Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Al__MO_131650261510_005
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=4.050180745124819
cohesive_energy=3.5802830731630406
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -9.5367431640625e-07 eV

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

Energy: 0.011099929492229882
Energy: 0.011981603716565896
Energy: 0.35138838313073484
Energy: 0.011981603715594312
Energy: 0.011981603715594312
Energy: 0.16992538104178795
Energy: 0.011981603716565896
Energy: 0.16992538104178795
Energy: 0.35138838313073484
Energy: 0.011981603716565896
Energy: 0.011099929492229882
Energy: 0.011981603717065569
Energy: 0.011981603715594312
Energy: 0.16992538104178795
Energy: 0.011981603715594312
Energy: 0.16992538104178795

minimum gb energy = 0.011099929492229882 eV
minimum distance =  2.79672269299501 Angstroms
sigma value = 1


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

Energy: 0.337819592197343
Energy: 0.31478559607233914
Energy: 0.3770101618110808
Energy: 0.31478559607233914
Energy: 0.31608747657145564
Energy: 0.334126514484368
Energy: 0.3161062561332722
Energy: 0.33412651448557995
Energy: 0.3206422695405939
Energy: 0.31025782279698766
Energy: 0.33036637682637343
Energy: 0.31025782279759373
Energy: 0.3156937687746181
Energy: 0.3226622559046201
Energy: 0.31806378213549924
Energy: 0.3226622559046201
Energy: 0.3216144855328728
Energy: 0.31587695092587126
Energy: 0.32231081605946776
Energy: 0.3158769509264772
Energy: 0.31792475964526834
Energy: 0.31528926711805894
Energy: 0.3170740499914303
Energy: 0.31528926711805894
Energy: 0.31738434073468846
Energy: 0.3109432393438245
Energy: 0.3190406687811518
Energy: 0.3109432393444304
Energy: 0.31772603711024355
Energy: 0.3154026075616928
Energy: 0.31874175895178325
Energy: 0.3154026075616928
Energy: 0.3181146081584103
Energy: 0.3242985924057515
Energy: 0.3163966009219824
Energy: 0.3242985924057515
Energy: 0.31188982712749
Energy: 0.3102907240651348
Energy: 0.32004359680725974
Energy: 0.3102907240645288
Energy: 0.3164372741514367
Energy: 0.32819262928628723
Energy: 0.31808846831698806
Energy: 0.3281926292868933
Energy: 0.3459801383993533
Energy: 0.31525975320501526
Energy: 0.31420935462876515
Energy: 0.31525975320501526
Energy: 0.3156740419283165
Energy: 0.3104536372757797
Energy: 0.31728300652025493
Energy: 0.3104536372757797
Energy: 0.3244757439012215
Energy: 0.3155424402239833
Energy: 0.31429081067687564
Energy: 0.3155424402233773
Energy: 0.3372855173373939
Energy: 0.31634505688004433
Energy: 0.32126587337418083
Energy: 0.31634505688065034
Energy: 0.33067432706189837
Energy: 0.3159623715926682
Energy: 0.3195786907495213
Energy: 0.3159623715926682
Energy: 0.32625481081993385
Energy: 0.31038124837531605
Energy: 0.31966650890706394
Energy: 0.310381248375922
Energy: 0.3161840321287604
Energy: 0.31166924550171665
Energy: 0.3161331946025037
Energy: 0.3116692455053526
Energy: 0.3267904123877429
Energy: 0.3148208673406495
Energy: 0.3136567778706763
Energy: 0.31482086734183395
Energy: 0.3163360573959252
Energy: 0.3271288220542674
Energy: 0.31877822408591605
Energy: 0.32712882205305543
Energy: 0.3129619228554602
Energy: 0.31089048441183287
Energy: 0.3189312861134523
Energy: 0.3108904844130449
Energy: 0.31819143622626056
Energy: 0.32369618838808356
Energy: 0.315409611189682
Energy: 0.32369618838808356
Energy: 0.33032907928081656
Energy: 0.3156449797493268
Energy: 0.3170941750990516
Energy: 0.31564497975111727
Energy: 0.3275570012235075
Energy: 0.31072613703229635
Energy: 0.3186448542019931
Energy: 0.3107261370316904
Energy: 0.3191897900230214
Energy: 0.3155746191820838
Energy: 0.3166864519664283
Energy: 0.3155746191814779
Energy: 0.32381282129810895
Energy: 0.31548009183492776
Energy: 0.3165911033669062
Energy: 0.3154800918343217
Energy: 0.31639867649839654
Energy: 0.3267213709916061
Energy: 0.3179104945479962
Energy: 0.3267213709903941
Energy: 0.3266952773487804
Energy: 0.31037508869928265
Energy: 0.3309297247047086
Energy: 0.31037508870049463
Energy: 0.31564716630068695
Energy: 0.33959364091436967
Energy: 0.3164392605899163
Energy: 0.3395936409149756
Energy: 0.33801622871216197
Energy: 0.31512235493368734
Energy: 0.35106044880392107
Energy: 0.3151223549324753
Energy: 0.330737224621128
Energy: 0.3153149699594673
Energy: 0.31569385754534735
Energy: 0.31531496996007324
Energy: 0.31473417584256935
Energy: 0.31064475767788546
Energy: 0.32464341063443675
Energy: 0.3106447576772795
Energy: 0.3220790842476377
Energy: 0.32384744112574904
Energy: 0.3166796464816723
Energy: 0.3238474411245371

minimum gb energy = 0.31025782279698766 eV
minimum distance =  2.59803182009305 Angstroms
sigma value = 1


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

Energy: 0.351253469175236
Energy: 0.33557844901731443
Energy: 0.3655791721030751
Energy: 0.33557844901455064
Energy: 0.3388084043794864
Energy: 0.33620249478119146
Energy: 0.32299673386840577
Energy: 0.33620249478257336
Energy: 0.3281128214176428
Energy: 0.33580385498764875
Energy: 0.32428731255632215
Energy: 0.33580385499110343
Energy: 0.3264023771370204
Energy: 0.333991305409548
Energy: 0.3274049976203595
Energy: 0.33399130541023897
Energy: 0.3263561843541783
Energy: 0.32732418189803963
Energy: 0.3270704156842813
Energy: 0.3273241818952758
Energy: 0.35740145854873556
Energy: 0.326889036332947
Energy: 0.3358853896134774
Energy: 0.32688903632880134
Energy: 0.32599048014854476
Energy: 0.35246037208547937
Energy: 0.32633771567512665
Energy: 0.3524603720827156
Energy: 0.32510989609571483
Energy: 0.33570993717402814
Energy: 0.32529250742943716
Energy: 0.33570993717057346
Energy: 0.3258468228435688
Energy: 0.3366085120932695
Energy: 0.3229371596259448
Energy: 0.3366085120925785
Energy: 0.31970682563249675
Energy: 0.3354817060287526
Energy: 0.35180509137250965
Energy: 0.3354817060259888
Energy: 0.32567844617626496
Energy: 0.3358449830764569
Energy: 0.32304305483416057
Energy: 0.3358449830730022
Energy: 0.3255493187950711
Energy: 0.3300473170771121
Energy: 0.3239396091385906
Energy: 0.3300473170757302
Energy: 0.3277243913388464
Energy: 0.32763936357443585
Energy: 0.33386159772232865
Energy: 0.32763936357236306
Energy: 0.3276555990538267
Energy: 0.32759004943239267
Energy: 0.3394077782510028
Energy: 0.3275900494317017
Energy: 0.3255774206126321
Energy: 0.33003182254831
Energy: 0.3306967941086082
Energy: 0.3300318225510738
Energy: 0.3257113291526708
Energy: 0.3357826795162121
Energy: 0.32581418094056935
Energy: 0.33578267951825347
Energy: 0.3195797922365026
Energy: 0.3354618094400853
Energy: 0.3624928571943857
Energy: 0.3354618094387034
Energy: 0.32593451733658324
Energy: 0.33664336108229076
Energy: 0.3229075116413977
Energy: 0.3366433610815998
Energy: 0.3251753615346167
Energy: 0.33552150138163733
Energy: 0.3248805240940283
Energy: 0.3355215013788736
Energy: 0.3257303212410661
Energy: 0.35264760783833093
Energy: 0.3282671412464245
Energy: 0.35264760783971283
Energy: 0.35735171634732493
Energy: 0.32691650636885317
Energy: 0.3328051087545257
Energy: 0.3269165063695441
Energy: 0.3264236681633414
Energy: 0.3273169159877705
Energy: 0.3320192784006261
Energy: 0.3273169159905343
Energy: 0.32656466726157934
Energy: 0.33412151128265405
Energy: 0.3259476884772275
Energy: 0.33412151128265405
Energy: 0.3280907853623968
Energy: 0.33575315490623164
Energy: 0.3257405631469913
Energy: 0.33575315490415886
Energy: 0.3388524444901584
Energy: 0.33611865395487217
Energy: 0.32302708713866174
Energy: 0.3361186539555631
Energy: 0.351253469175236
Energy: 0.33557844901731443
Energy: 0.37237282800097626
Energy: 0.33557844901455064
Energy: 0.33880840437879545
Energy: 0.33620249478119146
Energy: 0.3229967338690967
Energy: 0.3362024947818824
Energy: 0.3281128214162609
Energy: 0.33580385498764875
Energy: 0.32428731255632215
Energy: 0.33580385499110343
Energy: 0.3264023771370204
Energy: 0.333991305409548
Energy: 0.3250304489621339
Energy: 0.33399130541093

minimum gb energy = 0.3195797922365026 eV
minimum distance =  2.52657818432629 Angstroms
sigma value = 25


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

Energy: 0.3402963868502688
Energy: 0.3415722406539762
Energy: 0.4221043006355104
Energy: 0.3415722406539762
Energy: 0.3323747753485128
Energy: 0.3417826747179308
Energy: 0.33379440283297357
Energy: 0.3417826747179308
Energy: 0.33463756866869104
Energy: 0.3590993700933192
Energy: 0.33320672223699005
Energy: 0.3590993700933192
Energy: 0.33705564453119424
Energy: 0.3502356286546585
Energy: 0.33145936218353
Energy: 0.35023562865385527
Energy: 0.33147316088952344
Energy: 0.34229816898816623
Energy: 0.33463205046593963
Energy: 0.34229816898816623
Energy: 0.3706429632157336
Energy: 0.3575568924928462
Energy: 0.3326520650407676
Energy: 0.35755689249364947
Energy: 0.33271623419645535
Energy: 0.3318705626580004
Energy: 0.3398727839430563
Energy: 0.3318705626580004
Energy: 0.40739334924581466
Energy: 0.3421424968138277
Energy: 0.3281068808361304
Energy: 0.3421424968138277
Energy: 0.3399788829280044
Energy: 0.34155597253812303
Energy: 0.33495930689498665
Energy: 0.3415559725389262
Energy: 0.3303981859972211
Energy: 0.3575336180680814
Energy: 0.32985770424886324
Energy: 0.3575336180688847
Energy: 0.34465538344386254
Energy: 0.3419542795859654
Energy: 0.3327272291538047
Energy: 0.3419542795859654
Energy: 0.33072887283704805
Energy: 0.3414460707262383
Energy: 0.33298898990820036
Energy: 0.34144607072463184
Energy: 0.33306529617643765
Energy: 0.351906768867719
Energy: 0.32991101100249837
Energy: 0.351906768867719
Energy: 0.3402358545288339
Energy: 0.3303662652872462
Energy: 0.33297731309146833
Energy: 0.3303662652872462
Energy: 0.34274389617666656
Energy: 0.34154692988627405
Energy: 0.32694919681906714
Energy: 0.3415469298854708
Energy: 0.3341676668960682
Energy: 0.334805324184088
Energy: 0.3332851650713528
Energy: 0.33480532418489123
Energy: 0.3302923814076653
Energy: 0.35678465419887945
Energy: 0.32749486094700264
Energy: 0.35678465419887945
Energy: 0.3322588773737237
Energy: 0.34356925568834207
Energy: 0.3368214212154837
Energy: 0.34356925568673563
Energy: 0.329661580037843
Energy: 0.3504203269877439
Energy: 0.3317971941404158
Energy: 0.3504203269877439
Energy: 0.3328564254053112
Energy: 0.35738912101027853
Energy: 0.3334637859634955
Energy: 0.35738912101027853
Energy: 0.3351368880335092
Energy: 0.3421509225315519
Energy: 0.3352482039883813
Energy: 0.34215092253235513
Energy: 0.34068934457927685
Energy: 0.3420592380895853
Energy: 0.3374642068702281
Energy: 0.34205923809038846
Energy: 0.33255965131745396
Energy: 0.34748451173787986
Energy: 0.33328647247211324
Energy: 0.34748451173868306
Energy: 0.3348256922511472
Energy: 0.35733651076711465
Energy: 0.3304042956780138
Energy: 0.35733651076631145
Energy: 0.3330714553478401
Energy: 0.3501670612329317
Energy: 0.33181084723927107
Energy: 0.3501670612329317

minimum gb energy = 0.32694919681906714 eV
minimum distance =  2.54021128924035 Angstroms
sigma value = 9


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

Energy: 0.34813815173526275
Energy: 0.3582692221939974
Energy: 0.47098999119275775
Energy: 0.3582692221939974
Energy: 0.3458996332670263
Energy: 0.3635064972644356
Energy: 0.34628691123282807
Energy: 0.3635064972634775
Energy: 0.35916656948208364
Energy: 0.3589667357190667
Energy: 0.34901404780972844
Energy: 0.35896673572002485
Energy: 0.34690916667050486
Energy: 0.3733815004496995
Energy: 0.33302643850779284
Energy: 0.3733815004496995
Energy: 0.38804224023374984
Energy: 0.3602641467869227
Energy: 0.3491150192744141
Energy: 0.36026414678883906
Energy: 0.32391331474563106
Energy: 0.35671020861992775
Energy: 0.3276427511690705
Energy: 0.35671020861992775
Energy: 0.34256464642069073
Energy: 0.3584937605461294
Energy: 0.3332582724917447
Energy: 0.3584937605451712
Energy: 0.38378251738334695
Energy: 0.35812876214636985
Energy: 0.32727758510133875
Energy: 0.35812876214924433
Energy: 0.34221416959870965
Energy: 0.3635851740670497
Energy: 0.34922309988818473
Energy: 0.36358517406896596
Energy: 0.34709279999025916
Energy: 0.3582274213211847
Energy: 0.33218310896107367
Energy: 0.3582274213221428
Energy: 0.3321148842244662
Energy: 0.3585729613151851
Energy: 0.33629328656246743
Energy: 0.3585729613151851
Energy: 0.34717482044376824
Energy: 0.3598059391090782
Energy: 0.3329209216662091
Energy: 0.35980593910812
Energy: 0.32354015679114967
Energy: 0.3583244784909153
Energy: 0.3439434260171182
Energy: 0.3583244784918735
Energy: 0.3524458059149528
Energy: 0.3577010142675891
Energy: 0.34648700586572584
Energy: 0.3577010142695054
Energy: 0.3235438145076546
Energy: 0.35831657927087585
Energy: 0.38375903866934385
Energy: 0.35831657926991767
Energy: 0.34718858911747813
Energy: 0.35982941437045557
Energy: 0.3327920985069468
Energy: 0.35982941436949734
Energy: 0.3320445129681255
Energy: 0.35849549892953125
Energy: 0.3492151785636005
Energy: 0.35849549892665683
Energy: 0.34717407904497555
Energy: 0.3581620346843707
Energy: 0.33377122407045273
Energy: 0.35816203468724517
Energy: 0.3422166259617838
Energy: 0.36358243922881467
Energy: 0.3491412951245011
Energy: 0.3635824392278565
Energy: 0.38386628431160463
Energy: 0.3579278198079097
Energy: 0.3272675129324467
Energy: 0.35792781980503524
Energy: 0.3425771192708475
Energy: 0.3584202771045204
Energy: 0.33300360899515363
Energy: 0.3584202771026041

minimum gb energy = 0.32354015679114967 eV
minimum distance =  2.56720094161395 Angstroms
sigma value = 25


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

Energy: 0.3271338807370802
Energy: 0.37860505688530444
Energy: 0.4884447838363907
Energy: 0.3786050568864894
Energy: 0.31925633209664295
Energy: 0.3567727644812642
Energy: 0.3156792756505063
Energy: 0.3567727644812642
Energy: 0.31565013925517965
Energy: 0.39235250840942393
Energy: 0.31554283334197286
Energy: 0.39235250841060887
Energy: 0.3290640425396094
Energy: 0.37915105534976956
Energy: 0.3899493294209753
Energy: 0.37915105534976956
Energy: 0.3869194770850499
Energy: 0.3612716948991817
Energy: 0.3511826735268626
Energy: 0.36127169489799676
Energy: 0.3174337102660905
Energy: 0.39314271457489336
Energy: 0.3167360616916066
Energy: 0.39314271457607824
Energy: 0.3158047806278917
Energy: 0.3560708304506196
Energy: 0.31589057166487133
Energy: 0.3560708304506196
Energy: 0.32169536858896863
Energy: 0.37946196188796033
Energy: 0.32916797833954364
Energy: 0.37946196188559034
Energy: 0.3155897622269986
Energy: 0.356119949979928
Energy: 0.3207424599454045
Energy: 0.356119949979928
Energy: 0.40135383971142186
Energy: 0.36856287219336503
Energy: 0.3171566315208865
Energy: 0.36856287219455
Energy: 0.3529489508813035
Energy: 0.3780146449528421
Energy: 0.4573811626523308
Energy: 0.3780146449540271
Energy: 0.31591481796317794
Energy: 0.366017801639723
Energy: 0.32834974643071224
Energy: 0.366017801639723
Energy: 0.39101351485455244
Energy: 0.39185036877452883
Energy: 0.3152092083976222
Energy: 0.39185036877452883
Energy: 0.3157214131474155
Energy: 0.36185353547205695
Energy: 0.3289406785229075
Energy: 0.361853535470872
Energy: 0.33135315391090936
Energy: 0.37762042224234416
Energy: 0.321373287127278
Energy: 0.3776204222411592
Energy: 0.3203083241284851
Energy: 0.393686602469849
Energy: 0.3174089549783547
Energy: 0.393686602469849
Energy: 0.3157534263187831
Energy: 0.34864328419322377
Energy: 0.3976972958959323
Energy: 0.34864328419322377

minimum gb energy = 0.3152092083976222 eV
minimum distance =  2.6236171338834 Angstroms
sigma value = 17


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

Energy: 0.3709628722517676
Energy: 0.3851878055852572
Energy: 0.5024680216650564
Energy: 0.3851878055852572
Energy: 0.37104456656532875
Energy: 0.3685353761876142
Energy: 0.3256838079658867
Energy: 0.3685353761876142
Energy: 0.3699020083617843
Energy: 0.37604857627130384
Energy: 0.32561676559571606
Energy: 0.37604857627130384
Energy: 0.3262957610028397
Energy: 0.3859067988400685
Energy: 0.36403808030118656
Energy: 0.3859067988414107
Energy: 0.3790411079857596
Energy: 0.3798378424207442
Energy: 0.34660812445924294
Energy: 0.3798378424207442
Energy: 0.33002159898865135
Energy: 0.38817062528722607
Energy: 0.38383424332514154
Energy: 0.38817062528655494
Energy: 0.32777846491745916
Energy: 0.3686358177819389
Energy: 0.32686734250619937
Energy: 0.3686358177812678
Energy: 0.3806662623468101
Energy: 0.3858583338193747
Energy: 0.33447993332413556
Energy: 0.3858583338200458
Energy: 0.3320007263317303
Energy: 0.3840214069982381
Energy: 0.40522268504652953
Energy: 0.38402140699756704
Energy: 0.42928745384065076
Energy: 0.3680390764907995
Energy: 0.3295910211701841
Energy: 0.3680390764894573
Energy: 0.32783818699817124
Energy: 0.3792188790217759
Energy: 0.3780533938258282
Energy: 0.37921887902244694
Energy: 0.3339333687217565
Energy: 0.3682199245348125
Energy: 0.3340379102673602
Energy: 0.3682199245354836
Energy: 0.37767038979387785
Energy: 0.3796867085474451
Energy: 0.3691455111573021
Energy: 0.3796867085481162
Energy: 0.3300844739196238
Energy: 0.3911891417598977
Energy: 0.38000416723718167
Energy: 0.3911891417605688
Energy: 0.36779754212259214
Energy: 0.369825027579662
Energy: 0.33206515248490565
Energy: 0.36982502757899094
Energy: 0.38017875609493973
Energy: 0.3860377529224292
Energy: 0.38872847680663103
Energy: 0.3860377529231003
Energy: 0.32720767504540205
Energy: 0.38413273672849785
Energy: 0.3746523085559461
Energy: 0.38413273672849785
Energy: 0.379794672827632
Energy: 0.37522507622918616
Energy: 0.33002387619753654
Energy: 0.37522507622851503
Energy: 0.3499576358350677
Energy: 0.384451572451172
Energy: 0.37511716433273884
Energy: 0.3844515724505009
Energy: 0.327376340453798
Energy: 0.40206000499138944
Energy: 0.32655567519819956
Energy: 0.40206000499138944
Energy: 0.35556423480963656
Energy: 0.3755388630578806
Energy: 0.3868285100535347
Energy: 0.3755388630592228
Energy: 0.32716569375321874
Energy: 0.40549966365470264
Energy: 0.4108250976975042
Energy: 0.40549966365537377
Energy: 0.40698930357653706
Energy: 0.3849678007654579
Energy: 0.32542189942419
Energy: 0.3849678007647868
Energy: 0.33143050760759557
Energy: 0.3852002429867719
Energy: 0.3771331711000796
Energy: 0.3852002429867719
Energy: 0.3565880371847408
Energy: 0.37576038062884537
Energy: 0.3779857648665106
Energy: 0.37576038062884537
Energy: 0.40655609179312574
Energy: 0.37946652051748075
Energy: 0.326129791199522
Energy: 0.3794665205168097
Energy: 0.35214227761270683
Energy: 0.3915362243553462
Energy: 0.4205402998552177
Energy: 0.39153622435601737
Energy: 0.38379441879331283
Energy: 0.36979816662321013
Energy: 0.3770361014432933
Energy: 0.36979816662321013
Energy: 0.39932384162600965
Energy: 0.4013479529469251
Energy: 0.328085388399882
Energy: 0.4013479529462541
Energy: 0.3343849434041206
Energy: 0.3838839247916426
Energy: 0.3794035022756348
Energy: 0.38388392478962924

minimum gb energy = 0.32542189942419 eV
minimum distance =  2.50189102702546 Angstroms
sigma value = 53


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

Energy: 0.295909544998599
Energy: 0.2962450441103494
Energy: 0.5355450637396252
Energy: 0.29624504410880437
Energy: 0.3729580195126873
Energy: 0.34133578094903705
Energy: 0.3353880884118453
Energy: 0.3413357809474921
Energy: 0.2965995065890462
Energy: 0.2964188926513606
Energy: 0.38617394824380935
Energy: 0.29641889265290555
Energy: 0.2965365047981709
Energy: 0.29638799549193234
Energy: 0.3511671343927545
Energy: 0.2963879954934773
Energy: 0.3729848562008657
Energy: 0.34130106571366675
Energy: 0.36960642524156295
Energy: 0.34130106571521174
Energy: 0.295909544998599
Energy: 0.29624504410880437
Energy: 0.4742427107356705
Energy: 0.29624504410880437
Energy: 0.3729580195126873
Energy: 0.34133578094903705
Energy: 0.35097981000167544
Energy: 0.34133578094903705
Energy: 0.2965995065890462
Energy: 0.2964188926513606
Energy: 0.38617394824380935
Energy: 0.29641889265290555
Energy: 0.2965365047981709
Energy: 0.29638799549193234
Energy: 0.3732878582726371
Energy: 0.29638799549193234
Energy: 0.3729848562008657
Energy: 0.34130106571212177
Energy: 0.3902048879098296
Energy: 0.34130106571212177
Energy: 0.295909544998599
Energy: 0.2962450441103494
Energy: 0.4742427107372155
Energy: 0.2962450441103494
Energy: 0.3729580195126873
Energy: 0.34133578094903705
Energy: 0.3734284150179026
Energy: 0.34133578094903705
Energy: 0.2965995065890462
Energy: 0.2964188926513606
Energy: 0.38617394824380935
Energy: 0.2964188926544506

minimum gb energy = 0.295909544998599 eV
minimum distance =  2.58652517818435 Angstroms
sigma value = 9


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

Energy: 0.34693681564397705
Energy: 0.4071329703087507
Energy: 0.5004714123064444
Energy: 0.4071329703087507
Energy: 0.4086399031742247
Energy: 0.3745911968189484
Energy: 0.3505453369625523
Energy: 0.3745911968189484
Energy: 0.34542834797448246
Energy: 0.3434791271148176
Energy: 0.3514020699530987
Energy: 0.3434791271153894
Energy: 0.39739210989528995
Energy: 0.40553330331075427
Energy: 0.35206787456359306
Energy: 0.4055333033118979
Energy: 0.3974356484821289
Energy: 0.3643878385095339
Energy: 0.35165809566285006
Energy: 0.36438783850896206
Energy: 0.3430773539595092
Energy: 0.34300893854094866
Energy: 0.4068308178455692
Energy: 0.34300893854094866
Energy: 0.466388009548306
Energy: 0.3636006935980543
Energy: 0.35064281818495946
Energy: 0.3636006935986261
Energy: 0.34674786849170447
Energy: 0.40121495238807436
Energy: 0.4008893697404865
Energy: 0.40121495238635885
Energy: 0.34708188201435985
Energy: 0.40979591819721467
Energy: 0.34842536930122253
Energy: 0.4097959181983583
Energy: 0.34625622235803377
Energy: 0.3652980987601202
Energy: 0.3512915162096295
Energy: 0.3652980987595484
Energy: 0.34757907262718496
Energy: 0.40865716716208084
Energy: 0.4765554869814659
Energy: 0.4086571671603654
Energy: 0.4051444786086593
Energy: 0.4303719084452545
Energy: 0.3484970654149643
Energy: 0.43037190844582635
Energy: 0.3474772164075046
Energy: 0.38334303035541795
Energy: 0.43032231309491803
Energy: 0.38334303035598977
Energy: 0.4042081857514523
Energy: 0.4051083635016974
Energy: 0.35067620446714476
Energy: 0.4051083635022692
Energy: 0.3481298389128701
Energy: 0.3889816468328238
Energy: 0.40045982307138067
Energy: 0.3889816468305365
Energy: 0.349014831818787
Energy: 0.41007700647334816
Energy: 0.4053934972915382
Energy: 0.4100770064727763
Energy: 0.37857879927185256
Energy: 0.38857393572922844
Energy: 0.3491675258691139
Energy: 0.3885739357286566
Energy: 0.34926238008754484
Energy: 0.3636387825830117
Energy: 0.41057811687669954
Energy: 0.36363878258186805
Energy: 0.40404387415358156
Energy: 0.3838489563600679
Energy: 0.34425292025918613
Energy: 0.3838489563589242
Energy: 0.3526018001963009
Energy: 0.3688966914354804
Energy: 0.3843971060354429
Energy: 0.3688966914360522
Energy: 0.4028571110760282
Energy: 0.4055946457650255
Energy: 0.39942744907284383
Energy: 0.40559464576731286
Energy: 0.38272215159759454
Energy: 0.347167128427184
Energy: 0.3466188488895431
Energy: 0.34716712842832764
Energy: 0.348441183786792
Energy: 0.3838439883227868
Energy: 0.34662551015046705
Energy: 0.38384398832049943
Energy: 0.49399502013638885
Energy: 0.40126776929248353
Energy: 0.3465343491506331
Energy: 0.40126776929305535
Energy: 0.35028500332167717
Energy: 0.4518878001788202
Energy: 0.4387715212184769
Energy: 0.4518878001776765
Energy: 0.37862465310685284
Energy: 0.34343062448225115
Energy: 0.34569456606853866
Energy: 0.3434306244833948
Energy: 0.3808562512095073
Energy: 0.3826410708415203
Energy: 0.3971171800989143
Energy: 0.3826410708415203
Energy: 0.35331702419435446
Energy: 0.40450884716585817
Energy: 0.397649954430846
Energy: 0.40450884716643
Energy: 0.37690277687323465
Energy: 0.3432756906154155
Energy: 0.3452928013964776
Energy: 0.3432756906142719
Energy: 0.3501241170068657
Energy: 0.4505592278046071
Energy: 0.4442006526100956
Energy: 0.45055922780632257
Energy: 0.4697074173768196
Energy: 0.4021918474701517
Energy: 0.34584486833340017
Energy: 0.40219184747072356
Energy: 0.3483539628740857
Energy: 0.3659749922413302
Energy: 0.3458128222009723
Energy: 0.3659749922424738
Energy: 0.35096027039316646
Energy: 0.34825495019117686
Energy: 0.3456612432112185
Energy: 0.3482549501900333
Energy: 0.4014223642897486
Energy: 0.40379811263773746
Energy: 0.39822184780704273
Energy: 0.40379811263888116
Energy: 0.3507196522774833
Energy: 0.41273199598114435
Energy: 0.46666941662504735
Energy: 0.41273199598285987

minimum gb energy = 0.34300893854094866 eV
minimum distance =  2.54796321372987 Angstroms
sigma value = 73


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

Energy: 0.37187732978940563
Energy: 0.3770771259229784
Energy: 0.5399920934219458
Energy: 0.3770771259238856
Energy: 0.37824235865763683
Energy: 0.3759251397799487
Energy: 0.35469982673442496
Energy: 0.3759251397799487
Energy: 0.34816352444113585
Energy: 0.353815644584937
Energy: 0.3548126894784633
Energy: 0.3538156445831224
Energy: 0.3498154471100114
Energy: 0.3846800316854804
Energy: 0.35136132578031526
Energy: 0.38468003168457304
Energy: 0.37368472976983147
Energy: 0.3749217862709478
Energy: 0.35503820901770033
Energy: 0.3749217862709478
Energy: 0.35231635169956266
Energy: 0.3513508538776128
Energy: 0.4454714748572874
Energy: 0.35135085387579834
Energy: 0.45411886797724477
Energy: 0.39891826381921186
Energy: 0.3599416195581039
Energy: 0.3989182638210263
Energy: 0.348969202720489
Energy: 0.342211232953685
Energy: 0.4266511458681029
Energy: 0.342211232953685
Energy: 0.4562780057564429
Energy: 0.34191788911964804
Energy: 0.3418155668627065
Energy: 0.34191788911874077
Energy: 0.34909504021221366
Energy: 0.38740685031955663
Energy: 0.3533819259043893
Energy: 0.38740685031955663
Energy: 0.34807903297665843
Energy: 0.3422852573912002
Energy: 0.4297949910195638
Energy: 0.3422852573912002
Energy: 0.3976619882963121
Energy: 0.34772840120196735
Energy: 0.35017465051365443
Energy: 0.3477284012028746
Energy: 0.3518061430923372
Energy: 0.3715524704751408
Energy: 0.4135264801288965
Energy: 0.37155247047241907
Energy: 0.45857149687522336
Energy: 0.3793733770454627
Energy: 0.35223653565885055
Energy: 0.3793733770454627
Energy: 0.35552985874021403
Energy: 0.40961714744921085
Energy: 0.4228600011000575
Energy: 0.40961714744921085
Energy: 0.4290555936466555
Energy: 0.34229165323037014
Energy: 0.3487777716389955
Energy: 0.34229165323037014
Energy: 0.37798773426802557
Energy: 0.3856502121988557
Energy: 0.3481136124217142
Energy: 0.3856502121997629
Energy: 0.3729099680729639
Energy: 0.39699161582747894
Energy: 0.3486738818499961
Energy: 0.39699161582566445
Energy: 0.40497362064032216
Energy: 0.34203624258058984
Energy: 0.3483693827192354
Energy: 0.34203624258058984
Energy: 0.35199559955612053
Energy: 0.3881194262905412
Energy: 0.43996791582763517
Energy: 0.3881194262905412
Energy: 0.4485907928598857
Energy: 0.3516434314603975
Energy: 0.35112706697060586
Energy: 0.35164343146311927
Energy: 0.36267615005525994
Energy: 0.3833737900228658
Energy: 0.3978540901985556
Energy: 0.3833737900228658

minimum gb energy = 0.3418155668627065 eV
minimum distance =  2.54672203380111 Angstroms
sigma value = 7


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

Energy: 0.3612514496306177
Energy: 0.3616797942470131
Energy: 0.5379561508393377
Energy: 0.36167979425342833
Energy: 0.4528032135279835
Energy: 0.3875263859162073
Energy: 0.3592043645708993
Energy: 0.3875263859149243
Energy: 0.35238729389645707
Energy: 0.36273783577208685
Energy: 0.37691671786574454
Energy: 0.3627378357740114
Energy: 0.3803691099462315
Energy: 0.3859780625020618
Energy: 0.36736770965898935
Energy: 0.38597806250142025
Energy: 0.35336463798753115
Energy: 0.3862725612563907
Energy: 0.3731156768615098
Energy: 0.3862725612551076
Energy: 0.3546356440979373
Energy: 0.362929695208754
Energy: 0.45597150988560653
Energy: 0.36292969521452767
Energy: 0.4199622150272275
Energy: 0.4138145581298293
Energy: 0.37212425975903074
Energy: 0.4138145581234141
Energy: 0.35478680300524335
Energy: 0.3616745201652016
Energy: 0.46566366718765506
Energy: 0.3616745201639186
Energy: 0.41126285575173493
Energy: 0.3842556165429179
Energy: 0.3564158757524079
Energy: 0.38425561654355944
Energy: 0.35863018112060535
Energy: 0.3966564698033649
Energy: 0.41189045133235064
Energy: 0.39665646980400643
Energy: 0.38814116337765486
Energy: 0.36416250991706256
Energy: 0.375503281925592
Energy: 0.3641625099196287
Energy: 0.3756507021426871
Energy: 0.38667713462911935
Energy: 0.37746610326612484
Energy: 0.38667713462783626
Energy: 0.36667622053566756
Energy: 0.3624716627712749
Energy: 0.37469354536850885
Energy: 0.36247166277255793
Energy: 0.3803979363513448
Energy: 0.362098474700178
Energy: 0.37303033992868795
Energy: 0.3620984747027441
Energy: 0.3575772486960075
Energy: 0.41994181165208655
Energy: 0.4527886924374537
Energy: 0.4199418116540111
Energy: 0.5236267148855867
Energy: 0.3615924363188193
Energy: 0.3540032963875811
Energy: 0.3615924363188193
Energy: 0.36603404378674226
Energy: 0.3886958142729035
Energy: 0.4117398239396968
Energy: 0.38869581427226196
Energy: 0.3708061435958883
Energy: 0.3836354707276343
Energy: 0.3733452190521101
Energy: 0.38363547073084187
Energy: 0.35767944846270094
Energy: 0.3748957577209353
Energy: 0.3752956417149243
Energy: 0.3748957577177277
Energy: 0.35855126372624563
Energy: 0.38737077633596034
Energy: 0.37561736123937467
Energy: 0.387370776339168
Energy: 0.3796530063899251
Energy: 0.40109956274439235
Energy: 0.3561974164234884
Energy: 0.40109956274246783
Energy: 0.3547633085341658
Energy: 0.36268880502715306
Energy: 0.4137570901960431
Energy: 0.3626888050297191
Energy: 0.4449987510452409
Energy: 0.3847728776414826
Energy: 0.37215148353885136
Energy: 0.3847728776382749
Energy: 0.36339557438972364
Energy: 0.362122158237241
Energy: 0.4576188827433285
Energy: 0.3621221582391655
Energy: 0.3754622910032316
Energy: 0.3875438988215017
Energy: 0.3662593456868705
Energy: 0.3875438988227848
Energy: 0.3809966021895084
Energy: 0.3626512616526485
Energy: 0.3815833553841566
Energy: 0.3626512616552146
Energy: 0.35297757914909555
Energy: 0.39699430883266007
Energy: 0.3624310150237837
Energy: 0.39699430883009396
Energy: 0.380032174927616
Energy: 0.38863562669463586
Energy: 0.36769675933938056
Energy: 0.3886356266939944
Energy: 0.35204515982523155
Energy: 0.3621648987752488
Energy: 0.4136981171395755
Energy: 0.3621648987771734
Energy: 0.4496535238434428
Energy: 0.3644639477037885
Energy: 0.35876514952644134
Energy: 0.3644639477069961
Energy: 0.3520503505372427
Energy: 0.3621296608327029
Energy: 0.4608844239109867
Energy: 0.36212966082692927

minimum gb energy = 0.35204515982523155 eV
minimum distance =  2.51255014003428 Angstroms
sigma value = 29


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

Energy: 0.35282751875703183
Energy: 0.3685043133733019
Energy: 0.5856218486667587
Energy: 0.3685043133724329
Energy: 0.3666759704157477
Energy: 0.3384923021340262
Energy: 0.3585368371820971
Energy: 0.33849230213424975
Energy: 0.36846277557214285
Energy: 0.364767207902643
Energy: 0.4076484215105752
Energy: 0.364767207902643
Energy: 0.3618233707026455
Energy: 0.3444527428489695
Energy: 0.3585780030620482
Energy: 0.34445274284919297
Energy: 0.3533782323422492
Energy: 0.36096252014937563
Energy: 0.4122297394129386
Energy: 0.36096252014982255
Energy: 0.3793685325588106
Energy: 0.36433385831058296
Energy: 0.3795352897727524
Energy: 0.364333858311452
Energy: 0.3493971876885834
Energy: 0.3609394103056362
Energy: 0.35340900560113153
Energy: 0.3609394103054376
Energy: 0.35856563463096447
Energy: 0.34445725908153213
Energy: 0.3617062557026297
Energy: 0.3444572590808866
Energy: 0.4078894452112782
Energy: 0.36478121718583123
Energy: 0.38015551749552373
Energy: 0.3647812171849622

minimum gb energy = 0.3384923021340262 eV
minimum distance =  2.59063910304264 Angstroms
sigma value = 5


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

Energy: 0.3376250127412611
Energy: 0.352979688677223
Energy: 0.46702593946899074
Energy: 0.35297968867661705
Energy: 0.3989032920265782
Energy: 0.3649837967675451
Energy: 0.332810978217238
Energy: 0.36498379676693904
Energy: 0.3398744214742874
Energy: 0.3551357253204829
Energy: 0.41529568586905957
Energy: 0.3551357253210889
Energy: 0.34974003353542976
Energy: 0.36419185978052215
Energy: 0.33421034827854607
Energy: 0.36419185978173413
Energy: 0.33608283295678104
Energy: 0.36428175788469075
Energy: 0.4099869366618038
Energy: 0.3642817578834788
Energy: 0.3640392950327324
Energy: 0.3925295582519359
Energy: 0.33567112919909065
Energy: 0.3925295582519359
Energy: 0.33852571490447486
Energy: 0.3633602749254395
Energy: 0.3430229258467465
Energy: 0.36336027492604556
Energy: 0.3350720342690313
Energy: 0.36846181692273533
Energy: 0.34051553169623916
Energy: 0.36846181692273533
Energy: 0.3361517822094987
Energy: 0.3632342523022671
Energy: 0.3416062015691235
Energy: 0.3632342523046911
Energy: 0.33422070460586006
Energy: 0.3635579863630784
Energy: 0.3483651561619252
Energy: 0.36355798636247244
Energy: 0.3528374888669651
Energy: 0.3647668343814138
Energy: 0.3384128481559702
Energy: 0.3647668343820198
Energy: 0.3383125428219689
Energy: 0.37304532666231777
Energy: 0.3541751196983295
Energy: 0.37304532666231777
Energy: 0.37992693914292486
Energy: 0.3534121737208149
Energy: 0.35206390116704417
Energy: 0.3534121737214209
Energy: 0.33799696246341027
Energy: 0.35505576866660044
Energy: 0.3671921526229185
Energy: 0.35505576866660044
Energy: 0.39594615410007294
Energy: 0.3648085287890826
Energy: 0.3387023517277707
Energy: 0.3648085287884766
Energy: 0.3332895774137616
Energy: 0.3546199586410734
Energy: 0.36128555547094793
Energy: 0.3546199586410734
Energy: 0.3974806431885404
Energy: 0.3738469549680432
Energy: 0.3367980127823233
Energy: 0.37384695496864917
Energy: 0.3382426428399905
Energy: 0.35453601946591196
Energy: 0.39554268460422176
Energy: 0.35453601946530594
Energy: 0.3361769055864346
Energy: 0.36437239502881646
Energy: 0.33297973930007957
Energy: 0.3643723950306344
Energy: 0.3397042635576824
Energy: 0.3815763984044852
Energy: 0.34408075753586903
Energy: 0.3815763984044852
Energy: 0.3425999707666492
Energy: 0.3633421068741313
Energy: 0.3324389187430946
Energy: 0.36334210687534324
Energy: 0.33896774851732775
Energy: 0.3634833730328248
Energy: 0.34030982467642606
Energy: 0.3634833730328248
Energy: 0.332189410210875
Energy: 0.3638681356711596
Energy: 0.33933836521599764
Energy: 0.36386813567055365
Energy: 0.35296779865851335
Energy: 0.3492356701569442
Energy: 0.34028223603010543
Energy: 0.34923567015997414
Energy: 0.35737070056168707
Energy: 0.34536719648792497
Energy: 0.34079864340835425
Energy: 0.34536719648913694
Energy: 0.3457773381601546
Energy: 0.3685806290785542
Energy: 0.3382234289348675
Energy: 0.36858062907794825
Energy: 0.3352375586821494
Energy: 0.3633430671716319
Energy: 0.3664146091366533
Energy: 0.3633430671716319
Energy: 0.3778746370341223
Energy: 0.36887239736514393
Energy: 0.333555566106269
Energy: 0.36887239736393196
Energy: 0.33823123875011685
Energy: 0.36173368921798255
Energy: 0.3956560867041048
Energy: 0.3617336892167705
Energy: 0.376290419191473
Energy: 0.35305821718723146
Energy: 0.3383422649284165
Energy: 0.3530582171866255
Energy: 0.3344033689990221
Energy: 0.34264493657881984
Energy: 0.37561769783482163
Energy: 0.3426449365794258
Energy: 0.4090579131632725
Energy: 0.38295564579468305
Energy: 0.3381581142681894
Energy: 0.382955645795289
Energy: 0.3339723457331559
Energy: 0.3648554704091569
Energy: 0.34045095137598047
Energy: 0.36485547040855093

minimum gb energy = 0.332189410210875 eV
minimum distance =  2.53170879083586 Angstroms
sigma value = 1


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

Energy: 0.33117910588451244
Energy: 0.3314466218897581
Energy: 0.43656297857984916
Energy: 0.33144662188892027
Energy: 0.3293374830816763
Energy: 0.3420257372544668
Energy: 0.30810890555611453
Energy: 0.3420257372544668
Energy: 0.3158704161417195
Energy: 0.3316672086432408
Energy: 0.4722019429132441
Energy: 0.3316672086424029
Energy: 0.3212756421966519
Energy: 0.3488168780048348
Energy: 0.30707890620366446
Energy: 0.3488168780039969
Energy: 0.31555184217773974
Energy: 0.35908869135685534
Energy: 0.3889426056528271
Energy: 0.35908869135685534
Energy: 0.31482079399022667
Energy: 0.3784535747307293
Energy: 0.3072374220123624
Energy: 0.37845357473324304
Energy: 0.31559383726591533
Energy: 0.3586345955688541
Energy: 0.32234818835503554
Energy: 0.3586345955688541
Energy: 0.3152809624759402
Energy: 0.34746426762241056
Energy: 0.3508165870105984
Energy: 0.34746426762073473
Energy: 0.33158650405839324
Energy: 0.3224739926196346
Energy: 0.3423456685987511
Energy: 0.32247399261795884
Energy: 0.3315876880068211
Energy: 0.3223224413977215
Energy: 0.3271408410823687
Energy: 0.32232244139855937
Energy: 0.3153370620306253
Energy: 0.3473455992725175
Energy: 0.35094816180239985
Energy: 0.34734559927503117
Energy: 0.31537495110766034
Energy: 0.3586643826698391
Energy: 0.3273491832684951
Energy: 0.35866438267151485
Energy: 0.31516256790832586
Energy: 0.37834739734288764
Energy: 0.3072160493076484
Energy: 0.37834739734204975
Energy: 0.3153291977868047
Energy: 0.35908516793430884
Energy: 0.386163249642956
Energy: 0.35908516793430884
Energy: 0.3212819072441302
Energy: 0.3488062968084523
Energy: 0.3073911853858487
Energy: 0.34880629680761444
Energy: 0.31585790561616717
Energy: 0.33164889293843375
Energy: 0.36291298214722834
Energy: 0.3316488929375959
Energy: 0.3293902956813859
Energy: 0.3427521407649177
Energy: 0.3071852194257166
Energy: 0.3427521407649177
Energy: 0.33117910588451244
Energy: 0.3314466218897581
Energy: 0.4454702087215592
Energy: 0.33144662188892027
Energy: 0.3293374830833521
Energy: 0.3420257372544668
Energy: 0.30810890555611453
Energy: 0.34202573725530466
Energy: 0.3158704161417195
Energy: 0.3316672086432408
Energy: 0.4722019429132441
Energy: 0.3316672086424029
Energy: 0.32127564219581395
Energy: 0.3488168780048348
Energy: 0.30707890620366446
Energy: 0.3488168780039969
Energy: 0.31555184217773974
Energy: 0.35908869135685534
Energy: 0.38894260565366495
Energy: 0.35908869135685534
Energy: 0.31482079398938884
Energy: 0.3784535747307293
Energy: 0.30723742201320037
Energy: 0.37845357473324304
Energy: 0.31559383726591533
Energy: 0.3586345955688541
Energy: 0.32234818835503554
Energy: 0.3586345955688541

minimum gb energy = 0.30707890620366446 eV
minimum distance =  2.54822478015497 Angstroms
sigma value = 17


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

Energy: 0.33447348805021054
Energy: 0.3349721281707442
Energy: 0.4452022104705026
Energy: 0.33497212816815475
Energy: 0.40123079697822434
Energy: 0.32918741597066625
Energy: 0.32303801849960045
Energy: 0.32918741597066625
Energy: 0.3208852493935617
Energy: 0.33379249908007647
Energy: 0.4165474900196829
Energy: 0.333792499082148
Energy: 0.39789558912596523
Energy: 0.31763249394513837
Energy: 0.3211557721947755
Energy: 0.3176324939435847
Energy: 0.3239932383653686
Energy: 0.35505039239767
Energy: 0.3825299631870418
Energy: 0.35505039239767
Energy: 0.3260713617944398
Energy: 0.32350840574642314
Energy: 0.32247294818611166
Energy: 0.3235084057459052
Energy: 0.32462980295632893
Energy: 0.3515691794827532
Energy: 0.3346106328729462
Energy: 0.35156917948171734
Energy: 0.3204457042702708
Energy: 0.3457529663911035
Energy: 0.32513484126382725
Energy: 0.3457529663926571
Energy: 0.33997279555025106
Energy: 0.339059187597844
Energy: 0.3447612974918876
Energy: 0.339059187597844
Energy: 0.34152272602179823
Energy: 0.338756305839758
Energy: 0.32661802041684285
Energy: 0.3387563058402759
Energy: 0.3212846802099653
Energy: 0.33608449495085296
Energy: 0.32967457599485134
Energy: 0.3360844949513709
Energy: 0.3219509449936444
Energy: 0.3444751725291072
Energy: 0.3295556892089991
Energy: 0.3444751725285892
Energy: 0.32508968422199236
Energy: 0.3370386057495292
Energy: 0.32287522902994015
Energy: 0.3370386057495292
Energy: 0.3283996211639619
Energy: 0.3542044588538663
Energy: 0.33536036185340906
Energy: 0.3542044588538663
Energy: 0.32718083247031643
Energy: 0.32178061654982987
Energy: 0.3389611019048002
Energy: 0.32178061654931195
Energy: 0.32169023681823616
Energy: 0.3369387241176693
Energy: 0.3757294958103747
Energy: 0.3369387241161156
Energy: 0.33430530615119025
Energy: 0.3185464611525674
Energy: 0.32387107299878753
Energy: 0.31854646115722834
Energy: 0.3183028737084758
Energy: 0.3354991771602508
Energy: 0.3344884250009625
Energy: 0.33549917715973293
Energy: 0.37533500489503496
Energy: 0.3463619319890985
Energy: 0.32161696393854794
Energy: 0.34636193198650905
Energy: 0.3194101882616704
Energy: 0.3333410583722465
Energy: 0.36240587480288655
Energy: 0.3333410583706928
Energy: 0.39214022985150393
Energy: 0.3261872917729152
Energy: 0.31868631525229496
Energy: 0.32618729177032585
Energy: 0.3176904865505457
Energy: 0.3371863119517207
Energy: 0.3673185613230677
Energy: 0.3371863119512029
Energy: 0.34181081910419436
Energy: 0.320259295932339
Energy: 0.3202876281593298
Energy: 0.32025929593596414
Energy: 0.3214539536661761
Energy: 0.35275708912255216
Energy: 0.3822289865328977
Energy: 0.3527570891220343
Energy: 0.3429436118063686
Energy: 0.3355191317941412
Energy: 0.31993257578898127
Energy: 0.33551913179258763
Energy: 0.31676903865242384
Energy: 0.35492243079491936
Energy: 0.34543383448998694
Energy: 0.3549224307980267
Energy: 0.380087099771395
Energy: 0.3379730315964199
Energy: 0.32259814672253706
Energy: 0.33797303159538417
Energy: 0.3411384872375255
Energy: 0.3762319748946775
Energy: 0.3259641306101576
Energy: 0.3762319748931239
Energy: 0.3449688931007529
Energy: 0.35409030067796543
Energy: 0.32319433661920616
Energy: 0.35409030067900127
Energy: 0.3167709134485308
Energy: 0.33699685125695467
Energy: 0.34892597486863736
Energy: 0.3369968512579904
Energy: 0.3298953806167826
Energy: 0.35367669712601046
Energy: 0.3234637601168999
Energy: 0.35367669712549255
Energy: 0.31852704886880273
Energy: 0.3362146875318122
Energy: 0.31886456186221496
Energy: 0.3362146875307765
Energy: 0.3217365430403769
Energy: 0.3388597836600486
Energy: 0.3890531509226163
Energy: 0.3388597836610843
Energy: 0.3448100619489755
Energy: 0.37993129347157956
Energy: 0.3207254854613031
Energy: 0.37993129347261534
Energy: 0.3268342271343327
Energy: 0.3385869225962106
Energy: 0.3415519874806524
Energy: 0.3385869225951748
Energy: 0.3535945927970306
Energy: 0.3522632326150761
Energy: 0.3232928587072206
Energy: 0.35226323261404036
Energy: 0.3203020218896326
Energy: 0.3194479577361835
Energy: 0.32794542805646965
Energy: 0.3194479577351477
Energy: 0.3762224690433524
Energy: 0.35577468001450807
Energy: 0.31780660018560264
Energy: 0.35577468001502593

minimum gb energy = 0.31676903865242384 eV
minimum distance =  2.52829828077584 Angstroms
sigma value = 89


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

Energy: 0.28756841609982864
Energy: 0.28777265733141577
Energy: 0.5769008967801811
Energy: 0.28777265733141577
Energy: 0.29462205646302686
Energy: 0.2926827405525486
Energy: 0.29608508341484846
Energy: 0.29268274055390364
Energy: 0.2943622473467979
Energy: 0.332108450740076
Energy: 0.559852183501994
Energy: 0.332108450740076
Energy: 0.2975714819067342
Energy: 0.29261483217392015
Energy: 0.29592319134345246
Energy: 0.29261483217392015
Energy: 0.2879662850289231
Energy: 0.32004606076732905
Energy: 0.30198694056775194
Energy: 0.32004606076732905
Energy: 0.2946854136006982
Energy: 0.2878910945103435
Energy: 0.289728696063378
Energy: 0.2878910945103435
Energy: 0.2944482120269408
Energy: 0.33145097341782964
Energy: 0.29506898240289625
Energy: 0.33145097341782964
Energy: 0.31684989815467396
Energy: 0.36106005459025636
Energy: 0.29582072109235447
Energy: 0.36106005459025636
Energy: 0.2879851698556066
Energy: 0.31874890033686465
Energy: 0.31346438448358865
Energy: 0.31874890033686465
Energy: 0.29328150693676275
Energy: 0.2881674287326863
Energy: 0.2895186364319355
Energy: 0.2881674287326863
Energy: 0.28773863765884883
Energy: 0.292684314282901
Energy: 0.2946542756809163
Energy: 0.292684314282901
Energy: 0.2877336012075125
Energy: 0.3303762602582246
Energy: 0.2959220098246542
Energy: 0.3303762602582246
Energy: 0.2879144904891659
Energy: 0.2883483740679582
Energy: 0.2981524358515354
Energy: 0.2883483740679582
Energy: 0.2894077577264938
Energy: 0.31742951070462727
Energy: 0.2894055558432468
Energy: 0.31742951070462727
Energy: 0.31545829313605
Energy: 0.2883590796581524
Energy: 0.2880259734348094
Energy: 0.2883590796581524

minimum gb energy = 0.28756841609982864 eV
minimum distance =  2.56297559201105 Angstroms
sigma value = 13


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

Energy: 0.2950847885143754
Energy: 0.2851260517277273
Energy: 0.4677505632509462
Energy: 0.2851260517294311
Energy: 0.31321192375074675
Energy: 0.28911401605591214
Energy: 0.28927774408550505
Energy: 0.2891140160587519
Energy: 0.28526535163529304
Energy: 0.2850236730035016
Energy: 0.4546073014931519
Energy: 0.28502367300122977
Energy: 0.2907925084402554
Energy: 0.28938984522215855
Energy: 0.28691350038574603
Energy: 0.2893898452204547
Energy: 0.2903866823789455
Energy: 0.30987832901312995
Energy: 0.31021070670367873
Energy: 0.3098783290159697
Energy: 0.29084087738016995
Energy: 0.2910124553132133
Energy: 0.2922884865435564
Energy: 0.29101245531037356
Energy: 0.29252709787977493
Energy: 0.3056731225287843
Energy: 0.3565352350171044
Energy: 0.3056731225287843
Energy: 0.28959741857828325
Energy: 0.28898287811908036
Energy: 0.292244413931134
Energy: 0.28898287811624057
Energy: 0.29024979839984083
Energy: 0.3056952671084715
Energy: 0.34784116002798343
Energy: 0.3056952671084715
Energy: 0.3660098548565726
Energy: 0.3116165663385362
Energy: 0.28704303310015394
Energy: 0.3116165663391041
Energy: 0.29062312048792255
Energy: 0.31225772334816826
Energy: 0.3041175581126349
Energy: 0.31225772334873625
Energy: 0.30389569298564356
Energy: 0.3114185344243808
Energy: 0.28632543693716944
Energy: 0.3114185344300603
Energy: 0.30042078837626096
Energy: 0.28969865385614696
Energy: 0.2964283323142505
Energy: 0.28969865385501103
Energy: 0.4051690523928155
Energy: 0.3117576627552138
Energy: 0.2865253871013826
Energy: 0.3117576627625972
Energy: 0.29053287736061667
Energy: 0.2843715283325887
Energy: 0.2931391327678917
Energy: 0.2843715283320208
Energy: 0.30650797835997184
Energy: 0.31192005819122137
Energy: 0.2887701617665726
Energy: 0.3119200581917893
Energy: 0.30064074945827546
Energy: 0.30743531363882304
Energy: 0.2892510781581395
Energy: 0.307435313639391
Energy: 0.2984396688703023
Energy: 0.3045431267125102
Energy: 0.29811992996371933
Energy: 0.3045431267153499
Energy: 0.3002943220204646
Energy: 0.2915773883753621
Energy: 0.2981918967587301
Energy: 0.2915773883782018
Energy: 0.300331697689051
Energy: 0.29156483341383277
Energy: 0.29826041521871954
Energy: 0.2915648334132648
Energy: 0.2983824950172942
Energy: 0.3043682352714057
Energy: 0.2980985580912209
Energy: 0.30436823526970186
Energy: 0.3005995233379012
Energy: 0.3073095586049223
Energy: 0.28924502712120315
Energy: 0.3073095586077621
Energy: 0.3065156187437059
Energy: 0.31193975927109485
Energy: 0.2892044570649839
Energy: 0.31193975927109485
Energy: 0.29054609791406216
Energy: 0.28437738419641223
Energy: 0.2961359815777143
Energy: 0.28437738419811603
Energy: 0.4050385107093041
Energy: 0.31145402929332533
Energy: 0.2866014867286562
Energy: 0.31145402929275745
Energy: 0.3005056567397092
Energy: 0.289913629664785
Energy: 0.3094469429892148
Energy: 0.28991362965853756
Energy: 0.3033358808663584
Energy: 0.31141368882912857
Energy: 0.2863164807423877
Energy: 0.3114136888296965
Energy: 0.29040767294118697
Energy: 0.31237330260258345
Energy: 0.3086353117437883
Energy: 0.31237330260428736
Energy: 0.3658288913368914
Energy: 0.3116549023523903
Energy: 0.2870494306542107
Energy: 0.3116549023523903
Energy: 0.2901763634028895
Energy: 0.30563575491077477
Energy: 0.4081789859606665
Energy: 0.30563575491020684
Energy: 0.29645076699031236
Energy: 0.2890966652287634
Energy: 0.2922476548999475
Energy: 0.2890966652293314
Energy: 0.28505296392515006
Energy: 0.3054994967103982
Energy: 0.41209289024861456
Energy: 0.3054994967058546
Energy: 0.2906183310475126
Energy: 0.2909478400389411
Energy: 0.29224492838216176
Energy: 0.2909478400412129
Energy: 0.29034838061934737
Energy: 0.3099633052123203
Energy: 0.3189375432083799
Energy: 0.3099633052174318
Energy: 0.2906499921695013
Energy: 0.28939586448223337
Energy: 0.28692216755804173
Energy: 0.28939586448052945

minimum gb energy = 0.2843715283320208 eV
minimum distance =  2.5956554934488 Angstroms
sigma value = 37


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

Energy: 0.2631256188171966
Energy: 0.26340956657882875
Energy: 0.2858016878854237
Energy: 0.2634095665798059
Energy: 0.3029014098041175
Energy: 0.2929487065184141
Energy: 0.2658536359269811
Energy: 0.2929487065213455
Energy: 0.2640132298985285
Energy: 0.27734689286030845
Energy: 0.36330760693964276
Energy: 0.2773468928593313
Energy: 0.26523260694114353
Energy: 0.2929717467767733
Energy: 0.26599592217107315
Energy: 0.2929717467777504
Energy: 0.26531047011593606
Energy: 0.2632219857581684
Energy: 0.316239615594032
Energy: 0.2632219857581684
Energy: 0.27114959771418595
Energy: 0.29338154083845647
Energy: 0.2627882581712053
Energy: 0.2933815408394336
Energy: 0.27048685487477475
Energy: 0.3036018659218235
Energy: 0.35813336449225264
Energy: 0.3036018659218235
Energy: 0.2628656727531673
Energy: 0.2635052023423922
Energy: 0.2643960325849949
Energy: 0.2635052023423922
Energy: 0.2651525624927509
Energy: 0.26399295414618645
Energy: 0.35789041536034244
Energy: 0.26399295414618645
Energy: 0.38350765392528163
Energy: 0.26330431035669744
Energy: 0.26289894208885767
Energy: 0.26330431035572033
Energy: 0.2703765043517461
Energy: 0.27313229579543113
Energy: 0.26516567125565166
Energy: 0.27313229579543113
Energy: 0.38256386399983816
Energy: 0.2634200249293549
Energy: 0.2660251582940061
Energy: 0.2634200249283778
Energy: 0.26167306736515195
Energy: 0.2932680049941355
Energy: 0.2710888191278981
Energy: 0.2932680049931584
Energy: 0.35793123945425026
Energy: 0.27301472077750755
Energy: 0.2625516157147094
Energy: 0.2730147207784847
Energy: 0.26329948609365317
Energy: 0.27258057646243256
Energy: 0.2652153075434443
Energy: 0.2725805764634097
Energy: 0.26353071014602175
Energy: 0.26352582039895767
Energy: 0.26577107216416795
Energy: 0.26352582039895767
Energy: 0.2617061871314722
Energy: 0.29328261846851117
Energy: 0.28556970529919284
Energy: 0.29328261846851117
Energy: 0.26564062275983513
Energy: 0.2740812417374636
Energy: 0.2619405528650946
Energy: 0.2740812417364865
Energy: 0.26665732384016966
Energy: 0.2636772318555919
Energy: 0.26193458475593373
Energy: 0.2636772318555919
Energy: 0.261722981958596
Energy: 0.2636126313818488
Energy: 0.2618359619222014
Energy: 0.26361263138087176

minimum gb energy = 0.26167306736515195 eV
minimum distance =  2.58207922002721 Angstroms
sigma value = 25


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

Energy: 0.25078384322126496
Energy: 0.24470525696017464
Energy: 0.39760846784055875
Energy: 0.24470525695864861
Energy: 0.3407863881693691
Energy: 0.24660369852919084
Energy: 0.24556394956337355
Energy: 0.24660369852846248
Energy: 0.24221445458095409
Energy: 0.24252340563393915
Energy: 0.317568420765473
Energy: 0.24252340563393915
Energy: 0.2785114295998438
Energy: 0.24664263226032415
Energy: 0.2455842165028813
Energy: 0.24664263226032415
Energy: 0.24508470919141517
Energy: 0.24661101690948561
Energy: 0.24849417876567467
Energy: 0.24661101690948561
Energy: 0.24828895339925028
Energy: 0.2467887941365017
Energy: 0.24578201823204596
Energy: 0.24678879413573868
Energy: 0.2459280011697183
Energy: 0.24299324336015657
Energy: 0.2789703596321738
Energy: 0.24299324336091957
Energy: 0.3161146682063205
Energy: 0.2518926164550224
Energy: 0.24291708494311928
Energy: 0.2518926164550224
Energy: 0.24501702111321158
Energy: 0.24622997384487616
Energy: 0.3395582917345628
Energy: 0.24622997384487616
Energy: 0.245233795403496
Energy: 0.24458354046770422
Energy: 0.2515712463746623
Energy: 0.24458354046770422
Energy: 0.245901128387687
Energy: 0.24331931174279908
Energy: 0.3989015937702155
Energy: 0.24331931174203605
Energy: 0.32847642984043907
Energy: 0.2782860601101899
Energy: 0.2429528676938529
Energy: 0.27828606011171597
Energy: 0.2451062872220583
Energy: 0.24659773062315227
Energy: 0.3229304801801111
Energy: 0.24659773062315227
Energy: 0.34605966259833904
Energy: 0.2673012136300044
Energy: 0.24569831539941606
Energy: 0.2673012136322934
Energy: 0.24582582246948684
Energy: 0.2434396839929087
Energy: 0.2478026149576662
Energy: 0.24343968399367172
Energy: 0.2788290075013581
Energy: 0.27817533780376336
Energy: 0.24543656966435393
Energy: 0.27817533780452636
Energy: 0.24516687184079783
Energy: 0.25182504135751355
Energy: 0.2516247436539261
Energy: 0.25182504135751355
Energy: 0.32557588245348656
Energy: 0.24707764148111389
Energy: 0.24564285336695327
Energy: 0.2470776414803509
Energy: 0.2537450905174387
Energy: 0.2423199264748998
Energy: 0.24742420228627737
Energy: 0.24231992647566286
Energy: 0.4000946484390854
Energy: 0.274901105815337
Energy: 0.24545706961537667
Energy: 0.27490110581610006
Energy: 0.24513095486122258
Energy: 0.2521432646948813
Energy: 0.25169933256818183
Energy: 0.2521432646956443
Energy: 0.24473498438377647
Energy: 0.24676649345507828
Energy: 0.24560952900289737
Energy: 0.2467664934566043
Energy: 0.24625878562576264
Energy: 0.24350193001702594
Energy: 0.3461173353717064
Energy: 0.24350193001702594
Energy: 0.24762656587783688
Energy: 0.2748849858527095
Energy: 0.24526012537451236
Energy: 0.2748849858534725
Energy: 0.24450130288227961
Energy: 0.2748738643346875
Energy: 0.342807368378388
Energy: 0.2748738643346875
Energy: 0.2447972936088247
Energy: 0.25191030022250843
Energy: 0.24612094620842986
Energy: 0.25191030022327143

minimum gb energy = 0.24221445458095409 eV
minimum distance =  2.59364381021435 Angstroms
sigma value = 41


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

Energy: 0.36894798521066974
Energy: 0.23478575959921325
Energy: 0.4885448560274595
Energy: 0.2347857595998388
Energy: 0.3671546619377562
Energy: 0.23114213679095902
Energy: 0.2300950326960318
Energy: 0.23114213679158457
Energy: 0.2313193809291524
Energy: 0.23024280361829225
Energy: 0.2399709329172787
Energy: 0.23024280361829225
Energy: 0.31327893393028866
Energy: 0.22952350707988742
Energy: 0.22997497560735417
Energy: 0.22952350707926186
Energy: 0.22780667026082904
Energy: 0.23697599706928915
Energy: 0.25347855420358406
Energy: 0.2369759970686636
Energy: 0.2597679550975072
Energy: 0.22967536428844437
Energy: 0.2304001239370135
Energy: 0.22967536428906993
Energy: 0.2297980662051457
Energy: 0.23027845216887766
Energy: 0.25995192901447645
Energy: 0.23027845216762657
Energy: 0.2313889804439553
Energy: 0.233950313523522
Energy: 0.22838305633281958
Energy: 0.23395031352414752
Energy: 0.230943359733664
Energy: 0.28645038517101273
Energy: 0.31190516834199333
Energy: 0.28645038517226384
Energy: 0.23785539564822053
Energy: 0.22962779038481484
Energy: 0.23173494873202577
Energy: 0.2296277903854404
Energy: 0.22962325363961822
Energy: 0.23088647774824397
Energy: 0.3684142225017341
Energy: 0.23088647774886953
Energy: 0.23066085913545945
Energy: 0.2343444552359725
Energy: 0.36937525619191414
Energy: 0.23434445523659805
Energy: 0.23080682177863657
Energy: 0.28607001172675495
Energy: 0.39779096590026736
Energy: 0.28607001172738045
Energy: 0.2959959325811193
Energy: 0.24256139166583204
Energy: 0.2317393838139186
Energy: 0.24256139166645757
Energy: 0.22962268507099703
Energy: 0.22951379270528235
Energy: 0.36503002910477306
Energy: 0.22951379270590788
Energy: 0.3153925683418562
Energy: 0.23363039971784896
Energy: 0.22844679356232458
Energy: 0.23363039971537522
Energy: 0.23094601784954388
Energy: 0.284583840709969
Energy: 0.3324539226445743
Energy: 0.28458384070871795
Energy: 0.3142726235675318
Energy: 0.3536386501397399
Energy: 0.23010815617579877
Energy: 0.3536386501397399
Energy: 0.2300350510506828
Energy: 0.23406737770426295
Energy: 0.2327431099028553
Energy: 0.2340673777048885
Energy: 0.29511150348203957
Energy: 0.28569949261376426
Energy: 0.23284320292042532
Energy: 0.2856994926143898
Energy: 0.23284369299128152
Energy: 0.2840614740038291
Energy: 0.2407283914513022
Energy: 0.2840614740032036
Energy: 0.4205789386834709
Energy: 0.32724504398215626
Energy: 0.23033431671248294
Energy: 0.3272450439827818
Energy: 0.3704074430660043
Energy: 0.23164946016666704
Energy: 0.23095085921830855
Energy: 0.23164946016791815
Energy: 0.3636798486971518
Energy: 0.2847976672608764
Energy: 0.23262117306237245
Energy: 0.2847976672608764
Energy: 0.2330081326084696
Energy: 0.32241296475911085
Energy: 0.23909138214133707
Energy: 0.32241296475911085
Energy: 0.36227029081223977
Energy: 0.32655915663565094
Energy: 0.2301698475231522
Energy: 0.3265591566350253
Energy: 0.2297402425228679
Energy: 0.23302903703236041
Energy: 0.315496438523642
Energy: 0.23302903703236041
Energy: 0.22958455671614028
Energy: 0.2843029716817504
Energy: 0.23294887529039318
Energy: 0.2843029716811248
Energy: 0.23098202918530408
Energy: 0.3222040284754075
Energy: 0.31429417351827893
Energy: 0.32220402847478197
Energy: 0.2328673082978787
Energy: 0.29398819836123946
Energy: 0.23136916220704254
Energy: 0.29398819836061396
Energy: 0.22922868982616526
Energy: 0.28399293432381156
Energy: 0.3065453683808773
Energy: 0.2839929343244371
Energy: 0.23058387967056
Energy: 0.3200636821439303
Energy: 0.23491175246344423
Energy: 0.3200636821433047

minimum gb energy = 0.22780667026082904 eV
minimum distance =  2.62882007761213 Angstroms
sigma value = 15


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

Energy: 0.3368588965050084
Energy: 0.30426945252749016
Energy: 0.35982076217673414
Energy: 0.30426945252855003
Energy: 0.3915085355279902
Energy: 0.2686984881030479
Energy: 0.21919541634366765
Energy: 0.26869848810251795
Energy: 0.22299736834137412
Energy: 0.21964497954507514
Energy: 0.2271489385305832
Energy: 0.21964497954507514
Energy: 0.33877393849907206
Energy: 0.26622714805800995
Energy: 0.21922708647116987
Energy: 0.26622714805853986
Energy: 0.2178432406555814
Energy: 0.30482071241892694
Energy: 0.3435706832347148
Energy: 0.30482071241945685
Energy: 0.29189742107398536
Energy: 0.26689464793039963
Energy: 0.219686289122153
Energy: 0.26689464793198947
Energy: 0.21894325007665677
Energy: 0.2215096697415005
Energy: 0.2379103461903269
Energy: 0.22150966974256034
Energy: 0.2453542864157361
Energy: 0.22092775876537346
Energy: 0.21922738478181264
Energy: 0.2209277587674932
Energy: 0.2201780195480721
Energy: 0.30577675277815336
Energy: 0.29070197121171604
Energy: 0.30577675277762345
Energy: 0.21969151992752758
Energy: 0.26718479385379457
Energy: 0.2182994202526155
Energy: 0.26718479385379457
Energy: 0.21891631149404792
Energy: 0.26826103587660477
Energy: 0.33873797666024924
Energy: 0.2682610358760749
Energy: 0.22412893198296144
Energy: 0.21942164373770612
Energy: 0.22351016345685
Energy: 0.21942164374088569
Energy: 0.22013886327566715
Energy: 0.3056384676771784
Energy: 0.3907344189870845
Energy: 0.3056384676777083
Energy: 0.21909421047874453
Energy: 0.3048192256807245
Energy: 0.3371547457925476
Energy: 0.3048192256817844
Energy: 0.21891949269058802
Energy: 0.26866458082753797
Energy: 0.3917263453002882
Energy: 0.26866458082859784
Energy: 0.27292855288605367
Energy: 0.21916204643649528
Energy: 0.22330536406036572
Energy: 0.21916204643702522
Energy: 0.2200359280677576
Energy: 0.3057772228518554
Energy: 0.38739100066132653
Energy: 0.30577722285291525
Energy: 0.2921212416464102
Energy: 0.30454961990181423
Energy: 0.2182922341509754
Energy: 0.304549619903404
Energy: 0.2192804625836939
Energy: 0.26648928109694997
Energy: 0.338373828348046
Energy: 0.2664892810958901
Energy: 0.2913312314777103
Energy: 0.2680095653403459
Energy: 0.21941002665188467
Energy: 0.26800956533875614
Energy: 0.2200579403998587
Energy: 0.273149059611284
Energy: 0.27675681163395166
Energy: 0.27314905961287383
Energy: 0.2857126428059099
Energy: 0.3281824486284761
Energy: 0.2214242484325219
Energy: 0.32818244862741625
Energy: 0.21891055617876906
Energy: 0.26677004870815385
Energy: 0.23174881928717717
Energy: 0.266770048707094
Energy: 0.3401113488806973
Energy: 0.2683688404519551
Energy: 0.21915946296083882
Energy: 0.26836884045089526
Energy: 0.22427018062854925
Energy: 0.2721054719984312
Energy: 0.22316126829788074
Energy: 0.2721054719994911
Energy: 0.38817144600166187
Energy: 0.3042763988459175
Energy: 0.22135801917944417
Energy: 0.3042763988459175
Energy: 0.3378950752491993
Energy: 0.30161899826269173
Energy: 0.21935941830400463
Energy: 0.30161899826269173
Energy: 0.4373521704362066
Energy: 0.26783511090606527
Energy: 0.2190813007536171
Energy: 0.26783511090606527
Energy: 0.22426601515596123
Energy: 0.3072024120893577
Energy: 0.22525360492242252
Energy: 0.30720241208829785
Energy: 0.3358221464028295
Energy: 0.3048971688702048
Energy: 0.22129784178194703
Energy: 0.3048971688707347
Energy: 0.218880061977612
Energy: 0.3017489031397289
Energy: 0.2918420557137
Energy: 0.3017489031376092
Energy: 0.33639916899350225
Energy: 0.26769908850217045
Energy: 0.219154287042297
Energy: 0.26769908850217045
Energy: 0.22008794713916238
Energy: 0.3072049147531981
Energy: 0.2912939364132092
Energy: 0.307204914754258
Energy: 0.21793632506763533
Energy: 0.27474214415966647
Energy: 0.22150633580449136
Energy: 0.27474214416125625
Energy: 0.22018452435508204
Energy: 0.3015510535616459
Energy: 0.28596203535907744
Energy: 0.3015510535600561
Energy: 0.22080420327971034
Energy: 0.2993458792979926
Energy: 0.22037355173147416
Energy: 0.29934587929958245
Energy: 0.21993217906506274
Energy: 0.3072441820213761
Energy: 0.39957367309766395
Energy: 0.3072441820192564

minimum gb energy = 0.2178432406555814 eV
minimum distance =  2.65274822636 Angstroms
sigma value = 85


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

Energy: 0.33311604746655066
Energy: 0.28614630048446976
Energy: 0.32853303682558976
Energy: 0.2861463004835506
Energy: 0.4191443494924085
Energy: 0.20448008585990413
Energy: 0.1964602589272363
Energy: 0.2044800858594445
Energy: 0.3255775977556697
Energy: 0.20445579540283193
Energy: 0.2765587812545258
Energy: 0.20445579540191272
Energy: 0.3761031240620646
Energy: 0.20256981167140822
Energy: 0.1963905194846961
Energy: 0.20256981167140822
Energy: 0.22628492479701912
Energy: 0.19827893254579906
Energy: 0.22874453497460467
Energy: 0.19827893254671827
Energy: 0.3334829446122831
Energy: 0.20417154393581244
Energy: 0.19623861454052446
Energy: 0.20417154393627204
Energy: 0.22057427640473823
Energy: 0.20486224522523108
Energy: 0.24350114775345935
Energy: 0.20486224522477148
Energy: 0.29667833215682027
Energy: 0.2012259854194268
Energy: 0.19764670591161038
Energy: 0.20122598541896716
Energy: 0.19720523774535065
Energy: 0.19763723861574453
Energy: 0.2943812372034578
Energy: 0.19763723861712332
Energy: 0.2534752999984401
Energy: 0.20585543025781403
Energy: 0.22090306743170104
Energy: 0.20585543025827363
Energy: 0.19725065849347434
Energy: 0.2016339358694164
Energy: 0.333716376181396
Energy: 0.20163393586803757
Energy: 0.22242090007194065
Energy: 0.20487026943715628
Energy: 0.2266159933767079
Energy: 0.20487026943715628
Energy: 0.1961382895870389
Energy: 0.19854096020786752
Energy: 0.3760142935128815
Energy: 0.19854096020786752
Energy: 0.20476318984085082
Energy: 0.20437605800285305
Energy: 0.3258310129800333
Energy: 0.20437605800285305
Energy: 0.1970796048042057
Energy: 0.20218974502668463
Energy: 0.4197569041988737
Energy: 0.20218974502714424
Energy: 0.19894588139091499
Energy: 0.28192438521315627
Energy: 0.3044163571473399
Energy: 0.28192438521131785
Energy: 0.19607019157280423
Energy: 0.19835563381933458
Energy: 0.4187361093881192
Energy: 0.19835563382071342
Energy: 0.24501431477476301
Energy: 0.20473216809903716
Energy: 0.3258348250811042
Energy: 0.20473216809857753
Energy: 0.19715106289370235
Energy: 0.20261308419578522
Energy: 0.4075672316746755
Energy: 0.20261308419716406
Energy: 0.26147284647652513
Energy: 0.2827607131367342
Energy: 0.22679030231757819
Energy: 0.28276071313489576
Energy: 0.19653045009466852
Energy: 0.19973391875705226
Energy: 0.3620175353223906
Energy: 0.1997339187575119
Energy: 0.31194954178912143
Energy: 0.202356240620239
Energy: 0.22089396003643014
Energy: 0.20235624061931978
Energy: 0.19870702871672238
Energy: 0.2014198108855033
Energy: 0.3152376018351197
Energy: 0.20141981088320526
Energy: 0.30913672919519763
Energy: 0.2844792575272759
Energy: 0.19775314403616218
Energy: 0.2844792575268163
Energy: 0.22171425775844708
Energy: 0.20190629566158366
Energy: 0.29386563978673724
Energy: 0.20190629566342208
Energy: 0.37014445258687284
Energy: 0.20244379437246185
Energy: 0.1983697692843256
Energy: 0.20244379437384066
Energy: 0.22730631890632969
Energy: 0.20107835590066175
Energy: 0.22255210204004403
Energy: 0.20107835589882334
Energy: 0.3361912127814155
Energy: 0.2851698520131331
Energy: 0.19645940203974552
Energy: 0.28516985201175427
Energy: 0.3265406063346114
Energy: 0.20616726962715745
Energy: 0.20156993611018928
Energy: 0.20616726962899587
Energy: 0.4730007928807474
Energy: 0.20270997520896006
Energy: 0.19825043573335732
Energy: 0.20270997520850043
Energy: 0.33397276628450107
Energy: 0.2804603572290565
Energy: 0.19895453775636515
Energy: 0.28046035722951607
Energy: 0.41166724854811637
Energy: 0.28242497474445105
Energy: 0.19635617151249807
Energy: 0.2824249747467491
Energy: 0.3265598919269512
Energy: 0.20346916773352872
Energy: 0.2034597451181809
Energy: 0.2034691677312307
Energy: 0.407585210658078
Energy: 0.20121741912347527
Energy: 0.1983812706053921
Energy: 0.20121741912257696
Energy: 0.22746298450366767
Energy: 0.2790278073323788
Energy: 0.26111846526831156
Energy: 0.27902780733191923
Energy: 0.31573026461719683
Energy: 0.20805632655023942
Energy: 0.197381729219967
Energy: 0.2080563265516182
Energy: 0.22167634853818305
Energy: 0.2015319847365743
Energy: 0.2853502821836215
Energy: 0.20153198473519546
Energy: 0.31510662614016244
Energy: 0.20151822149439497
Energy: 0.19804668541580894
Energy: 0.20151822149531418
Energy: 0.19875027173551274
Energy: 0.27895707261287456
Energy: 0.28024551330049285
Energy: 0.278957072612415
Energy: 0.2203131656781643
Energy: 0.21045740868533366
Energy: 0.22305957327821826
Energy: 0.21045740868533366
Energy: 0.1965500721244003
Energy: 0.20146069949629838
Energy: 0.37495015684379446
Energy: 0.20146069949675796
Energy: 0.22246225275543619
Energy: 0.201252983451332
Energy: 0.22858061003270103
Energy: 0.201252983451332
Energy: 0.1972117706578584
Energy: 0.27922436586477656
Energy: 0.3724750318431356
Energy: 0.2792243658661554

minimum gb energy = 0.19607019157280423 eV
minimum distance =  2.65894131124103 Angstroms
sigma value = 113


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

Energy: 0.012550488083414304
Energy: 0.013301273933006537
Energy: 0.5190120944668543
Energy: 0.013301273933006537
Energy: 0.29305488030433113
Energy: 0.1311137316775776
Energy: 0.13003904623702375
Energy: 0.1311137316779309
Energy: 0.012550488083414304
Energy: 0.013301273933006537
Energy: 0.7380464600129826
Energy: 0.013301273932672846
Energy: 0.29305488030433113
Energy: 0.13111373167724388
Energy: 0.13003904623804444
Energy: 0.1311137316775776
Energy: 0.012550488083414304
Energy: 0.013301273933006537
Energy: 0.7796296984904436
Energy: 0.013301273932672846
Energy: 0.29305488030433113
Energy: 0.13111373167897125
Energy: 0.13003904623804444
Energy: 0.13111373167897125

minimum gb energy = 0.012550488083414304 eV
minimum distance =  2.84077019433752 Angstroms
sigma value = 1