: 0.19685697665535015
Energy: 0.2968649389897621
Energy: 0.1968657241260372
Energy: 0.5682631123781374
Energy: 0.1968657241269564
Energy: 0.3419719176737594
Energy: 0.1970043131518809
Energy: 0.5189866752878979
Energy: 0.1970043131514213
Energy: 0.24632402039075244
Energy: 0.19729161706849652
Energy: 0.5185538126219517
Energy: 0.1972916170689561
Energy: 0.24575472721051098
Energy: 0.19624955145384906
Energy: 0.5679422391793284
Energy: 0.19624955145430867
Energy: 0.2447334708361276
Energy: 0.19681372186294646
Energy: 0.565227331521387
Energy: 0.19681372186340607
Energy: 0.19579785689461698
Energy: 0.196821473450814
Energy: 0.5650410267901083
Energy: 0.196821473450814
Energy: 0.19641140689957984
Energy: 0.19604274424633591
Energy: 0.5681180543420146
Energy: 0.1960427442454167
Energy: 0.19626144798208703
Energy: 0.1973175411589743
Energy: 0.5619093338259369
Energy: 0.1973175411598935
Energy: 0.24703862495415355
Energy: 0.1965122375501309
Energy: 0.5644378996329539
Energy: 0.1965122375501309
Energy: 0.24834778630008914
Energy: 0.1962437724586676
Energy: 0.5683594689180756
Energy: 0.19624377245912722
Energy: 0.2452879236873927
Energy: 0.19637586883039457
Energy: 0.4737477728864364
Energy: 0.19637586883039457
Energy: 0.3417910082469638
Energy: 0.1964288478823199
Energy: 0.5654146713434378
Energy: 0.19642884788186027
Energy: 0.34139012635127913
Energy: 0.19713301921819387
Energy: 0.5654345539138175
Energy: 0.1971330192177343
Energy: 0.4002048175491832
Energy: 0.19679817144411746
Energy: 0.4743406815508342
Energy: 0.19679817144411746
Energy: 0.432964214971221
Energy: 0.27408017239023047
Energy: 0.569088816667493
Energy: 0.27408017239069005
Energy: 0.43175641747673543
Energy: 0.2739403086521585
Energy: 0.47623874142107464
Energy: 0.27394030865261815
Energy: 0.4844215057343276
Energy: 0.2746294141184531
Energy: 0.38695921237184816
Energy: 0.27462941411937236
Energy: 0.43020701771248493
Energy: 0.27437637225135175
Energy: 0.484256847904381
Energy: 0.27437637225135175
Energy: 0.5219437223051515
Energy: 0.27374655853476043
Energy: 0.38506792167166287
Energy: 0.27374655853522
Energy: 0.5691426388124203
Energy: 0.2738380563279234
Energy: 0.3856391666434758
Energy: 0.27383805632838304
Energy: 0.4653480112904306
Energy: 0.1966934449494349
Energy: 0.34058230013443
Energy: 0.1966934449494349
Energy: 0.6095088133822116
Energy: 0.19702459163478378
Energy: 0.34173720726698886
Energy: 0.19702459163340494
Energy: 0.5658637460879655
Energy: 0.19692460927071861
Energy: 0.3415284494995336
Energy: 0.1969246092711782
Energy: 0.51847455532999
Energy: 0.1961145014658687
Energy: 0.24639894966714443
Energy: 0.19611450146632828
Energy: 0.5682938024504754
Energy: 0.19677138654535484
Energy: 0.24792395767876532
Energy: 0.19677138654673365
Energy: 0.5648281624103266
Energy: 0.1965460808196568
Energy: 0.24671022361691108
Energy: 0.1965460808196568
Energy: 0.5181490798826841
Energy: 0.19732988087778006
Energy: 0.19613780818369658
Energy: 0.19732988087778006
Energy: 0.5680068216708416
Energy: 0.19605630358953507
Energy: 0.19616092405787833
Energy: 0.19605630358999465
Energy: 0.5619495681013063
Energy: 0.19690567989083643
Energy: 0.19594756049103973
Energy: 0.19690567989037683

minimum gb energy = 0.19579785689461698 eV
minimum distance =  2.58328523399938 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.012444780689921999
Energy: 0.18380595637874186
Energy: 0.5135013492340676
Energy: 0.013219447700985397
Energy: 0.3834022062087992
Energy: 0.056746579468640805
Energy: 0.3847346681286768
Energy: 0.0567465794682875
Energy: 0.013347313947976277
Energy: 0.056895295386875266
Energy: 0.382822791000042
Energy: 0.05689529538756227
Energy: 0.014267655971361029
Energy: 0.05632739561504214
Energy: 0.3823342160933285
Energy: 0.056327395615729144
Energy: 0.3826159097200239
Energy: 0.05733269925232474
Energy: 0.3830403161541931
Energy: 0.05733269925301174
Energy: 0.013231181753753818
Energy: 0.05649075579464573
Energy: 0.3827748025796071
Energy: 0.056490755794292406

minimum gb energy = 0.012444780689921999 eV
minimum distance =  2.8256605135121 Angstroms
sigma value = 1