Model name: model_name=EAM_Dynamo_AdamsFoilesWolfer_1989Universal6_Pt__MO_388062184209_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.920000053942204
cohesive_energy=5.77045383825134
mass=195.084
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=[1.443410542630404e-19, 2.43348200231724e-19, 3.27387171214926e-19, 4.00798904584806e-19, 4.6584887810184e-19, 5.23958222440386e-19, 5.76112276230354e-19, 6.230352233103119e-19, 6.652894276787939e-19, 7.0331548791015e-19, 7.374787002769319e-19, 7.6807706963306395e-19, 7.953685464166199e-19, 8.19571026649824e-19, 8.408735671754879e-19, 8.59442794363548e-19, 8.75426108464332e-19, 8.889564901384619e-19, 9.00147693926952e-19, 9.09110270017548e-19, 9.159371446550219e-19, 9.20718039730878e-19, 9.23533064076816e-19, 9.24455917818e-19, 9.2345455742175e-19, 9.2019412797156e-19, 9.14237235246348e-19, 9.050599674867958e-19, 8.92024658392572e-19, 8.74368671885892e-19, 8.511531324592319e-19, 8.212404947024519e-19, 7.832240475308999e-19, 7.35368633649954e-19, 6.755065080738119e-19, 6.00917174877942e-19, 5.08159158652512e-19, 3.9283929106709396e-19, 2.4928426466069395e-19, 7.010147622637259e-20, -1.54468252548891e-19, -4.37483942973504e-19, -7.966871377864019e-19, -1.25657912316303e-18, -1.8516996229791598e-18, -2.6318154478401e-18, -3.67061871202668e-18, -5.08035791051694e-18, -7.02028940073048e-18, -9.7434769820076e-18, -1.3743503209984677e-17, -1.99801039319604e-17, -3.0529155325543197e-17, -5.061692552730839e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018927836877800485
Energy: 0.10577771565450697
Energy: 0.8047244110986789
Energy: 0.020054613523473524
Energy: 0.10577771565607758
Energy: 0.9344118614202238
Energy: 0.02005461352296975
Energy: 0.9344118614415897
Energy: 0.8047244110913889
Energy: 0.020054613523473524
Energy: 0.018927836877800485
Energy: 0.10577771564878762
Energy: 0.020054613524006937
Energy: 0.9344118614228315
Energy: 0.10577771565189917
Energy: 0.9344118614270099

minimum gb energy = 0.018927836877800485 eV
minimum distance =  2.64296697689153 Angstroms
sigma value = 1


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

Energy: 1.4052430663229414
Energy: 0.8874071497418307
Energy: 0.8884346218261922
Energy: 0.8439300324684605
Energy: 0.8718257812278538
Energy: 0.9192715260602028
Energy: 0.8701254973670838
Energy: 0.9192715260608497
Energy: 0.8859551132550852
Energy: 0.8868117593670434
Energy: 0.8830872152815176
Energy: 0.8868117593683372
Energy: 0.8706848675982621
Energy: 0.8760918527295811
Energy: 0.869838131889819
Energy: 0.8760918527289342
Energy: 0.9177247089930692
Energy: 0.8713384374256227
Energy: 0.8710655570535744
Energy: 0.8713384374262697
Energy: 0.87152976376592
Energy: 0.9342005919287966
Energy: 0.8707045789071093
Energy: 0.9342005919307373
Energy: 0.9144103701582234
Energy: 0.9341685765490619
Energy: 0.9178956926653189
Energy: 0.9341685765471212
Energy: 0.9142754416945178
Energy: 0.9638314267554894
Energy: 0.8828606530036994
Energy: 0.96383142675743
Energy: 0.916865614066708
Energy: 0.9576435702567442
Energy: 0.8841914586281446
Energy: 0.9576435702554504
Energy: 0.9162269954212833
Energy: 0.9568866063016737
Energy: 0.9168241533694023
Energy: 0.9568866062990861
Energy: 0.914097765959395
Energy: 0.9568844481319272
Energy: 0.8849785822261883
Energy: 0.9568844481306333
Energy: 0.9219383640843004
Energy: 0.9566104332828835
Energy: 0.8844217443266019
Energy: 0.9566104332835303
Energy: 0.9157086778143685
Energy: 0.933427185957502
Energy: 0.9145153408130938
Energy: 0.933427185957502
Energy: 0.8719970276312631
Energy: 0.9373548678112199
Energy: 0.9076439559262645
Energy: 0.9373548678151015
Energy: 0.9148936362392922
Energy: 0.8713979877367346
Energy: 0.8720221604116024
Energy: 0.8713979877341469
Energy: 0.8405342467282901
Energy: 0.8715625709864829
Energy: 0.8720736631901674
Energy: 0.8715625709877768
Energy: 0.8874924204071708
Energy: 0.887066527538934
Energy: 0.8405900519603776
Energy: 0.8870665275363464
Energy: 0.8697913141595343
Energy: 0.8714943879937387
Energy: 0.8991321509755509
Energy: 0.8714943879892104
Energy: 0.8834944758200103
Energy: 0.8868087230410904
Energy: 0.8881686094936038
Energy: 0.886808723043678
Energy: 0.8719659061546366
Energy: 0.8715155173602508
Energy: 0.8703779320349664
Energy: 0.8715155173615445
Energy: 0.8721707601448576
Energy: 0.8738685894203562
Energy: 0.9175816578654331
Energy: 0.8738685894197092
Energy: 0.8715778935002001
Energy: 0.8718363492276817
Energy: 0.8719319987640675
Energy: 0.8718363492309164
Energy: 0.9179622605330623
Energy: 0.9360831662652577
Energy: 0.9107229703242404
Energy: 0.9360831662684922
Energy: 0.882528850141718
Energy: 0.9357761017558925
Energy: 0.9108651648470206
Energy: 0.9357761017533051
Energy: 0.8834707697324962
Energy: 0.9584607943302884
Energy: 0.9178987851390168
Energy: 0.9584607943270539
Energy: 0.9176666366998559
Energy: 0.9561955217617331
Energy: 0.9177003761790694
Energy: 0.9561955217610862
Energy: 0.8869128126437634
Energy: 0.9565980323656516
Energy: 0.9141541636219175
Energy: 0.9565980323604761
Energy: 0.8825430575649282
Energy: 0.9577469356574945
Energy: 0.9191391963642085
Energy: 0.9577469356574945
Energy: 0.9145222434987014
Energy: 0.9334159645398848
Energy: 0.9163534276386698
Energy: 0.9334159645379442
Energy: 0.9148968554589699
Energy: 0.9374059326423372
Energy: 0.8726245469286394
Energy: 0.937405932643631
Energy: 0.8717009141209803
Energy: 0.8714921568128927
Energy: 0.9145589112330673
Energy: 0.8714921568180681
Energy: 0.8720189934473753
Energy: 0.871268440819805
Energy: 0.8404401883135806
Energy: 0.8712684408210989
Energy: 0.8397319864290044
Energy: 0.871925675393691
Energy: 0.8879001354648259
Energy: 0.871925675394338

minimum gb energy = 0.8397319864290044 eV
minimum distance =  2.34851723648763 Angstroms
sigma value = 1


========================================
theta = 16.260204708311957
========================================

Energy: 1.5932133271788065
Energy: 0.936693114097332
Energy: 0.93669607435937
Energy: 0.8881627217032056
Energy: 0.9211128334878131
Energy: 0.9700540462873755
Energy: 0.9207315716523385
Energy: 0.9700540462940137
Energy: 0.9365105019086549
Energy: 0.9366344753408405
Energy: 0.9298063002492206
Energy: 0.9366344753423157
Energy: 0.9262234151144177
Energy: 0.9219704238567473
Energy: 0.9205815014283332
Energy: 0.9219704238648607
Energy: 0.9310327191667938
Energy: 0.9222464856685203
Energy: 0.9206337914464087
Energy: 0.9222464856663075
Energy: 0.9223197234699934
Energy: 1.03361020125162
Energy: 0.9211296945744383
Energy: 1.0336102012442439
Energy: 0.9202636915862811
Energy: 0.9965685715950973
Energy: 0.9366458675919077
Energy: 0.9965685715862462
Energy: 0.967775493808422
Energy: 1.0187142332961368
Energy: 0.932267924422317
Energy: 1.018714233295399
Energy: 0.9302159534088795
Energy: 1.0140939243766136
Energy: 0.8826933218788214
Energy: 1.014093924377351
Energy: 0.931520553803019
Energy: 1.0149322530686735
Energy: 0.9723730865716845
Energy: 1.0149322530657232
Energy: 0.9676631176015584
Energy: 0.9953249909297922
Energy: 0.9207112827672255
Energy: 0.9953249909261044
Energy: 0.9621541499668339
Energy: 1.0002301960620996
Energy: 0.9225319223120311
Energy: 1.0002301960606244
Energy: 0.9208796455438039
Energy: 0.9220829772535272
Energy: 0.9700757905333777
Energy: 0.9220829772579529
Energy: 0.9204393729539835
Energy: 0.9224913569226455
Energy: 0.8833642886054827
Energy: 0.9224913569278086
Energy: 0.8876016224209968
Energy: 0.9374521078923653
Energy: 0.9359136975266839
Energy: 0.9374521078835142
Energy: 0.9551470344950691
Energy: 0.9224629727868453
Energy: 0.9205281866533769
Energy: 0.9224629727979092
Energy: 0.9392821109650884
Energy: 0.9369316415747648
Energy: 0.929014479893126
Energy: 0.9369316415659138
Energy: 0.9202216141477962
Energy: 0.922298872457911
Energy: 0.9208966874526576
Energy: 0.9222988724534853
Energy: 0.9287643213522679
Energy: 0.9254625662941828
Energy: 0.9226059017019763
Energy: 0.9254625662963955
Energy: 0.9199011563281448
Energy: 0.9218662296554347
Energy: 0.9220737078456787
Energy: 0.921866229660598
Energy: 0.9201722375303716
Energy: 0.9997118971736295
Energy: 0.9360402701157654
Energy: 0.9997118971677287
Energy: 0.9646766026928035
Energy: 0.9997398371501979
Energy: 0.9330422640832247
Energy: 0.9997398371457724
Energy: 0.930621359348309
Energy: 1.0146756706291689
Energy: 0.8871735812583457
Energy: 1.014675670628431
Energy: 0.9308171369122922
Energy: 1.0143485699476873
Energy: 0.932929028112351
Energy: 1.0143485699425911
Energy: 0.9673214159619123
Energy: 0.9951521735400938
Energy: 0.9222153206976521
Energy: 0.9951521735320474
Energy: 0.9691309027567867
Energy: 0.9988470606897667
Energy: 0.9231216850708082
Energy: 0.9988470606934546
Energy: 0.9220258876438644
Energy: 0.9218787480666503
Energy: 0.9699220625289277
Energy: 0.9218787480563241
Energy: 0.9207931697861582
Energy: 0.9221625610131584
Energy: 0.8838805262820268
Energy: 0.9221625610161087
Energy: 0.8843559142259246
Energy: 0.9205431480011511
Energy: 0.9366875354559765
Energy: 0.9205431480107398

minimum gb energy = 0.8826933218788214 eV
minimum distance =  2.35533899986614 Angstroms
sigma value = 25


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

Energy: 1.515999804261822
Energy: 0.994237104102814
Energy: 0.9954907513158522
Energy: 0.9384291995398393
Energy: 0.9496510698411881
Energy: 1.0272738770209686
Energy: 0.9497106631426602
Energy: 1.0272738770201113
Energy: 0.9950654742218843
Energy: 0.9940889956194864
Energy: 0.9804050342703096
Energy: 0.9940889956212013
Energy: 0.9381268728575632
Energy: 0.9831702775720667
Energy: 0.9499724410931633
Energy: 0.9831702775712092
Energy: 0.9486953645007427
Energy: 0.9835652102513669
Energy: 0.9808901298405114
Energy: 0.9835652102530817
Energy: 0.9807800195078501
Energy: 1.092473121348185
Energy: 0.9815992272287043
Energy: 1.0924731213464702
Energy: 0.9801150537891559
Energy: 1.0823716511074666
Energy: 0.9819816102407354
Energy: 1.0823716511074666
Energy: 0.9803893088070957
Energy: 1.068421305769569
Energy: 0.9475099745105541
Energy: 1.0684213057704264
Energy: 0.9795026965599207
Energy: 1.0806979570707014
Energy: 0.9318193625862234
Energy: 1.0806979570732738
Energy: 0.9792715962159249
Energy: 1.078364669838572
Energy: 0.9817269535619978
Energy: 1.0783646698351423
Energy: 0.9319617260216205
Energy: 0.9839797893330323
Energy: 0.9812837075667543
Energy: 0.9839797893373196
Energy: 0.9322823072324079
Energy: 0.9833800996815786
Energy: 0.9500531006470455
Energy: 0.9833800996798636
Energy: 0.9939518526042739
Energy: 0.9939382703936597
Energy: 0.9322288610645093
Energy: 0.9939382703919449
Energy: 0.9818717905253083
Energy: 0.9830558888401224
Energy: 1.0338870174761439
Energy: 0.983055888839265
Energy: 0.9510329642116456
Energy: 0.9940884848160466
Energy: 0.9986904635975642
Energy: 0.9940884848194763
Energy: 0.979640857397724
Energy: 0.9833124138512477
Energy: 0.9393340775832337
Energy: 0.983312413852105
Energy: 0.983352530340807
Energy: 0.9812921752256855
Energy: 0.9488592923624414
Energy: 0.9812921752265428
Energy: 0.9818122075607598
Energy: 0.9804861519154567
Energy: 0.9364047099829603
Energy: 0.9804861519137419
Energy: 0.9808331494303696
Energy: 1.0877059832928475
Energy: 0.9790159964942622
Energy: 1.0877059832902753
Energy: 0.9482240433086482
Energy: 1.0876688158249261
Energy: 0.9793777491512633
Energy: 1.0876688158257837
Energy: 0.9329874675089018
Energy: 1.0789008119288586
Energy: 0.9805559076097543
Energy: 1.0789008119262862
Energy: 0.9364231212216932
Energy: 1.0800887319599106
Energy: 0.9831137960759383
Energy: 1.0800887319564807
Energy: 0.9817634205689708
Energy: 0.9841726370721466
Energy: 0.9328484407818814
Energy: 0.9841726370687169
Energy: 0.9812363117128282
Energy: 0.9831753914012438
Energy: 0.9328241350701925
Energy: 0.9831753914003862
Energy: 0.9330503176279934
Energy: 0.9790645702578518
Energy: 0.993935806314757
Energy: 0.9790645702587092

minimum gb energy = 0.9318193625862234 eV
minimum distance =  2.36411493577472 Angstroms
sigma value = 9


========================================
theta = 22.61986494804043
========================================

Energy: 1.404011305257965
Energy: 1.0603159590100675
Energy: 1.0618626383109044
Energy: 0.9946789508873293
Energy: 1.0525480976390287
Energy: 1.087365334928004
Energy: 1.05214932937868
Energy: 1.087365334934141
Energy: 1.0610369005918163
Energy: 1.0593764939639254
Energy: 1.0599106332265185
Energy: 1.0593764939649482
Energy: 1.0455819288431158
Energy: 1.0583309483620238
Energy: 1.0519302731099693
Energy: 1.0583309483589551
Energy: 1.0488390698751984
Energy: 1.059945673981306
Energy: 1.0513857677991445
Energy: 1.0599456739864201
Energy: 1.0469531762325088
Energy: 1.1600961348364676
Energy: 1.0536249215632258
Energy: 1.1600961348364676
Energy: 1.100255318090732
Energy: 1.156904133725551
Energy: 1.0524841916401553
Energy: 1.1569041337286194
Energy: 1.0531253371691343
Energy: 1.1600864896417906
Energy: 1.0539257599124456
Energy: 1.1600864896417906
Energy: 1.0541952179975749
Energy: 1.0613321602678882
Energy: 0.9853938250389609
Energy: 1.061332160268911
Energy: 1.051836666672948
Energy: 1.058901684242953
Energy: 0.9850268892417186
Energy: 1.058901684236816
Energy: 0.9863086958841206
Energy: 1.059523315714357
Energy: 1.0590483312676637
Energy: 1.059523315720494
Energy: 1.1017355664405537
Energy: 1.0562862052198654
Energy: 1.0521158198695273
Energy: 1.056286205216797
Energy: 1.0625697827321896
Energy: 1.059120880140383
Energy: 1.0586638553041423
Energy: 1.0591208801383374
Energy: 1.044855495292126
Energy: 1.0739836164718821
Energy: 1.0438931159118123
Energy: 1.073983616466768
Energy: 1.0490346632732586
Energy: 1.0453169938706834
Energy: 1.0527828725209172
Energy: 1.0453169938717064
Energy: 1.0461018232003576
Energy: 1.0586398679745792
Energy: 1.052046193481087
Energy: 1.0586398679735562
Energy: 1.103544309891638
Energy: 1.1599827681889532
Energy: 1.052389786350938
Energy: 1.1599827681858845
Energy: 1.101498925578563
Energy: 1.159111319248216
Energy: 1.0520084741554372
Energy: 1.1591113192461706
Energy: 1.055512182765722
Energy: 1.0586841484094303
Energy: 0.9847360249924216
Energy: 1.058684148404316
Energy: 1.051718767448278
Energy: 1.058869703113108
Energy: 0.9845688093680792
Energy: 1.0588697031151535
Energy: 0.9856287139898815
Energy: 1.044040719222049
Energy: 1.0583910618814394
Energy: 1.0440407192312549

minimum gb energy = 0.9845688093680792 eV
minimum distance =  2.40317615120897 Angstroms
sigma value = 25


========================================
theta = 28.07248693585296
========================================

Energy: 1.2496248939922578
Energy: 1.1414254560004407
Energy: 1.1436000635036232
Energy: 1.0600684926726562
Energy: 1.1474637081325125
Energy: 1.1250441864571057
Energy: 1.0766800836094026
Energy: 1.1250441864596354
Energy: 1.1423689606397767
Energy: 1.140868334760248
Energy: 1.1615623008245612
Energy: 1.1408683347589834
Energy: 1.1405262307293162
Energy: 1.1263544582732425
Energy: 1.0768928035266003
Energy: 1.1263544582770377
Energy: 1.0732940523275323
Energy: 1.1619301949774403
Energy: 1.0799709433527331
Energy: 1.1619301949761753
Energy: 1.0526521203231853
Energy: 1.1677245485230308
Energy: 1.0752586502543338
Energy: 1.1677245485230308
Energy: 1.0482357297958935
Energy: 1.1608082295292317
Energy: 1.076930026111821
Energy: 1.160808229527967
Energy: 1.047881905431126
Energy: 1.1602939021281429
Energy: 1.0811270420419592
Energy: 1.1602939021294079
Energy: 1.1394552909435909
Energy: 1.1386860130349608
Energy: 1.2210744324197256
Energy: 1.1386860130374907
Energy: 1.144591231417817
Energy: 1.0570704118916805
Energy: 1.1380539654955932
Energy: 1.0570704118904155
Energy: 1.1565536121232551
Energy: 1.140317471472491
Energy: 1.1468188297567194
Energy: 1.140317471472491
Energy: 1.13982901634523
Energy: 1.160432115426311
Energy: 1.1415565677077224
Energy: 1.1604321154250459
Energy: 1.0763013816880687
Energy: 1.1677589240358839
Energy: 1.073252165843775
Energy: 1.167758924032089
Energy: 1.0779581076650224
Energy: 1.1622340359820478
Energy: 1.054796206725109
Energy: 1.1622340359807828
Energy: 1.0777008979441165
Energy: 1.1595442656882595
Energy: 1.0479309120544857
Energy: 1.1595442656857295
Energy: 1.0773590500465917
Energy: 1.160113937570106
Energy: 1.0479410293419786
Energy: 1.160113937571371
Energy: 1.2200593169422482
Energy: 1.0540140267080556
Energy: 1.137548398643812
Energy: 1.0540140267080556

minimum gb energy = 1.047881905431126 eV
minimum distance =  2.43361077593835 Angstroms
sigma value = 17


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

Energy: 1.6831988053255038
Energy: 1.2365162831826582
Energy: 1.2377342962390097
Energy: 1.1813225691217608
Energy: 1.1031717458843706
Energy: 1.1428333347457256
Energy: 1.1921740054144807
Energy: 1.142833334748591
Energy: 1.1355806200993597
Energy: 1.1280344327984553
Energy: 1.244012162938875
Energy: 1.128034432801321
Energy: 1.1272932546239298
Energy: 1.1938180840381554
Energy: 1.1257353763398084
Energy: 1.1938180840374393
Energy: 1.12833448483971
Energy: 1.2436579545211461
Energy: 1.083619980035974
Energy: 1.2436579545247284
Energy: 1.1290333113362305
Energy: 1.2457800545203181
Energy: 1.1279929666905908
Energy: 1.2457800545196014
Energy: 1.1665424493996792
Energy: 1.1279690930455726
Energy: 1.1273719436130207
Energy: 1.1279690930455726
Energy: 1.2914639668251362
Energy: 1.1276974119575538
Energy: 1.1079678208149728
Energy: 1.1276974119589867
Energy: 1.244111869500426
Energy: 1.2310633016855772
Energy: 1.2439358777482705
Energy: 1.2310633016877264
Energy: 1.2307634054073886
Energy: 1.1862202808526254
Energy: 1.193360890650797
Energy: 1.186220280855491
Energy: 1.1270134137165069
Energy: 1.0859741315015299
Energy: 1.1021689948198705
Energy: 1.0859741314993805
Energy: 1.172181472977639
Energy: 1.142466801054951
Energy: 1.1080778342772124
Energy: 1.142466801052802
Energy: 1.1674350258892796
Energy: 1.1433121275728588
Energy: 1.1369997610522893
Energy: 1.1433121275771572
Energy: 1.1693690964448713
Energy: 1.1424358783917998
Energy: 1.1031389841886583
Energy: 1.1424358783953819
Energy: 1.2298816229470688
Energy: 1.1690006500448
Energy: 1.294165496114443
Energy: 1.1690006500433672
Energy: 1.2438962416766302
Energy: 1.2303752702513413
Energy: 1.2939644074943528
Energy: 1.230375270250625
Energy: 1.2386806121857192
Energy: 1.127565855232169
Energy: 1.1271281362906718
Energy: 1.1275658552314527
Energy: 1.2382420588828356
Energy: 1.1273457739932153
Energy: 1.1247624032519112
Energy: 1.1273457739932153
Energy: 1.1338752517174635
Energy: 1.243688916053276
Energy: 1.12772023760183
Energy: 1.2436889160504105
Energy: 1.194169857842867
Energy: 1.2463929698003688
Energy: 1.1277841122459935
Energy: 1.2463929698018015
Energy: 1.1301492452028077
Energy: 1.1282298090637148
Energy: 1.2315762806383712
Energy: 1.1282298090608496
Energy: 1.1269931222689487
Energy: 1.1409602930094553
Energy: 1.1663713333767087
Energy: 1.14096029300659
Energy: 1.1927839084958802
Energy: 1.1919716681535597
Energy: 1.1906654585449612
Energy: 1.1919716681514103
Energy: 1.241236761249423
Energy: 1.2306523055000667
Energy: 1.2344285092795821
Energy: 1.23065230549935
Energy: 1.1091196923881514
Energy: 1.1418245961987195
Energy: 1.2344510778883735
Energy: 1.1418245962008688
Energy: 1.108077259711199
Energy: 1.1420123238057323
Energy: 1.1269443131378967
Energy: 1.1420123238064488
Energy: 1.1016791010851579
Energy: 1.1041347715492567
Energy: 1.1686975245447202
Energy: 1.1041347715478238
Energy: 1.1079987453084321
Energy: 1.142432415378933
Energy: 1.1685136455659673
Energy: 1.1424324153760674
Energy: 1.1039762590237392
Energy: 1.142183128482325
Energy: 1.1676342095974583
Energy: 1.1421831284816086
Energy: 1.2925947728416798
Energy: 1.2330557731880782
Energy: 1.235082996408386
Energy: 1.2330557731866452

minimum gb energy = 1.083619980035974 eV
minimum distance =  2.44362262411367 Angstroms
sigma value = 53


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

Energy: 1.5243008613181652
Energy: 1.1881248279699324
Energy: 1.1912591375890387
Energy: 1.0619782228229493
Energy: 1.1763544311812464
Energy: 1.1143064825026874
Energy: 1.1779424910383605
Energy: 1.1143064825026874
Energy: 1.1878171419141381
Energy: 1.1799557498610933
Energy: 1.1780767569043624
Energy: 1.179955749859444
Energy: 1.1773788117579078
Energy: 1.115726727175118
Energy: 1.1745221284735796
Energy: 1.1157267271816775
Energy: 1.1872344563673671
Energy: 1.1161134385937692
Energy: 1.0546159918972304
Energy: 1.116113438587172
Energy: 1.1740217485930202
Energy: 1.1187333635642114
Energy: 1.067234974199952
Energy: 1.1187333635691596
Energy: 1.2995153540672832
Energy: 1.1754291849667657
Energy: 1.177423186260291
Energy: 1.175429184961818
Energy: 1.3004606949236284
Energy: 1.116967776194802
Energy: 1.1734245514480073
Energy: 1.116967776194802
Energy: 1.1809662596214652
Energy: 1.1770914820489422
Energy: 1.1841400874191654
Energy: 1.1770914820456435
Energy: 1.1741499543792415
Energy: 1.1168397679921604
Energy: 1.1814955291852975
Energy: 1.1168397679872126
Energy: 1.1790943551993165
Energy: 1.1227989794043347
Energy: 1.0708455966456507
Energy: 1.1227989794109317
Energy: 1.1782207711805082
Energy: 1.1156706212045835
Energy: 1.0509157716622866
Energy: 1.1156706212045835
Energy: 1.3011627840702187
Energy: 1.1188717746272603
Energy: 1.172651247133421
Energy: 1.1188717746272603

minimum gb energy = 1.0509157716622866 eV
minimum distance =  2.41835990914885 Angstroms
sigma value = 9


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

Energy: 1.4774736739806478
Energy: 1.295687379715266
Energy: 1.2976685984448755
Energy: 1.214887757614953
Energy: 1.1236456803391173
Energy: 1.1219656757736172
Energy: 1.283189960603983
Energy: 1.1219656757754481
Energy: 1.1282425112573955
Energy: 1.1271808345932877
Energy: 1.2694420195032192
Energy: 1.1271808345902354
Energy: 1.125373538435811
Energy: 1.1256350692028796
Energy: 1.335514208229745
Energy: 1.1256350692034898
Energy: 1.1232607123322322
Energy: 1.1222660485278997
Energy: 1.3340716305205
Energy: 1.1222660485242373
Energy: 1.122100554602456
Energy: 1.122017127332461
Energy: 1.3338902631681042
Energy: 1.122017127332461
Energy: 1.283709940042694
Energy: 1.268728525155724
Energy: 1.2833350099937035
Energy: 1.2687285251477884
Energy: 1.2835287008439789
Energy: 1.2681585110029754
Energy: 1.2682586368017672
Energy: 1.2681585110011437
Energy: 1.15949945484266
Energy: 1.2443201111827258
Energy: 1.1760578911001973
Energy: 1.2443201111802842
Energy: 1.125478554352512
Energy: 1.2252129727557017
Energy: 1.2717515316751011
Energy: 1.2252129727550911
Energy: 1.1568790501258113
Energy: 1.1580822243097668
Energy: 1.2002285369909609
Energy: 1.1580822243103774
Energy: 1.1732708837249988
Energy: 1.1598629600273154
Energy: 1.337355213851693
Energy: 1.1598629600279258
Energy: 1.2838595974779297
Energy: 1.1574776849127906
Energy: 1.1802908683154536
Energy: 1.157477684917674
Energy: 1.2845250166805922
Energy: 1.1581279274916034
Energy: 1.1596096137009257
Energy: 1.1581279274934346
Energy: 1.2678347494685647
Energy: 1.175524698373902
Energy: 1.17412262645892
Energy: 1.1755246983745127
Energy: 1.1989026308710098
Energy: 1.2503293075674198
Energy: 1.1754475374042173
Energy: 1.250329307570472
Energy: 1.2720292742754946
Energy: 1.2523599209338998
Energy: 1.159929569903847
Energy: 1.25235992093451
Energy: 1.269684285422405
Energy: 1.2697278945310386
Energy: 1.3376044738052268
Energy: 1.2697278945285968
Energy: 1.2875338665097504
Energy: 1.1212649681901943
Energy: 1.1678658380171114
Energy: 1.1212649681920257
Energy: 1.3842267699354456
Energy: 1.1249634929781658
Energy: 1.1272847114224553
Energy: 1.1249634929738928
Energy: 1.2886717555990348
Energy: 1.1239657657183668
Energy: 1.1227771484685671
Energy: 1.1239657657201982
Energy: 1.334089277679933
Energy: 1.1216478972334853
Energy: 1.121725217248941
Energy: 1.1216478972334853
Energy: 1.3341326826204851
Energy: 1.1230007203869752
Energy: 1.1219375491684782
Energy: 1.1230007203845336
Energy: 1.2847242797644958
Energy: 1.269146736962593
Energy: 1.283522825410356
Energy: 1.269146736963814
Energy: 1.26897842496406
Energy: 1.2684595439448167
Energy: 1.2834865349496827
Energy: 1.2684595439399335
Energy: 1.174078504523409
Energy: 1.2537103072780975
Energy: 1.158516865011518
Energy: 1.2537103072774871
Energy: 1.2744762477456788
Energy: 1.2257436824468353
Energy: 1.1250368344927442
Energy: 1.2257436824480563
Energy: 1.2009845790460532
Energy: 1.1575249282521294
Energy: 1.1579552870116647
Energy: 1.1575249282496876
Energy: 1.336891780633291
Energy: 1.2326398849989417
Energy: 1.1723997246118998
Energy: 1.2326398850001627
Energy: 1.181345090030312
Energy: 1.157931121712235
Energy: 1.284730922345609
Energy: 1.157931121707962
Energy: 1.1621304268391122
Energy: 1.1587109317976996
Energy: 1.269664863206898
Energy: 1.1587109317989202
Energy: 1.1685840659250515
Energy: 1.1647351405502855
Energy: 1.2680928402823262
Energy: 1.164735140551506
Energy: 1.1765025851430126
Energy: 1.2493231720935782
Energy: 1.1990338925153647
Energy: 1.2493231720941889
Energy: 1.1589948682503393
Energy: 1.2510168618056945
Energy: 1.2066202403960173
Energy: 1.2510168618063051
Energy: 1.3380878395456317
Energy: 1.2695715003063364
Energy: 1.2765640857097058
Energy: 1.269571500303284

minimum gb energy = 1.1212649681901943 eV
minimum distance =  2.45954193765982 Angstroms
sigma value = 73


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

Energy: 1.5725911348127182
Energy: 1.259779592257457
Energy: 1.2610726577348086
Energy: 1.1698414267318316
Energy: 1.1331596250050617
Energy: 1.1265861921318685
Energy: 1.2277134517818424
Energy: 1.1265861921347737
Energy: 1.1343679963191529
Energy: 1.130962407131718
Energy: 1.2519098956725219
Energy: 1.1309624071288125
Energy: 1.1304379617989868
Energy: 1.1304181095490071
Energy: 1.3159415961190077
Energy: 1.1304181095461017
Energy: 1.1313748570853437
Energy: 1.1309776152743594
Energy: 1.3292530051114613
Energy: 1.1309776152724222
Energy: 1.1857086461319566
Energy: 1.1306154359731093
Energy: 1.3287112325587604
Energy: 1.130615435972141
Energy: 1.242421775009741
Energy: 1.2507853298374048
Energy: 1.2708700097804013
Energy: 1.2507853298364362
Energy: 1.24127633318902
Energy: 1.2489991390372848
Energy: 1.248185704329415
Energy: 1.2489991390334105
Energy: 1.1667820749960887
Energy: 1.341712022413965
Energy: 1.2497653942951512
Energy: 1.3417120224120278
Energy: 1.1909846544727558
Energy: 1.2563281534739912
Energy: 1.2524228119731222
Energy: 1.2563281534749595
Energy: 1.1787802386504038
Energy: 1.1016956409399816
Energy: 1.1251662101881152
Energy: 1.1016956409399816
Energy: 1.173508653914841
Energy: 1.1063595938471584
Energy: 1.3042460623603733
Energy: 1.1063595938452215
Energy: 1.2510944536857638
Energy: 1.1766697834297242
Energy: 1.1593905296041078
Energy: 1.1766697834287556
Energy: 1.2511977473484477
Energy: 1.1623004475118246
Energy: 1.159276713304009
Energy: 1.162300447516667
Energy: 1.2710519047001978
Energy: 1.161269114255842
Energy: 1.1592791536456029
Energy: 1.1612691142529366
Energy: 1.281188451593537
Energy: 1.1606199834902557
Energy: 1.1590884453977788
Energy: 1.160619983489287
Energy: 1.3299943589413308
Energy: 1.1604076085391526
Energy: 1.1583600614822689
Energy: 1.1604076085401211
Energy: 1.2402840549732965
Energy: 1.236772237376557
Energy: 1.2347404029649132
Energy: 1.2367722373813999
Energy: 1.2224233460579104
Energy: 1.2015539084470743
Energy: 1.24082283147452
Energy: 1.2015539084432
Energy: 1.2215711273864247
Energy: 1.201771057664438
Energy: 1.215898890713946
Energy: 1.2017710576586271
Energy: 1.222264883660336
Energy: 1.2083172113484215
Energy: 1.1708815772917416
Energy: 1.2083172113464844
Energy: 1.2835380117258113
Energy: 1.2156297053755554
Energy: 1.2168633755348686
Energy: 1.215629705374587

minimum gb energy = 1.1016956409399816 eV
minimum distance =  2.43487784885278 Angstroms
sigma value = 7


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

Energy: 1.8195222663516502
Energy: 1.2675738459525594
Energy: 1.2677006252734984
Energy: 1.1429418651424734
Energy: 1.1286796150074825
Energy: 1.1925049363738331
Energy: 1.2276389454769374
Energy: 1.1925049363847906
Energy: 1.125690598914836
Energy: 1.1272488389191773
Energy: 1.230807592303282
Energy: 1.127248838903426
Energy: 1.127873218760142
Energy: 1.1301069577862137
Energy: 1.316973970674895
Energy: 1.1301069577868987
Energy: 1.122642669359459
Energy: 1.123044184420189
Energy: 1.2959552886720334
Energy: 1.12304418443731
Energy: 1.1319490178471554
Energy: 1.1225777739403373
Energy: 1.293012457596489
Energy: 1.1225777739478704
Energy: 1.2228075498166582
Energy: 1.12541444291098
Energy: 1.1319834486818279
Energy: 1.1254144429089257
Energy: 1.2239510871749038
Energy: 1.1219267750461506
Energy: 1.1200001342886858
Energy: 1.1219267750495747
Energy: 1.3192535432850268
Energy: 1.1298542537990353
Energy: 1.1290480771345046
Energy: 1.129854253792187
Energy: 1.3378582850436382
Energy: 1.270889240418165
Energy: 1.1224271241223303
Energy: 1.270889240437278
Energy: 1.220391336335296
Energy: 1.2073199709131235
Energy: 1.1397288867283446
Energy: 1.2073199709138085
Energy: 1.2166185967964573
Energy: 1.2112581869972614
Energy: 1.2212276569655318
Energy: 1.2112581869897285
Energy: 1.2129537873268843
Energy: 1.2152095673118501
Energy: 1.2104587006308007
Energy: 1.2152095673419827
Energy: 1.2210037594730818
Energy: 1.194403610453936
Energy: 1.142187960571186
Energy: 1.1944036104580449
Energy: 1.210297062210016
Energy: 1.1937297740056871
Energy: 1.1364754979804137
Energy: 1.1937297740008932
Energy: 1.14294306336105
Energy: 1.2114966889672472
Energy: 1.2163823326995937
Energy: 1.2114966889651924
Energy: 1.142617256903447
Energy: 1.2072443604331888
Energy: 1.2208619198528494
Energy: 1.2072443604311343
Energy: 1.1227028037855524
Energy: 1.2690960209275735
Energy: 1.2380545143005466
Energy: 1.269096020936414
Energy: 1.1275377350243598
Energy: 1.1301556068609018
Energy: 1.2206360193434131
Energy: 1.130155606851314
Energy: 1.1213875208142656
Energy: 1.1218782754922658
Energy: 1.146308889811432
Energy: 1.1218782754991143
Energy: 1.1317123686957367
Energy: 1.1253751497598996
Energy: 1.2992302925461057
Energy: 1.1253751497516815
Energy: 1.2231823966642956
Energy: 1.1226471360315333
Energy: 1.131855612046419
Energy: 1.122647136032218
Energy: 1.2229110475364502
Energy: 1.1230418430229288
Energy: 1.122747454212373
Energy: 1.1230418430242983
Energy: 1.3168939166663107
Energy: 1.130202375150345
Energy: 1.1297853312650619
Energy: 1.1302023751489754
Energy: 1.2846175597686773
Energy: 1.1273295410954398
Energy: 1.1257622423546176
Energy: 1.1273295411016033
Energy: 1.2870008270184934
Energy: 1.2148767321848066
Energy: 1.128241225902652
Energy: 1.2148767321937095
Energy: 1.2677536912628378
Energy: 1.2222638649654496
Energy: 1.580028523734962
Energy: 1.2222638649770297
Energy: 1.207619895813433
Energy: 1.2163584371896792
Energy: 1.2167167100117753
Energy: 1.2163584371869396
Energy: 1.2259489707029712
Energy: 1.193436927986725
Energy: 1.2136048649898
Energy: 1.1934369279880948
Energy: 1.207141372789351
Energy: 1.2127315224451207
Energy: 1.1414877498056393
Energy: 1.212731522453339
Energy: 1.1429590812360877
Energy: 1.2081957214787455
Energy: 1.2094760728594323
Energy: 1.2081957214773758

minimum gb energy = 1.1200001342886858 eV
minimum distance =  2.44796237984641 Angstroms
sigma value = 29


========================================
theta = 53.13010235415599
========================================

Energy: 1.0507822587330045
Energy: 1.2404937263339957
Energy: 1.1720833143984277
Energy: 1.052056321013501
Energy: 1.0634526285476555
Energy: 1.1329818520049
Energy: 1.063570479133994
Energy: 1.1329818520049
Energy: 1.061615228235038
Energy: 1.125567318609922
Energy: 1.0544112560147842
Energy: 1.1255673186075896
Energy: 1.0564731946589867
Energy: 1.0628401048508016
Energy: 1.0635324380650955
Energy: 1.0628401048508016
Energy: 1.0600144360391397
Energy: 1.064916949930947
Energy: 1.0540155537478022
Energy: 1.0649169499286146
Energy: 1.0626384984078145
Energy: 1.1303236431042245
Energy: 1.0549318292045888
Energy: 1.1303236431042245
Energy: 1.053307860808484
Energy: 1.1251940247568493
Energy: 1.0624257672468758
Energy: 1.1251940247591816
Energy: 1.064175055289117
Energy: 1.0644566572167784
Energy: 1.0593518442433707
Energy: 1.0644566572167784
Energy: 1.0617953938592437
Energy: 1.0638059182482131
Energy: 1.0599543507894984
Energy: 1.0638059182482131

minimum gb energy = 1.0507822587330045 eV
minimum distance =  2.40570416266821 Angstroms
sigma value = 5


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

Energy: 1.5434618765218715
Energy: 1.036067682641607
Energy: 1.193497394088249
Energy: 1.018236761399858
Energy: 1.1908776962915795
Energy: 1.0362677831431182
Energy: 1.1994800027372154
Energy: 1.0362677831463527
Energy: 1.198749874277986
Energy: 1.1093793385769195
Energy: 1.2008429557240117
Energy: 1.109379338582095
Energy: 1.138234594698519
Energy: 1.1841236025161472
Energy: 1.1900952586005626
Energy: 1.1841236025232633
Energy: 1.1234661956707157
Energy: 1.033461480214354
Energy: 1.1342025335523729
Energy: 1.0334614802227637
Energy: 1.03434864157169
Energy: 1.0340487413368213
Energy: 1.1338639005606335
Energy: 1.0340487413368213
Energy: 1.0322808033637338
Energy: 1.0325433278599956
Energy: 1.1907059930870545
Energy: 1.032543327861936
Energy: 1.0429715656752254
Energy: 1.0376772062520414
Energy: 1.2515538921497147
Energy: 1.037677206239162
Energy: 1.180948093233614
Energy: 1.0655410686474007
Energy: 1.258176669490503
Energy: 1.0655410686396376
Energy: 1.3319032833573297
Energy: 1.0197728346964716
Energy: 1.0217402296285136
Energy: 1.0197728346964716
Energy: 1.179294993434984
Energy: 1.0163592801800143
Energy: 1.0168732704851562
Energy: 1.016359280184543
Energy: 1.2600981500425803
Energy: 1.0155914958331427
Energy: 1.0159299929347394
Energy: 1.0155914958266734
Energy: 1.2535634365788912
Energy: 1.0161662577210144
Energy: 1.0300445904158766
Energy: 1.0161662577080763
Energy: 1.0840821368852902
Energy: 1.15630459338366
Energy: 1.271550654815594
Energy: 1.156304593391423
Energy: 1.0988754392450832
Energy: 1.0102219089223354
Energy: 1.2685781022230578
Energy: 1.0102219089035749
Energy: 1.0902709832505704
Energy: 1.004612917021549
Energy: 1.0534439817905978
Energy: 1.00461291701508
Energy: 1.0986900724509738
Energy: 1.0051759157616424
Energy: 1.051492278685394
Energy: 1.0051759157590547
Energy: 1.2429734499135137
Energy: 1.007793940037899
Energy: 1.0540403348567855
Energy: 1.0077939400353115
Energy: 1.2384252876329849
Energy: 1.083080984964508
Energy: 1.0695102246201469
Energy: 1.0830809849735648
Energy: 1.2391232332010331
Energy: 1.0408772505165778
Energy: 1.1424718685997513
Energy: 1.040877250507521
Energy: 1.1330238929852419
Energy: 1.0409515158210976
Energy: 1.055054080957468
Energy: 1.0409515158204505
Energy: 1.1344976524131456
Energy: 1.039298933250006
Energy: 1.0400301340087346
Energy: 1.0392989332668259
Energy: 1.3088506075468351
Energy: 1.038983803149187
Energy: 1.0395772044718397
Energy: 1.0389838031517744
Energy: 1.2517077484579522
Energy: 1.0420827369746648
Energy: 1.0482953157432005
Energy: 1.0420827369617263
Energy: 1.261217689286839
Energy: 1.1431416063656303
Energy: 1.059471328217728
Energy: 1.1431416063630429
Energy: 1.0125313316635256
Energy: 1.080963340836404
Energy: 1.3323707732673233
Energy: 1.0809633408357573
Energy: 1.011933552145811
Energy: 1.0115065960554293
Energy: 1.0611812614207694
Energy: 1.0115065960560763
Energy: 1.0108997932855441
Energy: 1.0100189187112885
Energy: 1.0537380084189185
Energy: 1.0100189187235797
Energy: 1.1028005533024825
Energy: 1.0116581821906585
Energy: 1.2500150997475457
Energy: 1.011658182185483
Energy: 1.2708260325479492
Energy: 1.0603412629867173
Energy: 1.05841329839509
Energy: 1.0603412629724853
Energy: 1.269259213655636
Energy: 1.033233952050154
Energy: 1.0355198270589399
Energy: 1.0332339520469191
Energy: 1.189260088537308
Energy: 1.0328657032321888
Energy: 1.0349402805076002
Energy: 1.0328657032334825
Energy: 1.041985478484174
Energy: 1.0324376050979385
Energy: 1.0332435757976965
Energy: 1.032437605094057

minimum gb energy = 1.00461291701508 eV
minimum distance =  2.40370357551784 Angstroms
sigma value = 1


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

Energy: 1.52004547265438
Energy: 0.9763771453327204
Energy: 1.1466187249159379
Energy: 0.9447506104774165
Energy: 0.9753848286417836
Energy: 0.9762095543369351
Energy: 1.201468897588475
Energy: 0.9762095543297795
Energy: 1.1997243695058861
Energy: 1.071993259607557
Energy: 1.2020640864116658
Energy: 1.071993259607557
Energy: 0.9975822239857701
Energy: 1.072246705485889
Energy: 1.190673239019386
Energy: 1.0722467054814169
Energy: 0.9744135560390305
Energy: 0.9724141165873167
Energy: 1.1961571068834786
Energy: 0.9724141165846334
Energy: 0.9724456092335916
Energy: 0.9723516376778077
Energy: 1.1960343952405734
Energy: 0.9723516376751243
Energy: 0.9705429655946416
Energy: 0.9715722661008412
Energy: 1.191248966763972
Energy: 0.971572266099947
Energy: 0.9825561515107304
Energy: 0.9772916898595414
Energy: 1.377062896873557
Energy: 0.9772916898658028
Energy: 1.1947832211337077
Energy: 1.0149719868257558
Energy: 1.3776371490896417
Energy: 1.0149719868257558
Energy: 1.2008783826955682
Energy: 0.978845149674679
Energy: 0.9758864489963068
Energy: 0.9788451496791513
Energy: 1.1934699746728938
Energy: 0.9717101014422894
Energy: 0.9705992759923198
Energy: 0.9717101014413949
Energy: 1.375279371268023
Energy: 0.9735177679763113
Energy: 0.9727996887264606
Energy: 0.9735177679843614
Energy: 1.3754175561169708
Energy: 0.9724615586899114
Energy: 0.9734245905793524
Energy: 0.9724615586908059
Energy: 1.1905979891234426
Energy: 1.071853976503702
Energy: 1.2000091124508308
Energy: 1.071853976510858
Energy: 1.0018974289169664
Energy: 1.0708451369005638
Energy: 1.1988721855321227
Energy: 1.070845136891619
Energy: 1.0036416324642128
Energy: 0.9749617307634435
Energy: 1.1918469901929212
Energy: 0.9749617307607601
Energy: 0.9732878932099125
Energy: 0.9727183212223941
Energy: 1.1994213036327503
Energy: 0.9727183212206051
Energy: 0.9796098675226611
Energy: 0.9771517362417464
Energy: 1.1931469928336298
Energy: 0.9771517362471133
Energy: 0.9709018229498445
Energy: 0.9715238186350286
Energy: 1.3824664039196315
Energy: 0.9715238186386064
Energy: 0.9744371924750069
Energy: 0.9781442099182027
Energy: 1.377279654860037
Energy: 0.9781442099119415
Energy: 1.1964583198315708
Energy: 1.0151587211320283
Energy: 1.190352399555548
Energy: 1.0151587211320283
Energy: 1.1979768448390844
Energy: 0.9744133984562942
Energy: 0.9776451482981887
Energy: 0.974413398461661
Energy: 1.1913731025874075
Energy: 0.9721257259968866
Energy: 0.9724785230455671
Energy: 0.9721257259986755
Energy: 1.375498281402511
Energy: 0.9725234703179788
Energy: 0.9723128936418809
Energy: 0.9725234703152954

minimum gb energy = 0.9447506104774165 eV
minimum distance =  2.41597401728292 Angstroms
sigma value = 17


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

Energy: 1.6276375110547323
Energy: 0.9678375194507646
Energy: 1.1520337714361462
Energy: 0.943102248449351
Energy: 0.964347475603809
Energy: 0.9658619484884579
Energy: 1.1127019595673338
Energy: 0.9658619484873522
Energy: 1.2251673759421244
Energy: 0.9609786810634994
Energy: 1.1097642875367706
Energy: 0.960978681061891
Energy: 1.2367006307972954
Energy: 1.0088628851966348
Energy: 1.10067095476807
Energy: 1.008862885199952
Energy: 1.0838952914110591
Energy: 0.9449541870306181
Energy: 1.2659103909022593
Energy: 0.9449541870328294
Energy: 0.9459476902228717
Energy: 0.9444083754503132
Energy: 1.2661598242977614
Energy: 0.944408375451419
Energy: 0.9440599384583045
Energy: 0.9447561981718067
Energy: 1.1008900711581942
Energy: 0.9447561981713042
Energy: 0.9482243368473569
Energy: 0.9449251419175724
Energy: 1.089730212551108
Energy: 0.944925141918075
Energy: 1.256623511065805
Energy: 0.9445791779160234
Energy: 1.2241859325821505
Energy: 0.9445791779188379
Energy: 1.1343348068792933
Energy: 1.0128207283637438
Energy: 1.1023023871401856
Energy: 1.0128207283615325
Energy: 1.2530156123069789
Energy: 0.960924822794139
Energy: 0.9754864215595664
Energy: 0.9609248227963504
Energy: 1.262820371779394
Energy: 0.9613984119083895
Energy: 1.1017626727152505
Energy: 0.9613984119099978
Energy: 1.2489961682908126
Energy: 0.96132295491197
Energy: 0.9615476536779684
Energy: 0.96132295491197
Energy: 1.1281483093747051
Energy: 0.962277110534571
Energy: 0.9623205143432298
Energy: 0.9622771105373855
Energy: 1.2329187977844205
Energy: 0.9647077076660996
Energy: 0.9701860891387541
Energy: 0.9647077076632852
Energy: 1.2885860240616431
Energy: 0.9630754911110667
Energy: 0.9653519624538743
Energy: 0.9630754911060407
Energy: 0.9629821071206848
Energy: 0.966244405213048
Energy: 1.1682423368328643
Energy: 0.966244405213048
Energy: 0.9604343558403206
Energy: 0.961805632007397
Energy: 1.257176543483924
Energy: 0.9618056320062912
Energy: 0.9637215145124393
Energy: 0.9667900745297648
Energy: 1.2216101353741733
Energy: 0.966790074530368
Energy: 0.963563800423973
Energy: 0.9620714868705792
Energy: 1.086436555506674
Energy: 0.9620714868667597
Energy: 1.1078525293040073
Energy: 0.9635711890811001
Energy: 1.0860270241176808
Energy: 0.9635711890839146
Energy: 1.1083934931227573
Energy: 0.9664192776179812
Energy: 1.2277734571803613
Energy: 0.9664192776074266
Energy: 1.101481829430375
Energy: 1.0073441685385465
Energy: 1.2322986567260623
Energy: 1.0073441685429692
Energy: 1.157248667839408
Energy: 0.9465345686227853
Energy: 1.0842593657262796
Energy: 0.9465345686177594
Energy: 1.261754269780816
Energy: 0.944440871664222
Energy: 0.9446038870044271
Energy: 0.9444408716658301
Energy: 1.1018009919520317
Energy: 0.9450058443411871
Energy: 0.9466342142036064
Energy: 0.945005844340584
Energy: 1.0949801910282164
Energy: 0.9444097953213412
Energy: 0.9446904060897261
Energy: 0.94440979531531
Energy: 1.103045647952834
Energy: 0.9450853031809339
Energy: 1.2602538387475786
Energy: 0.9450853031804314
Energy: 1.1061755805352427
Energy: 1.0111158143274233
Energy: 1.1091743410831845
Energy: 1.0111158143274233
Energy: 0.9764221808212854
Energy: 0.9611072787231274
Energy: 1.2508957274504893
Energy: 0.9611072787204135
Energy: 1.1000790165027263
Energy: 0.9610179973320124
Energy: 1.2661514946012615
Energy: 0.9610179973320124
Energy: 0.9615687196635481
Energy: 0.9614649321890196
Energy: 1.2671260206655086
Energy: 0.9614649321917336
Energy: 0.9608856951841535
Energy: 0.961496531834729
Energy: 1.129468688084022
Energy: 0.961496531834729
Energy: 0.9743997368120688
Energy: 0.9677836527745718
Energy: 1.2372687503491115
Energy: 0.9677836527778889
Energy: 1.1346611748883915
Energy: 0.9616192790998997
Energy: 1.287632398152614
Energy: 0.9616192790976883
Energy: 1.4602932969721762
Energy: 0.9638959757195816
Energy: 0.9629383035561115
Energy: 0.9638959757168676
Energy: 1.253898155835948
Energy: 0.9615010026904486
Energy: 0.9598688333907902
Energy: 0.9615010026887398
Energy: 1.224927384281297
Energy: 0.9617479817322023
Energy: 0.9634089782757144
Energy: 0.9617479817288852

minimum gb energy = 0.943102248449351 eV
minimum distance =  2.42020332576836 Angstroms
sigma value = 89


========================================
theta = 67.38013505195958
========================================

Energy: 1.7250700759599917
Energy: 0.8699826449237446
Energy: 1.0723119039014009
Energy: 0.8639711245595739
Energy: 0.8714557785616401
Energy: 0.9467940239254174
Energy: 0.8767275317889013
Energy: 0.9467940239254174
Energy: 0.866995888807695
Energy: 0.9478329873424777
Energy: 0.8734604562127082
Energy: 0.9478329873424777
Energy: 0.8640772955548851
Energy: 0.9428577248295922
Energy: 0.8683747369473865
Energy: 0.9428577248295922
Energy: 0.8677001217224433
Energy: 0.8677549793980014
Energy: 0.8788509316643625
Energy: 0.8677549793965877
Energy: 0.8696645692552885
Energy: 0.8661609815940968
Energy: 0.8782855882615512
Energy: 0.8661609815940968
Energy: 0.8671263712920977
Energy: 0.8652200736189725
Energy: 0.8693411132968887
Energy: 0.8652200736189725
Energy: 0.8669139907249256
Energy: 0.867748307778548
Energy: 0.8718489446778188
Energy: 0.8677483077771013
Energy: 0.8721892129797019
Energy: 0.8660569952442578
Energy: 0.8656327031557589
Energy: 0.8660569952457045
Energy: 0.8705518255576253
Energy: 0.9409000537596861
Energy: 0.8712430694446425
Energy: 0.9409000537611327
Energy: 0.8695829759687496
Energy: 0.9407694823789773
Energy: 0.862206634567454
Energy: 0.9407694823789773
Energy: 0.8776764374514092
Energy: 0.8656063080959846
Energy: 0.8706339452708517
Energy: 0.865606308097431
Energy: 0.879464947255683
Energy: 0.8716980440720806
Energy: 0.8678048981771461
Energy: 0.8716980440720806
Energy: 0.8684380112975179
Energy: 0.8648495960348396
Energy: 0.8651581006213588
Energy: 0.864849596033393
Energy: 0.8633996213705154
Energy: 0.8679186820364662
Energy: 0.8715237303075769
Energy: 0.8679186820379127

minimum gb energy = 0.862206634567454 eV
minimum distance =  2.44184720571459 Angstroms
sigma value = 3


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

Energy: 1.5135716428643289
Energy: 0.8225476605231976
Energy: 1.0439944798979337
Energy: 0.8115217929751298
Energy: 0.970218266545436
Energy: 0.8177335114740892
Energy: 0.9716176089605073
Energy: 0.8177335114746955
Energy: 0.8228015683462117
Energy: 0.8155024464118583
Energy: 0.9735923935742166
Energy: 0.815502446415496
Energy: 1.146993497969875
Energy: 0.8151072316077969
Energy: 0.9745201965480117
Energy: 0.8151072316162851
Energy: 0.9784034499883608
Energy: 0.818423801391894
Energy: 0.9724002016108927
Energy: 0.8184238014040199
Energy: 0.9746738541012054
Energy: 0.817778382796126
Energy: 0.9705966308307185
Energy: 0.8177783827876379
Energy: 0.9731194687339854
Energy: 0.8157926246366907
Energy: 0.9718814573895866
Energy: 0.8157926246318402
Energy: 0.9733124022799566
Energy: 0.8165752899647934
Energy: 0.9916866651034414
Energy: 0.8165752899508486
Energy: 0.8150402756609436
Energy: 0.8145721634958731
Energy: 0.9808238084942027
Energy: 0.8145721635013299
Energy: 0.8153653596329065
Energy: 0.8149026431839383
Energy: 0.9770033376742134
Energy: 0.814902643191214
Energy: 0.8191743682828162
Energy: 0.8165642935427255
Energy: 1.5140378162889017
Energy: 0.8165642935299934
Energy: 0.9702508733505693
Energy: 0.8595351708109851
Energy: 0.9779232688209688
Energy: 0.8595351708037094
Energy: 0.9731339071727421
Energy: 0.8567730969355838
Energy: 0.9699296918002229
Energy: 0.8567730969325523
Energy: 0.9745884548611933
Energy: 0.8574828107812628
Energy: 1.1452440461323732
Energy: 0.8574828107697431
Energy: 0.9892202485195223
Energy: 0.8189122673482664
Energy: 0.9754004714643794
Energy: 0.8189122673434159
Energy: 0.9848822848713704
Energy: 0.817939145083231
Energy: 0.822778428071353
Energy: 0.817939145091719
Energy: 0.971322210013391
Energy: 0.8162375399909332
Energy: 0.8171440856983492
Energy: 0.8162375399836576
Energy: 0.8283195641439902
Energy: 0.8168713828604164
Energy: 0.818697130583047
Energy: 0.8168713828507156
Energy: 1.1307498388770283
Energy: 0.8146231939921641
Energy: 0.9688500232757166
Energy: 0.8146231939970144
Energy: 0.9761486909304063
Energy: 0.814823900354556
Energy: 0.9846529849909162
Energy: 0.8148239003575873
Energy: 1.1510984907858859
Energy: 0.8163591096130991
Energy: 0.9710890585313324
Energy: 0.8163591096209258
Energy: 0.975986481188199
Energy: 0.816171759547339
Energy: 0.9700577532783293
Energy: 0.8161717595485516
Energy: 0.9693461877815195
Energy: 0.8202711069245501
Energy: 0.9734773916598443
Energy: 0.8202711069142431
Energy: 0.8215686228376016
Energy: 0.8146083979879264
Energy: 0.9750889152449529
Energy: 0.8146083979812572
Energy: 0.9700186025660178
Energy: 0.8149746914258673
Energy: 0.9884297181485789
Energy: 0.8149746914179855
Energy: 0.8162257205337741
Energy: 0.8158084394930339
Energy: 0.9846666993275399
Energy: 0.8158084394766639
Energy: 0.8159728267756466
Energy: 0.8151826872712141
Energy: 0.974182930753017
Energy: 0.815182687273033
Energy: 0.8157311788750646
Energy: 0.8144621226970513
Energy: 0.8277545556542186
Energy: 0.8144621227109962
Energy: 0.9698850781404665
Energy: 0.8157224775775761
Energy: 1.1325359353287343
Energy: 0.8157224775781823
Energy: 0.9860225419254383
Energy: 0.8574509079628921
Energy: 1.1472295206147123
Energy: 0.857450907984719
Energy: 0.9748461592751231
Energy: 0.8592249689054478
Energy: 1.1515159343705554
Energy: 0.859224968895747
Energy: 0.9842367731320193
Energy: 0.8171699839288435
Energy: 0.9698661302143163
Energy: 0.817169983927631
Energy: 0.9803044301748803
Energy: 0.8158306208831274
Energy: 0.815849976357583
Energy: 0.8158306208879779
Energy: 1.1481339780666604
Energy: 0.815660233939637
Energy: 0.8157443737807808
Energy: 0.8156602339341803
Energy: 1.1145218853219574
Energy: 0.8152953345141067
Energy: 0.815552076153649
Energy: 0.8152953345025872

minimum gb energy = 0.8115217929751298 eV
minimum distance =  2.44589746004305 Angstroms
sigma value = 37


========================================
theta = 73.73979529168805
========================================

Energy: 1.3100915979329946
Energy: 0.7359496826244143
Energy: 0.7394461705337583
Energy: 0.734588632497028
Energy: 1.2604672002567905
Energy: 0.7342497600445845
Energy: 0.9942079350388223
Energy: 0.7342497600435415
Energy: 1.2514078947129499
Energy: 0.7318498990514042
Energy: 0.9970703389594283
Energy: 0.7318498990534904
Energy: 1.2502637162115868
Energy: 0.8140383514673086
Energy: 0.9986961989670071
Energy: 0.8140383514683517
Energy: 0.9940264394826113
Energy: 0.8133247251358341
Energy: 0.9961428850204834
Energy: 0.8133247251347908
Energy: 0.7412414142208749
Energy: 0.7343782402538845
Energy: 0.9943430825975957
Energy: 0.7343782402538845
Energy: 0.7358601880688294
Energy: 0.7316480122696817
Energy: 1.2603416599211512
Energy: 0.7316480122707247
Energy: 0.7401703969000336
Energy: 0.7338889167858915
Energy: 1.2557205290136797
Energy: 0.7338889167869347
Energy: 0.7339671671928063
Energy: 0.7322116826742942
Energy: 1.2560694361026146
Energy: 0.7322116826742942
Energy: 0.732376021929163
Energy: 0.7351858437297774
Energy: 1.250312617842815
Energy: 0.7351858437308205
Energy: 0.7394461705108097
Energy: 0.734588632497028
Energy: 1.3100915979340375
Energy: 0.7359496806381819
Energy: 0.9942079350377792
Energy: 0.7342497600466709
Energy: 1.2604672002567905
Energy: 0.7342497600445845
Energy: 0.9970703389625576
Energy: 0.7318498990534904
Energy: 1.2514078947129499
Energy: 0.7318498990534904
Energy: 0.9986961989680502
Energy: 0.8140383514673086
Energy: 1.25026371621263
Energy: 0.8140383514693948
Energy: 0.9961428850183972
Energy: 0.8133247251368771
Energy: 0.9940264394826113
Energy: 0.8133247251379202
Energy: 0.9943430825986389
Energy: 0.7343782402538845
Energy: 0.7412414142187885
Energy: 0.7343782402549277
Energy: 1.260341659920108
Energy: 0.7316480122686385
Energy: 0.7358601880677861
Energy: 0.7316480122686385
Energy: 1.2557205290147229
Energy: 0.7338889167848485
Energy: 0.7401703969000336
Energy: 0.7338889167890208
Energy: 1.2560694361026146
Energy: 0.7322116826742942
Energy: 0.7339671671938494
Energy: 0.7322116826753372
Energy: 1.2503126178407287
Energy: 0.7351858437308205
Energy: 0.732376021929163
Energy: 0.7351858437297774

minimum gb energy = 0.7316480122686385 eV
minimum distance =  2.45780549840357 Angstroms
sigma value = 25


========================================
theta = 77.31961650818019
========================================

Energy: 1.7389312106860453
Energy: 0.6583812413296032
Energy: 0.9047480218667878
Energy: 0.6539095596995065
Energy: 1.265071768410511
Energy: 0.6587571987556541
Energy: 0.8702230032038191
Energy: 0.6587571987572831
Energy: 1.3493717550959883
Energy: 0.6562245122821402
Energy: 0.8702751582368172
Energy: 0.6562245122796966
Energy: 1.172275027035571
Energy: 0.6579372659803783
Energy: 1.0345724161417977
Energy: 0.6579372659828219
Energy: 1.0756549532952226
Energy: 0.7223242179018193
Energy: 1.2645813914719433
Energy: 0.7223242178928594
Energy: 1.1654765773438134
Energy: 0.7203519535858165
Energy: 1.2620181957683103
Energy: 0.7203519535768567
Energy: 1.169101316363191
Energy: 0.649031478833577
Energy: 1.0751471883427095
Energy: 0.6490314788352061
Energy: 0.8653095268138024
Energy: 0.6478640205641447
Energy: 1.3449601510812188
Energy: 0.6478640205665883
Energy: 0.859169850412066
Energy: 0.648019320002984
Energy: 1.0706001677970358
Energy: 0.6480193200054275
Energy: 0.8564103280754486
Energy: 0.6485430579057292
Energy: 1.432385107337045
Energy: 0.6485430579032856
Energy: 0.7590879278066948
Energy: 0.6477142473493551
Energy: 1.4693503418085079
Energy: 0.6477142473542423
Energy: 0.755719845097424
Energy: 0.6485471056312883
Energy: 1.4322069904671428
Energy: 0.6485471056304737
Energy: 0.7579891741511212
Energy: 0.6493613133156358
Energy: 1.0705817449784938
Energy: 0.6493613133172649
Energy: 0.7660786964612605
Energy: 0.6480823613209201
Energy: 1.430180046851738
Energy: 0.6480823613168476
Energy: 0.9673694714484052
Energy: 0.6463050161646611
Energy: 1.0759049442004562
Energy: 0.6463050161695483
Energy: 0.9660736303232415
Energy: 0.6478514974597557
Energy: 1.35197022203016
Energy: 0.6478514974638284
Energy: 1.0746164283364548
Energy: 0.6489593912436603
Energy: 1.3565606641165033
Energy: 0.6489593912444749
Energy: 0.9738736246007872
Energy: 0.7170782146352594
Energy: 1.0694730845813702
Energy: 0.7170782146434048
Energy: 1.2489173607032158
Energy: 0.7109201815755647
Energy: 1.1677701565541598
Energy: 0.7109201815934845
Energy: 1.26475461555825
Energy: 0.713259742239508
Energy: 1.1659859472913885
Energy: 0.7132597422476533
Energy: 1.469266667326812
Energy: 0.7110302574925567
Energy: 0.8727464365302187
Energy: 0.7110302574835967
Energy: 1.265292690622423
Energy: 0.6552991765090823
Energy: 0.7582463460539614
Energy: 0.6552991765041952
Energy: 1.168299555807531
Energy: 0.6565949045120911
Energy: 0.8657642334829289
Energy: 0.6565949045080184
Energy: 1.34655559776577
Energy: 0.6565680801089827
Energy: 0.6585578776949246
Energy: 0.6565680801073537
Energy: 1.0740772872490143
Energy: 0.6558081424048805
Energy: 0.6571004066625136
Energy: 0.6558081424024369
Energy: 1.3513474837276895
Energy: 0.6561404370513501
Energy: 0.6573721499265135
Energy: 0.6561404370407612

minimum gb energy = 0.6463050161646611 eV
minimum distance =  2.46715045782876 Angstroms
sigma value = 41


========================================
theta = 79.6111421845304
========================================

Energy: 1.5734551373507502
Energy: 0.5886771209411118
Energy: 0.8464264895179985
Energy: 0.5869909165943626
Energy: 1.2630144064622506
Energy: 0.5853503926733956
Energy: 0.7595303605461676
Energy: 0.5853503926727277
Energy: 1.5582389765472289
Energy: 0.5855188508924918
Energy: 0.7630471518550099
Energy: 0.5855188508944951
Energy: 1.2592005719372896
Energy: 0.5862280247865658
Energy: 0.9475254785643581
Energy: 0.5862280247845624
Energy: 1.2576001363597873
Energy: 0.5838556583197274
Energy: 1.0966313139846293
Energy: 0.5838556583257374
Energy: 1.2530059373364897
Energy: 0.806081605523465
Energy: 1.0957565349386318
Energy: 0.8060816055207937
Energy: 1.2576966206988007
Energy: 0.6408162353746867
Energy: 1.2578624825459028
Energy: 0.6408162353753544
Energy: 1.1057941587745574
Energy: 0.6444332203376951
Energy: 1.0993489707169068
Energy: 0.6444332203376951
Energy: 0.9341282787346514
Energy: 0.5895396854466454
Energy: 1.4060022107295242
Energy: 0.5895396854519875
Energy: 0.9343439527605742
Energy: 0.5840899933340449
Energy: 1.2594268142856277
Energy: 0.5840899933340449
Energy: 0.7711627740120454
Energy: 0.5858415082400742
Energy: 1.4172458903782432
Energy: 0.5858415082360675
Energy: 0.7606288832802464
Energy: 0.5846942941174826
Energy: 1.258733624967223
Energy: 0.5846942941214894
Energy: 0.7611340039672255
Energy: 0.5863097003864599
Energy: 1.4051471749572213
Energy: 0.5863097003837888
Energy: 0.5904260187567926
Energy: 0.5867789232729825
Energy: 1.4141180452561886
Energy: 0.586778923274318
Energy: 0.5847721849481484
Energy: 0.5849474662478806
Energy: 1.259192265548626
Energy: 0.5849474662505517
Energy: 0.5867571041769204
Energy: 0.5860098107666375
Energy: 1.562619560984549
Energy: 0.5860098107666375
Energy: 0.7652047582047712
Energy: 0.5855097238507077
Energy: 1.5654549176628074
Energy: 0.5855097238567177
Energy: 0.761265794937033
Energy: 0.585107761068652
Energy: 1.2572306083767573
Energy: 0.5851077610766654
Energy: 0.7628642110465409
Energy: 0.5861021462058795
Energy: 1.2556774699512414
Energy: 0.5861021462005372
Energy: 1.0974373341024357
Energy: 0.584660501559299
Energy: 1.253845549965622
Energy: 0.5846605015533497
Energy: 1.102358031415583
Energy: 0.5850154883721246
Energy: 1.2603236877963997
Energy: 0.5850154883734604
Energy: 1.097669880210327
Energy: 0.6446356999936621
Energy: 1.2590409161250116
Energy: 0.6446356999956655
Energy: 1.4056597525336474
Energy: 0.6379938547220158
Energy: 1.2504760105038986
Energy: 0.6379938547232906
Energy: 1.098226130861148
Energy: 0.6454257692561233
Energy: 1.0975176370635105
Energy: 0.6454257692567911
Energy: 1.404528088020694
Energy: 0.5846329143392571
Energy: 0.9367237339157788
Energy: 0.584632914342596
Energy: 1.4075403201060774
Energy: 0.5845229935071037
Energy: 1.0949845886395337
Energy: 0.5845229935004258
Energy: 1.4116529301359815
Energy: 0.5865667589073444
Energy: 0.7637504325315434
Energy: 0.5865667589100156
Energy: 1.258772220131574
Energy: 0.5848469417907767
Energy: 0.760049500249946
Energy: 0.5848469417820955
Energy: 1.4112295822610086
Energy: 0.5869339256446277
Energy: 0.7681920466921328
Energy: 0.5869339256426243
Energy: 1.4085432479252618
Energy: 0.5859177226241583
Energy: 0.5869515507037659
Energy: 0.585917722628165
Energy: 1.258048356715124
Energy: 0.5849121006072333
Energy: 0.5844915348503
Energy: 0.5849121006085689
Energy: 1.56788203949803
Energy: 0.5857898272768531
Energy: 0.5884882979420653
Energy: 0.5857898272761853

minimum gb energy = 0.5838556583197274 eV
minimum distance =  2.47298752338853 Angstroms
sigma value = 15


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

Energy: 1.395565843169469
Energy: 0.543057087946324
Energy: 0.8020722430998385
Energy: 0.5398397108374459
Energy: 1.3906795487326555
Energy: 0.5381988651806275
Energy: 0.6869022565179902
Energy: 0.5381988651800619
Energy: 1.6491288089891232
Energy: 0.539041188413122
Energy: 0.6899186697714322
Energy: 0.5390411884125563
Energy: 1.392694776269042
Energy: 0.5406451254090012
Energy: 0.9844510782414178
Energy: 0.5406451254067385
Energy: 1.3887322719419721
Energy: 0.5371621257705204
Energy: 0.9761793669212564
Energy: 0.5371621257722174
Energy: 1.384889564479951
Energy: 0.5381531816405767
Energy: 0.9754224962543605
Energy: 0.5381531816326569
Energy: 1.1153417347020844
Energy: 0.5439336454006881
Energy: 1.2494849106269041
Energy: 0.5439336453984254
Energy: 1.2538782212832316
Energy: 0.5897984600562748
Energy: 0.9767180351170469
Energy: 0.5897984600647604
Energy: 1.1133729372447287
Energy: 0.5839341057340146
Energy: 1.24695408865412
Energy: 0.5839341057272261
Energy: 1.1116915170672679
Energy: 0.5854438932783085
Energy: 1.3897984223985684
Energy: 0.5854438932720857
Energy: 0.9846945553367569
Energy: 0.5432167240305739
Energy: 1.258135134005989
Energy: 0.5432167240271796
Energy: 0.8329319817008245
Energy: 0.537203843268757
Energy: 1.5138296400793134
Energy: 0.537203843276677
Energy: 0.9759740924017538
Energy: 0.5380132019512609
Energy: 1.5162023525226258
Energy: 0.5380132019506952
Energy: 0.6964326329558276
Energy: 0.5404949607478571
Energy: 1.2545700149690688
Energy: 0.5404949607512513
Energy: 0.6847958633225638
Energy: 0.5374250410480691
Energy: 1.3888804756949757
Energy: 0.5374250410458061
Energy: 0.691719874304897
Energy: 0.5396586002417908
Energy: 1.5173120691703101
Energy: 0.5396586002440537
Energy: 0.5409262747514682
Energy: 0.5392280210768721
Energy: 1.5222302255006885
Energy: 0.5392280210706493
Energy: 0.5382113080544777
Energy: 0.5380905348677035
Energy: 1.3881592933671159
Energy: 0.5380905348665721
Energy: 0.5425215872087682
Energy: 0.5391714515627033
Energy: 1.3875537656919223
Energy: 0.5391714515587434
Energy: 0.6936562285843684
Energy: 0.5401569047288615
Energy: 1.6520696265051114
Energy: 0.5401569047271644
Energy: 0.6851155760902055
Energy: 0.5375670492295147
Energy: 1.3883199858214859
Energy: 0.5375670492261718
Energy: 0.6962926128419729
Energy: 0.5397385767535482
Energy: 1.3900718818066389
Energy: 0.5397385767507197
Energy: 0.9765680229000474
Energy: 0.5386217807369521
Energy: 1.381964622219822
Energy: 0.5386217807369521
Energy: 0.9754910307587397
Energy: 0.5374646360983567
Energy: 1.3891810056838256
Energy: 0.5374646360966596
Energy: 0.9838542427957631
Energy: 0.5477593842047954
Energy: 1.1198087798605412
Energy: 0.5477593841985727
Energy: 1.2493577366144764
Energy: 0.7435732837718271
Energy: 1.3916107257584291
Energy: 0.7435732837763528
Energy: 0.9752638422908606
Energy: 0.5843840351282603
Energy: 1.248569145575207
Energy: 0.5843840351231689
Energy: 1.252730101068793
Energy: 0.589492903553643
Energy: 1.1195056257617368
Energy: 0.5894929035423289
Energy: 1.2505023324998652
Energy: 0.5436039346856204
Energy: 1.2476352706051836
Energy: 0.5436039346856204
Energy: 1.2493173236844017
Energy: 0.5373338728375818
Energy: 0.9762246616054474
Energy: 0.537333872839279
Energy: 1.3877370759281742
Energy: 0.5372891753897588
Energy: 0.8327432914617285
Energy: 0.5372891753931532
Energy: 1.2536658327071775
Energy: 0.5390601877152229
Energy: 0.9843575348841127
Energy: 0.5390601877123944
Energy: 1.516711488695462
Energy: 0.5397067682976134
Energy: 0.6879475522701797
Energy: 0.5397067683055333
Energy: 1.513043606963515
Energy: 0.5384961651577886
Energy: 0.6875654131324517
Energy: 0.5384961651600515
Energy: 1.5274248241351382
Energy: 0.5417155938021018
Energy: 0.5427752386832019
Energy: 0.5417155938037989
Energy: 1.5130739394464516
Energy: 0.5385977442792214
Energy: 0.5386302862495769
Energy: 0.5385977442792214
Energy: 1.6468256319585237
Energy: 0.5390082066992328
Energy: 0.5405341998060808
Energy: 0.5390082067003642

minimum gb energy = 0.5371621257705204 eV
minimum distance =  2.48200257306147 Angstroms
sigma value = 85


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

Energy: 1.5407757839357055
Energy: 0.47748311008684224
Energy: 0.4782242105571049
Energy: 0.4645630123244064
Energy: 1.4684626284345916
Energy: 0.4743560809459341
Energy: 0.608562937522208
Energy: 0.47435608093906517
Energy: 1.5211782924757296
Energy: 0.47457208091567177
Energy: 0.6086793189497108
Energy: 0.47457208091567177
Energy: 1.2797992659520507
Energy: 0.4761559131481553
Energy: 0.8636288386569435
Energy: 0.4761559131535523
Energy: 1.4658537002350431
Energy: 0.4732030772696001
Energy: 0.8633296408624372
Energy: 0.47320307727058136
Energy: 1.2841973184742772
Energy: 0.4741856964985039
Energy: 0.8648683753121762
Energy: 0.4741856964945788
Energy: 1.2883564385310067
Energy: 0.47516708650188333
Energy: 1.1108286761932307
Energy: 0.47516708650041145
Energy: 1.3511214845290769
Energy: 0.4736491778600554
Energy: 0.9240362130465194
Energy: 0.47364917785858346
Energy: 1.2879926025224662
Energy: 0.4741969796330423
Energy: 1.1067260128343102
Energy: 0.4741969796340236
Energy: 1.2879365482168923
Energy: 0.837462282767495
Energy: 1.3440995179128965
Energy: 0.8374622827670043
Energy: 1.1131965283356466
Energy: 0.4727039379494923
Energy: 1.1630181733657294
Energy: 0.4727039380068525
Energy: 1.0476884464841474
Energy: 0.472628764809622
Energy: 1.3441582202191626
Energy: 0.4726287648061876
Energy: 1.1073346116118248
Energy: 0.47339930089325233
Energy: 1.403724025672371
Energy: 0.4733993008942336
Energy: 0.8717251965899473
Energy: 0.47187824239505355
Energy: 1.167969662029009
Energy: 0.4718782423945629
Energy: 0.7981767646459986
Energy: 0.47173276899528704
Energy: 1.4135027298283354
Energy: 0.471732768994841
Energy: 0.8689676753697627
Energy: 0.47086677448094644
Energy: 1.4055961941617712
Energy: 0.4708667744868341
Energy: 0.606387744822344
Energy: 0.47223918489542827
Energy: 1.409054832588806
Energy: 0.47223918489886274
Energy: 0.6059304964342369
Energy: 0.47148091835068506
Energy: 1.46357434049374
Energy: 0.4714809183497038
Energy: 0.6049556815995045
Energy: 0.47061531782565885
Energy: 1.4680373761256709
Energy: 0.4706153178246776
Energy: 0.5418267530475431
Energy: 0.47298048401161874
Energy: 1.5215195624331266
Energy: 0.4729804840160345
Energy: 0.5355977185609962
Energy: 0.47027370945684316
Energy: 1.4620256777723701
Energy: 0.4702737094548806
Energy: 0.5396455031842985
Energy: 0.47119417185379525
Energy: 1.4593169011511518
Energy: 0.47119417185428586
Energy: 0.6736904519680482
Energy: 0.4706895675916722
Energy: 1.4696278590402414
Energy: 0.47068956759265346
Energy: 0.6686865398416555
Energy: 0.4700473833846733
Energy: 1.4611449980813251
Energy: 0.4700473833866358
Energy: 0.6704354567840957
Energy: 0.47292231748743685
Energy: 1.279776037542712
Energy: 0.4729223174786054
Energy: 0.8584090501525851
Energy: 0.47048684129305796
Energy: 1.4669306329686385
Energy: 0.47048684129256735
Energy: 0.861431464798342
Energy: 0.47015413858359845
Energy: 1.5199574394772017
Energy: 0.4701541385850704
Energy: 0.860787046525946
Energy: 0.47224903882348346
Energy: 1.28171014439932
Energy: 0.47224903882495534
Energy: 1.1106177799383563
Energy: 0.4711301008993343
Energy: 1.460258540509484
Energy: 0.47113010090129687
Energy: 1.1080083007565678
Energy: 0.4713177742572532
Energy: 1.2848296287765972
Energy: 0.4713177741758516
Energy: 1.2306584432030163
Energy: 0.5676977723241509
Energy: 1.0443055775518997
Energy: 0.5676977723246415
Energy: 1.1700087083446413
Energy: 0.5673369029966852
Energy: 1.293471020429064
Energy: 0.5673369027254953
Energy: 1.346683260087071
Energy: 0.474307911300978
Energy: 1.044805211936071
Energy: 0.4743079112965622
Energy: 1.4677098810499734
Energy: 0.4730526332491869
Energy: 1.0461852470924007
Energy: 0.47305263325654645
Energy: 1.1598929083240324
Energy: 0.4758706889329273
Energy: 0.8625847164737521
Energy: 0.47587068892507706
Energy: 1.4686529812890685
Energy: 0.4731711123606727
Energy: 0.8633453344546634
Energy: 0.4731711123709761
Energy: 1.4698968171113163
Energy: 0.4740905929342463
Energy: 0.8640253135018048
Energy: 0.474090592927868
Energy: 1.4009066415899005
Energy: 0.4747603517742851
Energy: 0.6099414177548312
Energy: 0.4747603517791915
Energy: 1.4668125081836785
Energy: 0.4731123943373393
Energy: 0.6054038055397337
Energy: 0.4731123943402831
Energy: 1.6376816673227053
Energy: 0.47448469615177236
Energy: 0.6108345796018834
Energy: 0.47448469615226296
Energy: 1.3992641713681893
Energy: 0.4764649203326186
Energy: 0.4786069120889314
Energy: 0.47646492033065607
Energy: 1.4659039304042152
Energy: 0.4731174233525559
Energy: 0.4734586986704162
Energy: 0.47311742334470563
Energy: 1.5251050857569748
Energy: 0.4741045562352893
Energy: 0.47804046536661854
Energy: 0.4741045562352893

minimum gb energy = 0.4645630123244064 eV
minimum distance =  2.46816289506326 Angstroms
sigma value = 113


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

Energy: 0.02141440285717403
Energy: 0.3876839968079007
Energy: 1.2793993016465768
Energy: 0.02211203689492021
Energy: 0.9931244749648557
Energy: 0.11340097634281361
Energy: 0.9925934541027357
Energy: 0.11340097634541196
Energy: 0.022387367173052328
Energy: 0.1117913734940567
Energy: 0.9914104909769613
Energy: 0.11179137349770275
Energy: 0.023242716879110312
Energy: 0.11335225454032284
Energy: 0.9955804546523966
Energy: 0.1133522545396104
Energy: 0.9952814096414642
Energy: 0.11105314573894647
Energy: 0.9943083496808441
Energy: 0.11105314573823401
Energy: 0.03000717526113906
Energy: 0.11190801353777102
Energy: 0.9934138324497027
Energy: 0.11190801353890255

minimum gb energy = 0.02141440285717403 eV
minimum distance =  2.73239709452846 Angstroms
sigma value = 1