Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Au__MO_468407568810_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080054295063022
cohesive_energy=3.930314242832764
mass=196.9665
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=[1.068807226011498e-19, 1.72237192508268e-19, 2.2702682686116596e-19, 2.75048867112048e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57767499159944e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29041783511178e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06387151295308e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.85714556964586e-19, 1.9324813688654397e-19, 7.75266036189822e-20, -6.80838551911764e-20, -2.52636018179022e-19, -4.88748788731602e-19, -7.943880143166119e-19, -1.195294264735896e-18, -1.72852428335724e-18, -2.44934355099384e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -5.96046447753906e-08 eV

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

Energy: 0.011899071032453523
Energy: 0.0649781605191383
Energy: 0.43002311385669295
Energy: 0.0649781605191383
Energy: 0.06497816051867325
Energy: 0.4427971380887057
Energy: 0.0649781605239527
Energy: 0.4427971380877209
Energy: 0.43002311385620057
Energy: 0.0649781605191383
Energy: 0.011899071032453523
Energy: 0.06497816051867325
Energy: 0.06497816051818088
Energy: 0.4427971380862985
Energy: 0.06497816051818088
Energy: 0.4427971380882133

minimum gb energy = 0.011899071032453523 eV
minimum distance =  2.7975880374881 Angstroms
sigma value = 1


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

Energy: 0.822519825790407
Energy: 0.5806016579589327
Energy: 0.5812519647051324
Energy: 0.5806016579577385
Energy: 0.5494303275385385
Energy: 0.5903747591774587
Energy: 0.5482654733204353
Energy: 0.5903747591780558
Energy: 0.5813198939771071
Energy: 0.5806576717214516
Energy: 0.8963047942852955
Energy: 0.5806576717220487
Energy: 0.5506783236361842
Energy: 0.5498372190347707
Energy: 0.5485159235194073
Energy: 0.5498372190341736
Energy: 0.7639595769212306
Energy: 0.5475859419841108
Energy: 0.5497231009368293
Energy: 0.5475859419829165
Energy: 0.5716393587740084
Energy: 0.5717004723541821
Energy: 0.5487471435045767
Energy: 0.5717004723547792
Energy: 0.5726956789645675
Energy: 0.5710020629279327
Energy: 0.5704190156564948
Energy: 0.5710020629273356
Energy: 0.5741765869642124
Energy: 0.5793085348051354
Energy: 0.5927533799201885
Energy: 0.5793085348045383
Energy: 0.5813318221052741
Energy: 0.5767109931897881
Energy: 0.5817486948678507
Energy: 0.5767109931897881
Energy: 0.5892871230461876
Energy: 0.5788763434248105
Energy: 0.5827155340011675
Energy: 0.5788763434254078
Energy: 0.580200228494843
Energy: 0.57659691201235
Energy: 0.5816080584210233
Energy: 0.576596912013517
Energy: 0.5763985718164709
Energy: 0.5754433924995475
Energy: 0.5911558401009878
Energy: 0.5754433924983532
Energy: 0.5834696533627053
Energy: 0.5704176427428598
Energy: 0.5550291102055587
Energy: 0.5704176427422625
Energy: 0.5720122641182477
Energy: 0.5710865644941174
Energy: 0.5725468773696133
Energy: 0.5710865644941174
Energy: 0.555490053183454
Energy: 0.5477424669710316
Energy: 0.548487441495395
Energy: 0.5477424669704344
Energy: 0.5615979299230586
Energy: 0.5503604199487222
Energy: 0.5491930741738574
Energy: 0.5503604199433477
Energy: 0.5810311191890989
Energy: 0.5806003426771292
Energy: 0.5406119155659419
Energy: 0.5806003426777263
Energy: 0.5481012307644683
Energy: 0.5478038639535778
Energy: 0.5540731524937237
Energy: 0.5478038639995314
Energy: 0.548796634233511
Energy: 0.5805457356879596
Energy: 0.5818198889182536
Energy: 0.5805457356873625
Energy: 0.5713862943416361
Energy: 0.5498699844842481
Energy: 0.5499038537912625
Energy: 0.5498699844848451
Energy: 0.5504655317877688
Energy: 0.5493633013179203
Energy: 0.5698344267765185
Energy: 0.5493633013179203
Energy: 0.5490337608384384
Energy: 0.5489239879480338
Energy: 0.5717011075759929
Energy: 0.5489239879480338
Energy: 0.569935989281662
Energy: 0.5711893019048929
Energy: 0.5711658820200008
Energy: 0.5711893019054901
Energy: 0.5870367553458168
Energy: 0.5742894664141868
Energy: 0.5721347986806273
Energy: 0.5742894664129925
Energy: 0.5819059340776419
Energy: 0.5769091995502478
Energy: 0.6571085270732366
Energy: 0.576909199550845
Energy: 0.5827360359245564
Energy: 0.5749395251433452
Energy: 0.5901399619710976
Energy: 0.5749395251439423
Energy: 0.5819275317480633
Energy: 0.5766041589179828
Energy: 0.5800231282145178
Energy: 0.5766041589168156
Energy: 0.5916429054178428
Energy: 0.5753168329104115
Energy: 0.5716475004384428
Energy: 0.5753168329098144
Energy: 0.5550349180080069
Energy: 0.5704772830844128
Energy: 0.5841872006307911
Energy: 0.5704772830844128
Energy: 0.57238868086868
Energy: 0.5721211047086069
Energy: 0.5729684438281912
Energy: 0.5721211047080097
Energy: 0.547979514887509
Energy: 0.5478256434473652
Energy: 0.5544521844882918
Energy: 0.5478256434485594
Energy: 0.5490258179328725
Energy: 0.5478542960302938
Energy: 0.5616685865326557
Energy: 0.5478542960308911
Energy: 0.5409325722255555
Energy: 0.5493529034305075
Energy: 0.5816285470003774
Energy: 0.5493529034305075

minimum gb energy = 0.5406119155659419 eV
minimum distance =  2.55140063440046 Angstroms
sigma value = 1


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

Energy: 0.9391739628347341
Energy: 0.6081392104373582
Energy: 0.6078699466016741
Energy: 0.6081392104394009
Energy: 0.5742024120970947
Energy: 0.6154398241865514
Energy: 0.5744271154807379
Energy: 0.6154398241885939
Energy: 0.6076367139022083
Energy: 0.6085155399326317
Energy: 0.573485338611257
Energy: 0.6085155399333125
Energy: 0.5754427286831676
Energy: 0.5739124083404277
Energy: 0.5743107380833691
Energy: 0.5739124083397468
Energy: 0.5746219232300029
Energy: 0.5736218087290349
Energy: 0.5742817950626495
Energy: 0.5736218087296848
Energy: 0.6004406730995283
Energy: 0.640813946135931
Energy: 0.5743413642076667
Energy: 0.6408139461379735
Energy: 0.6016102254277245
Energy: 0.6023972467079172
Energy: 0.5994635803204029
Energy: 0.6023972467085981
Energy: 0.6016718157640207
Energy: 0.6192478385115923
Energy: 0.6215134961691484
Energy: 0.6192478385109114
Energy: 0.601206038858626
Energy: 0.6076597088728783
Energy: 0.6087457390998121
Energy: 0.6076597088749208
Energy: 0.6200879377907815
Energy: 0.6084383131427378
Energy: 0.6037535964126055
Energy: 0.608438313146142
Energy: 0.5855821222647234
Energy: 0.6017486895844276
Energy: 0.6212124731677394
Energy: 0.6017486895885128
Energy: 0.5847018786432006
Energy: 0.60447399206048
Energy: 0.6009459209362359
Energy: 0.6044739920611608
Energy: 0.5744114976798648
Energy: 0.5736025992007704
Energy: 0.5841906754084257
Energy: 0.5736025992007704
Energy: 0.5741654488402431
Energy: 0.5736641901577315
Energy: 0.5635022834812522
Energy: 0.5736641901611359
Energy: 0.5624772363183761
Energy: 0.6079735268375572
Energy: 0.6075760193754292
Energy: 0.6079735268375572
Energy: 0.583610475699786
Energy: 0.5737140536811085
Energy: 0.5742029844869382
Energy: 0.573714053679066
Energy: 0.6093609840285195
Energy: 0.6084719693641697
Energy: 0.5744382889653943
Energy: 0.6084719693621271
Energy: 0.575295998135608
Energy: 0.5736221972337682
Energy: 0.6005868218941003
Energy: 0.5736221971568621
Energy: 0.5745439207720276
Energy: 0.5759201578131444
Energy: 0.5765961035817737
Energy: 0.575920157810421
Energy: 0.600634453068501
Energy: 0.5736405051833794
Energy: 0.5739769864078305
Energy: 0.5736405051826985
Energy: 0.6012918143146074
Energy: 0.6188377155442653
Energy: 0.6001167930368021
Energy: 0.6188377155483503
Energy: 0.6001983703532334
Energy: 0.6058038905387984
Energy: 0.6157990219590209
Energy: 0.6058038905435643
Energy: 0.6010765777948889
Energy: 0.6076083643856102
Energy: 0.6083740983895796
Energy: 0.6076083643835676
Energy: 0.6192875284059406
Energy: 0.6076754548879484
Energy: 0.6010839429038538
Energy: 0.6076754548872675
Energy: 0.5848629505970127
Energy: 0.6017606171024324
Energy: 0.6217557887472454
Energy: 0.6017606171085602
Energy: 0.5842718404353612
Energy: 0.6031536461383699
Energy: 0.6026813819709462
Energy: 0.6031536461377199
Energy: 0.5738596592457348
Energy: 0.5735334008572723
Energy: 0.5834854231901385
Energy: 0.5735334008511446
Energy: 0.5742774787341512
Energy: 0.5737712541948956
Energy: 0.5634161202453122
Energy: 0.5737712541908104
Energy: 0.5624424591558386
Energy: 0.5753213907067964
Energy: 0.6082216006292454
Energy: 0.5753213907054349

minimum gb energy = 0.5624424591558386 eV
minimum distance =  2.54142511275661 Angstroms
sigma value = 25


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

Energy: 0.8955036728507416
Energy: 0.6381691113991844
Energy: 0.6383595764250157
Energy: 0.638169111399976
Energy: 0.6028642363560305
Energy: 0.6419959455843914
Energy: 0.6028782893770499
Energy: 0.6419959455843914
Energy: 0.6378613022174723
Energy: 0.6382035803654308
Energy: 0.6018126736919884
Energy: 0.6382035803654308
Energy: 0.6049114900915382
Energy: 0.602231856497201
Energy: 0.6028751028410025
Energy: 0.6022318564956181
Energy: 0.602620165162123
Energy: 0.6023028093738466
Energy: 0.6027590013846487
Energy: 0.6023028093738466
Energy: 0.6286755501382861
Energy: 0.6616625827249586
Energy: 0.603422502674549
Energy: 0.66166258272575
Energy: 0.6322345934296525
Energy: 0.6496618662613205
Energy: 0.6276656138037934
Energy: 0.649661866262112
Energy: 0.6285016919662088
Energy: 0.6433785716378817
Energy: 0.6213944897401272
Energy: 0.6433785716378817
Energy: 0.6293236863768141
Energy: 0.6484238688523282
Energy: 0.6213927798810727
Energy: 0.6484238688523282
Energy: 0.6286276960731186
Energy: 0.6470084100361229
Energy: 0.6025361635202549
Energy: 0.6470084100345399
Energy: 0.5848521514333147
Energy: 0.6021558963812526
Energy: 0.6012424015132228
Energy: 0.6021558963828355
Energy: 0.5848911711623743
Energy: 0.6023120259244654
Energy: 0.6024686029742227
Energy: 0.6023120259236738
Energy: 0.6373993723734749
Energy: 0.6385660441840665
Energy: 0.5843333949986538
Energy: 0.6385660441832749
Energy: 0.6027329168310295
Energy: 0.6021932405346182
Energy: 0.6192326996752842
Energy: 0.6021932405401585
Energy: 0.6021502636014471
Energy: 0.638929768286708
Energy: 0.6403524968732718
Energy: 0.6389297682859166
Energy: 0.6287991673339306
Energy: 0.6025162299546953
Energy: 0.604616464698336
Energy: 0.602516229953904
Energy: 0.6055294473436993
Energy: 0.6049449724521959
Energy: 0.602773885952602
Energy: 0.6049449724521959
Energy: 0.6031052922684396
Energy: 0.6022569035865685
Energy: 0.6294835468627656
Energy: 0.6022569035873601
Energy: 0.6265928658970206
Energy: 0.6529767686712468
Energy: 0.6305406347409136
Energy: 0.6529767686712468
Energy: 0.622460714605636
Energy: 0.6467032529859857
Energy: 0.6294986318647166
Energy: 0.6467032529859857
Energy: 0.6185600803219424
Energy: 0.6483026422979191
Energy: 0.6284534705819468
Energy: 0.6483026422987106
Energy: 0.6191487876479644
Energy: 0.6482462097595773
Energy: 0.6287567460410004
Energy: 0.6482462097595773
Energy: 0.6007669115530825
Energy: 0.6022149514652587
Energy: 0.5846646033852846
Energy: 0.6022149514549694
Energy: 0.6024953046411404
Energy: 0.6022705005354378
Energy: 0.584826184865013
Energy: 0.6022705005346465
Energy: 0.5842279484067817
Energy: 0.6041680600926815
Energy: 0.6395364192236197
Energy: 0.6041680600910986

minimum gb energy = 0.5842279484067817 eV
minimum distance =  2.54490298770089 Angstroms
sigma value = 9


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

Energy: 0.8297006721253098
Energy: 0.6688433072529686
Energy: 0.6694605840858484
Energy: 0.6688433072501361
Energy: 0.6370549897540064
Energy: 0.6673351060346143
Energy: 0.6369873369180495
Energy: 0.6673351060355586
Energy: 0.6688571544885579
Energy: 0.6686597410643134
Energy: 0.6669687832384719
Energy: 0.6686597410652574
Energy: 0.6343298194269572
Energy: 0.6367476039700317
Energy: 0.636506455340398
Energy: 0.6367476039700317
Energy: 0.6341286611961506
Energy: 0.637816293987781
Energy: 0.6358095335022946
Energy: 0.6378162939896693
Energy: 0.6353231391818818
Energy: 0.6975776716926421
Energy: 0.6382782903657296
Energy: 0.6975776716935862
Energy: 0.662010297036173
Energy: 0.6911056918340223
Energy: 0.6366872511545771
Energy: 0.6911056918283571
Energy: 0.637445434894989
Energy: 0.6922630073326377
Energy: 0.6390426921028349
Energy: 0.6922630073298053
Energy: 0.6350340265883652
Energy: 0.6375813712862465
Energy: 0.6047528680743434
Energy: 0.6375813712824698
Energy: 0.6366572287759963
Energy: 0.636843195556883
Energy: 0.6043212078109336
Energy: 0.6368431957446893
Energy: 0.6034492239701358
Energy: 0.6690068736564161
Energy: 0.6681698702538403
Energy: 0.6690068736554721
Energy: 0.660112758109542
Energy: 0.6368712315530703
Energy: 0.6371134292550414
Energy: 0.6368712315530703
Energy: 0.669692811504348
Energy: 0.6689469804863927
Energy: 0.6670921388980411
Energy: 0.6689469804854484
Energy: 0.6342092462012542
Energy: 0.6365340578371782
Energy: 0.6320015467880002
Energy: 0.6365340578400108
Energy: 0.6341064359678412
Energy: 0.6353454530974635
Energy: 0.6377327761037255
Energy: 0.6353454530965194
Energy: 0.6359202679314296
Energy: 0.6380461132299521
Energy: 0.6367198847864403
Energy: 0.638046113229008
Energy: 0.6604636160005533
Energy: 0.6937244616510563
Energy: 0.6363904165040757
Energy: 0.6937244616510563
Energy: 0.6592848588173964
Energy: 0.6921852952692698
Energy: 0.6376753601113062
Energy: 0.6921852952692698
Energy: 0.634753258705762
Energy: 0.6376162623764622
Energy: 0.6041748799680045
Energy: 0.6376162623764622
Energy: 0.6365127036120654
Energy: 0.637155668809108
Energy: 0.6041452455069751
Energy: 0.637155668809108
Energy: 0.6032624584754416
Energy: 0.6344425144615081
Energy: 0.6694347515393356
Energy: 0.6344425144586757

minimum gb energy = 0.6032624584754416 eV
minimum distance =  2.55771001712654 Angstroms
sigma value = 25


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

Energy: 0.7382612902467826
Energy: 0.7021144058373191
Energy: 0.7030752528933485
Energy: 0.7021144058373191
Energy: 0.6426397881606107
Energy: 0.671592764475056
Energy: 0.6415330015009861
Energy: 0.671592764475056
Energy: 0.7020369006642896
Energy: 0.7020168305801348
Energy: 0.6995718572408985
Energy: 0.7020168305801348
Energy: 0.6275804822060899
Energy: 0.6720453655231866
Energy: 0.6421659631673274
Energy: 0.6720453655243542
Energy: 0.6393518737571136
Energy: 0.6919611742590749
Energy: 0.6440760788059773
Energy: 0.6919611742579073
Energy: 0.6267028079426584
Energy: 0.6959525839147164
Energy: 0.6412541977887556
Energy: 0.6959525839147164
Energy: 0.624073266131394
Energy: 0.6913321446262319
Energy: 0.6419364721643414
Energy: 0.6913321446250643
Energy: 0.6236815691908405
Energy: 0.6899632117629731
Energy: 0.6437754185744956
Energy: 0.6899632117618054
Energy: 0.7013444201273514
Energy: 0.7024205459752112
Energy: 0.7705640609786267
Energy: 0.7024205459752112
Energy: 0.6437140355065853
Energy: 0.691002965166429
Energy: 0.6238642125237212
Energy: 0.691002965166429
Energy: 0.6995359814915713
Energy: 0.7024326537198984
Energy: 0.7071496501389601
Energy: 0.7024326537198984
Energy: 0.625298837822375
Energy: 0.6733755854863956
Energy: 0.7144722316587617
Energy: 0.6733755854863956
Energy: 0.6417195951821986
Energy: 0.695128436645972
Energy: 0.6390048188923428
Energy: 0.695128436645972
Energy: 0.6435149819762521
Energy: 0.6913913451427361
Energy: 0.6282943641876239
Energy: 0.6913913451427361
Energy: 0.680870278712215
Energy: 0.6902516411439263
Energy: 0.6236738384165168
Energy: 0.6902516411439263
Energy: 0.6418309630343246
Energy: 0.6906875598256497
Energy: 0.6237953362305898
Energy: 0.6906875598256497
Energy: 0.701004526678241
Energy: 0.628138529745867
Energy: 0.7035424822463929
Energy: 0.628138529766885

minimum gb energy = 0.6236738384165168 eV
minimum distance =  2.62145506190849 Angstroms
sigma value = 17


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

Energy: 1.0296438892966733
Energy: 0.7685865843069318
Energy: 0.7664675947956038
Energy: 0.7685865843069318
Energy: 0.6735775639576957
Energy: 0.6848220717035327
Energy: 0.6826573895924788
Energy: 0.6848220717048553
Energy: 0.6844865569292133
Energy: 0.6824172279990786
Energy: 0.7197578702071856
Energy: 0.6824172279984172
Energy: 0.6816759268341325
Energy: 0.708493496631095
Energy: 0.6819453229362625
Energy: 0.708493496631095
Energy: 0.6836992075528796
Energy: 0.7366341825279259
Energy: 0.642650828439529
Energy: 0.7366341825272646
Energy: 0.6835349413085912
Energy: 0.7323414354177249
Energy: 0.6833339725875206
Energy: 0.7323414354177249
Energy: 0.7176248473823067
Energy: 0.6820342407640562
Energy: 0.6814468637875793
Energy: 0.6820342407640562
Energy: 0.723959870451434
Energy: 0.6829195583526275
Energy: 0.6574887068908236
Energy: 0.6829195583526275
Energy: 0.770584811653987
Energy: 0.7678787041545757
Energy: 0.7808841635950443
Energy: 0.7678787041545757
Energy: 0.7763037420970911
Energy: 0.7218757180368004
Energy: 0.6831082306726302
Energy: 0.721875718036139
Energy: 0.6816474233143465
Energy: 0.6576567301998096
Energy: 0.6544559176332484
Energy: 0.6576567301991484
Energy: 0.7217080691870195
Energy: 0.6745693933721907
Energy: 0.6583469786622556
Energy: 0.6745693933735133
Energy: 0.7203698023260315
Energy: 0.6759680269345824
Energy: 0.6747446515474707
Energy: 0.6759680269345824
Energy: 0.7194295779107707
Energy: 0.6757701018364952
Energy: 0.6551228389310366
Energy: 0.6757701018378178
Energy: 0.7714594367196997
Energy: 0.7230341275094582
Energy: 0.7237418153462505
Energy: 0.7230341275081354
Energy: 0.7673005145116446
Energy: 0.7232710082348662
Energy: 0.7245314548979129
Energy: 0.723271008234205
Energy: 0.7235646876608585
Energy: 0.682544608196019
Energy: 0.6821878275009161
Energy: 0.682544608198003
Energy: 0.7239216809649002
Energy: 0.6824184277913851
Energy: 0.6808787845278274
Energy: 0.6824184277913851
Energy: 0.686804365985511
Energy: 0.7359866676891871
Energy: 0.6839580249180378
Energy: 0.7359866676898484
Energy: 0.7056091760181865
Energy: 0.7351494157022318
Energy: 0.6839012860359673
Energy: 0.7351494157035543
Energy: 0.6832420790203398
Energy: 0.6841014565017695
Energy: 0.7221503376319148
Energy: 0.6841014565017695
Energy: 0.6826346318587373
Energy: 0.68286676370304
Energy: 0.718566466477659
Energy: 0.6828667637010561
Energy: 0.6823018408347645
Energy: 0.7230697530601924
Energy: 0.6829448896699736
Energy: 0.7230697530601924
Energy: 0.726608307833971
Energy: 0.7679036012596124
Energy: 0.7671769723861614
Energy: 0.7679036012589511
Energy: 0.6580262062391247
Energy: 0.6756084766873011
Energy: 0.7230013165101753
Energy: 0.6756084766879624
Energy: 0.6582614140115596
Energy: 0.674875467260866
Energy: 0.6819678232104365
Energy: 0.6748754672621886
Energy: 0.6534748391059075
Energy: 0.6603360204690844
Energy: 0.7221518088480173
Energy: 0.660336020468423
Energy: 0.6582774666093574
Energy: 0.6742946070567508
Energy: 0.719550346566241
Energy: 0.6742946070560896
Energy: 0.6584634624098733
Energy: 0.6760090305947501
Energy: 0.7187277465505029
Energy: 0.6760090305940888
Energy: 0.7198414341057334
Energy: 0.7687582186854699
Energy: 0.7656191432659587
Energy: 0.7687582186841473

minimum gb energy = 0.642650828439529 eV
minimum distance =  2.60995929089263 Angstroms
sigma value = 53


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

Energy: 0.9314609252352801
Energy: 0.7154690734707344
Energy: 0.716441088132996
Energy: 0.715469073472257
Energy: 0.7229035778699818
Energy: 0.6486078268647868
Energy: 0.714314039409874
Energy: 0.6486078268632642
Energy: 0.7147995554112235
Energy: 0.7154621619881715
Energy: 0.7297629193946983
Energy: 0.7154621619896939
Energy: 0.7178622138954834
Energy: 0.6491226411312012
Energy: 0.7227897484419693
Energy: 0.6491226411342461
Energy: 0.7168458871301769
Energy: 0.6490630723154301
Energy: 0.6128977827417621
Energy: 0.6490630723169527
Energy: 0.7274789576622157
Energy: 0.650138664502472
Energy: 0.6176068070375103
Energy: 0.6501386645130947
Energy: 0.8228777366148904
Energy: 0.7155639449350865
Energy: 0.7138213262605831
Energy: 0.715563944933564
Energy: 0.8066198077150276
Energy: 0.6494843311606743
Energy: 0.7240007667220809
Energy: 0.6494843311637191
Energy: 0.7153092824003194
Energy: 0.7153362570497618
Energy: 0.7304450087805557
Energy: 0.7153362570512842
Energy: 0.7208066340816595
Energy: 0.649657076114028
Energy: 0.719889286046343
Energy: 0.6496570761155503
Energy: 0.7152376688732959
Energy: 0.6522777497223089
Energy: 0.6201969198583164
Energy: 0.6522777497207864
Energy: 0.7267411239263002
Energy: 0.6486025823367528
Energy: 0.6088300332876194
Energy: 0.6486025823352304
Energy: 0.806628908530554
Energy: 0.6501934189218973
Energy: 0.7230985764462945
Energy: 0.6501934189218973

minimum gb energy = 0.6088300332876194 eV
minimum distance =  2.61333394424896 Angstroms
sigma value = 9


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

Energy: 0.9079028006977297
Energy: 0.7988117494972014
Energy: 0.7997920827391091
Energy: 0.7988117494966379
Energy: 0.6689772282644962
Energy: 0.6682228871291018
Energy: 0.8044840989691031
Energy: 0.668222887108253
Energy: 0.672460031191467
Energy: 0.6695593626213222
Energy: 0.7960602707790133
Energy: 0.6695593626207588
Energy: 0.6698136650960461
Energy: 0.6691405707291802
Energy: 0.8544299816786409
Energy: 0.6691405707297438
Energy: 0.6674148804760378
Energy: 0.6673317697694697
Energy: 0.859465853928496
Energy: 0.6673317697683427
Energy: 0.6676867142239725
Energy: 0.6668081881644624
Energy: 0.8567226038129157
Energy: 0.666808188166153
Energy: 0.8022670755278631
Energy: 0.7957709738990529
Energy: 0.805898513495543
Energy: 0.7957709739001799
Energy: 0.8025346303465954
Energy: 0.7339085383604522
Energy: 0.7953985683586338
Energy: 0.7339085383610157
Energy: 0.7035428033370131
Energy: 0.7435143427019784
Energy: 0.720742970259797
Energy: 0.7435143427014149
Energy: 0.6678447992839501
Energy: 0.7335287645946177
Energy: 0.7975159001233929
Energy: 0.7335287645951812
Energy: 0.7027006566922056
Energy: 0.7042781336686766
Energy: 0.7582266269645588
Energy: 0.7042781336681131
Energy: 0.70997442011985
Energy: 0.7479036197463427
Energy: 0.8498449889460037
Energy: 0.7479036197452157
Energy: 0.8039498893303975
Energy: 0.7035169351792698
Energy: 0.7131096718078476
Energy: 0.7035169351792698
Energy: 0.8029041014449073
Energy: 0.7036360876452096
Energy: 0.7024228389706932
Energy: 0.7036360876485904
Energy: 0.7946906353411342
Energy: 0.6983186627704632
Energy: 0.70861469065164
Energy: 0.6983186627715902
Energy: 0.7392391332596614
Energy: 0.7439065143841902
Energy: 0.7099002315182437
Energy: 0.7439065143836266
Energy: 0.796625901597718
Energy: 0.6683060525594019
Energy: 0.7043351649978795
Energy: 0.6683060525594019
Energy: 0.7985850580362038
Energy: 0.7986949137662975
Energy: 0.8515866671702575
Energy: 0.7986949137662975
Energy: 0.8051978507353229
Energy: 0.6687124902245686
Energy: 0.7053316259284158
Energy: 0.6687124901930647
Energy: 0.8440848065856624
Energy: 0.670585111669602
Energy: 0.6722950065850226
Energy: 0.6705851116690386
Energy: 0.8079784139153163
Energy: 0.6684566277187023
Energy: 0.6690027264480819
Energy: 0.6684566277187023
Energy: 0.8570383938133544
Energy: 0.6669629249287258
Energy: 0.6668527721214567
Energy: 0.6669629249270352
Energy: 0.8591312575924995
Energy: 0.667398943256666
Energy: 0.6679921787920714
Energy: 0.6673989432555391
Energy: 0.8069473067144302
Energy: 0.7964643290619187
Energy: 0.8025438914158086
Energy: 0.7964643290624821
Energy: 0.7959614308240106
Energy: 0.7379889586704163
Energy: 0.802775976341256
Energy: 0.7379889586709798
Energy: 0.71191635553971
Energy: 0.7418149133410467
Energy: 0.7023959344385385
Energy: 0.7418149133427372
Energy: 0.7984524386468401
Energy: 0.7330969698159464
Energy: 0.6677352760690954
Energy: 0.7330969698176368
Energy: 0.7579651348109385
Energy: 0.7007787342773928
Energy: 0.7026853245814999
Energy: 0.7007787342773928
Energy: 0.8519286214510235
Energy: 0.7088239038790614
Energy: 0.7124890702232887
Energy: 0.7088239038801882
Energy: 0.7140244534688015
Energy: 0.6947140701155848
Energy: 0.8095229148725276
Energy: 0.6947140701161483
Energy: 0.7036719708478281
Energy: 0.7031652665941611
Energy: 0.7946042338331273
Energy: 0.7031652665952879
Energy: 0.7062699948965216
Energy: 0.6987606008555578
Energy: 0.7974766227764426
Energy: 0.6987606008566847
Energy: 0.7109339844311923
Energy: 0.742874701920034
Energy: 0.7390051524838754
Energy: 0.742874701921161
Energy: 0.7032029405562493
Energy: 0.6691410010300888
Energy: 0.7422054960235551
Energy: 0.669141001032855
Energy: 0.8509495626625424
Energy: 0.7960223303763228
Energy: 0.7977564670194485
Energy: 0.7960223303785767

minimum gb energy = 0.6668081881644624 eV
minimum distance =  2.59215618079602 Angstroms
sigma value = 73


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

Energy: 0.8580620981668461
Energy: 0.7601371421538474
Energy: 0.759867221926808
Energy: 0.7601371421538474
Energy: 0.6683923374083096
Energy: 0.6706212027216586
Energy: 0.7518530774205859
Energy: 0.6706212027216586
Energy: 0.668317323759977
Energy: 0.669271600687472
Energy: 0.7531152935089542
Energy: 0.6692716006883661
Energy: 0.666748326687387
Energy: 0.6692561796939986
Energy: 0.8293141694112752
Energy: 0.6692561796931046
Energy: 0.6662614886325068
Energy: 0.6678416098824242
Energy: 0.8265326476170004
Energy: 0.6678416098815302
Energy: 0.6684790586921847
Energy: 0.6676920854532538
Energy: 0.826636425017576
Energy: 0.6676920854523598
Energy: 0.7470319248034292
Energy: 0.747053606441887
Energy: 0.7548918977584418
Energy: 0.7470536064410134
Energy: 0.7477947620315231
Energy: 0.7100660592011849
Energy: 0.7447374255496422
Energy: 0.7100660592011849
Energy: 0.7461589620414691
Energy: 0.7110227810904872
Energy: 0.7568438614046474
Energy: 0.7110227810913812
Energy: 0.6675435200109484
Energy: 0.7115179596763972
Energy: 0.7464061704600913
Energy: 0.7115179596763972
Energy: 0.74452093558552
Energy: 0.7106870915616887
Energy: 0.6705495057032695
Energy: 0.7106870915634768
Energy: 0.756454598666712
Energy: 0.7479899913572315
Energy: 0.8247887986984479
Energy: 0.7479899913670657
Energy: 0.7465103639339336
Energy: 0.6678915474289709
Energy: 0.6681504853856339
Energy: 0.667891547429865
Energy: 0.7506648476529392
Energy: 0.6681518778718449
Energy: 0.6668935442776442
Energy: 0.6681518778718449
Energy: 0.8287162056197659
Energy: 0.6695873140840342
Energy: 0.6671414619110879
Energy: 0.6695873140849282
Energy: 0.826700704226229
Energy: 0.6693022294069529
Energy: 0.6679772970468812
Energy: 0.669302229407847
Energy: 0.8268405899484866
Energy: 0.6681218728232129
Energy: 0.6684149895804459
Energy: 0.668121872824107
Energy: 0.7605745328653879
Energy: 0.7611123351455156
Energy: 0.7469732948095599
Energy: 0.7611123351446216
Energy: 0.744599145766041
Energy: 0.7096506526113294
Energy: 0.7485259746232459
Energy: 0.7096506526122235
Energy: 0.7461308313573385
Energy: 0.7121942367483347
Energy: 0.7490570856148018
Energy: 0.7121942367501227
Energy: 0.7453759286069914
Energy: 0.7142186722329023
Energy: 0.6679238842580967
Energy: 0.7142186722329023
Energy: 0.8240444388101595
Energy: 0.7470313273557976
Energy: 0.7456314580490199
Energy: 0.7470313273566916

minimum gb energy = 0.6662614886325068 eV
minimum distance =  2.57341094851759 Angstroms
sigma value = 7


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

Energy: 1.1880225833349476
Energy: 0.7765077158697914
Energy: 0.7763106445999686
Energy: 0.7765077158685271
Energy: 0.6840680520836123
Energy: 0.6844772229676919
Energy: 0.7552496700972772
Energy: 0.6844772229689561
Energy: 0.6824913646927688
Energy: 0.6841138048756894
Energy: 0.7879069030451609
Energy: 0.684113804878218
Energy: 0.6821942555110575
Energy: 0.6830049573698915
Energy: 0.8257405195310071
Energy: 0.6830049573705237
Energy: 0.6823244644500958
Energy: 0.6827407699483109
Energy: 0.8174746934814229
Energy: 0.682740769948943
Energy: 0.7093158096177157
Energy: 0.6839297976977002
Energy: 0.8162791551037172
Energy: 0.6839297976970682
Energy: 0.7180592522183395
Energy: 0.6847583238052759
Energy: 0.6874389741307859
Energy: 0.6847583238021151
Energy: 0.7565888987781952
Energy: 0.6848931334081075
Energy: 0.6833924438013244
Energy: 0.6848931334087397
Energy: 0.8135673933522243
Energy: 0.6868792247865082
Energy: 0.6855601446396887
Energy: 0.6868792247877725
Energy: 0.7778522234874803
Energy: 0.686082610123617
Energy: 0.6838050990109843
Energy: 0.6860826101217206
Energy: 0.8187925335584832
Energy: 0.705152365188259
Energy: 0.6760560442748528
Energy: 0.7051523651863626
Energy: 0.7785713437002445
Energy: 0.7743687056386388
Energy: 0.7170734399776288
Energy: 0.7743687056373744
Energy: 0.7711533577024827
Energy: 0.7112986825212909
Energy: 0.7210722973032041
Energy: 0.7112986825200266
Energy: 0.7750705257359869
Energy: 0.712502593286247
Energy: 0.7192723768104179
Energy: 0.7125025932868793
Energy: 0.7764852158297622
Energy: 0.6887460718052534
Energy: 0.7169880797449643
Energy: 0.6887460718084142
Energy: 0.687754144165284
Energy: 0.687550732702033
Energy: 0.7141333354351391
Energy: 0.687550732702033
Energy: 0.6879904345023745
Energy: 0.6895743350230628
Energy: 0.7269862167902863
Energy: 0.6895743350230628
Energy: 0.7021520974846837
Energy: 0.7252281783454364
Energy: 0.7894858988648168
Energy: 0.7252281783416435
Energy: 0.7066693381515586
Energy: 0.6713200802705854
Energy: 0.7948047516758272
Energy: 0.6713200802724819
Energy: 0.7033081187127613
Energy: 0.7037740148592324
Energy: 0.7195059115186637
Energy: 0.7037740148573358
Energy: 0.706214953423297
Energy: 0.7028313150742551
Energy: 0.8196889383553835
Energy: 0.7028313150755194
Energy: 0.7555880309104103
Energy: 0.6864169023313506
Energy: 0.6853735759221189
Energy: 0.6864169023326149
Energy: 0.7552881685016382
Energy: 0.6855568352819992
Energy: 0.6850967401163869
Energy: 0.6855568352807349
Energy: 0.8143535901968607
Energy: 0.6849804696910358
Energy: 0.6836294405373362
Energy: 0.6849804696916679
Energy: 0.776622454168244
Energy: 0.6859916766889294
Energy: 0.6848991968603851
Energy: 0.685991676691458
Energy: 0.8222423094975856
Energy: 0.6859349459039146
Energy: 0.6867950082432002
Energy: 0.6859349459032824
Energy: 0.7766498806783452
Energy: 0.7770009158496084
Energy: 1.0382977224750063
Energy: 0.7770009158515051
Energy: 0.7510372260401832
Energy: 0.7228934469350947
Energy: 0.7571136845108111
Energy: 0.7228934469338592
Energy: 0.7578935055971104
Energy: 0.7225281164919573
Energy: 0.7516546873451051
Energy: 0.7225281164919573
Energy: 0.7542313561331914
Energy: 0.7273276157164906
Energy: 0.7191052636875847
Energy: 0.7273276157171228
Energy: 0.6849704719484144
Energy: 0.7523220094698068
Energy: 0.7532188836573731
Energy: 0.7523220094704389

minimum gb energy = 0.6713200802705854 eV
minimum distance =  2.54518383546465 Angstroms
sigma value = 29


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

Energy: 0.6317170129957198
Energy: 0.7472473677931336
Energy: 0.7130552606940288
Energy: 0.7472473677931336
Energy: 0.6509763621768702
Energy: 0.688691828003733
Energy: 0.6470714368920746
Energy: 0.6886918280035128
Energy: 0.6451847676708633
Energy: 0.6766413214362509
Energy: 0.6346037337703477
Energy: 0.6766413214293513
Energy: 0.6383050982218407
Energy: 0.6429518821607374
Energy: 0.6446491327093371
Energy: 0.6429518821588045
Energy: 0.6423783329197231
Energy: 0.6467597258031983
Energy: 0.6364652497091803
Energy: 0.6467597258016814
Energy: 0.6439890882797864
Energy: 0.68343717307878
Energy: 0.6378725555528627
Energy: 0.6834371730783396
Energy: 0.6340024461704596
Energy: 0.6752809286778648
Energy: 0.645080499274814
Energy: 0.6752809286778648
Energy: 0.6465300251149887
Energy: 0.647279453816894
Energy: 0.6418474094370937
Energy: 0.64727945381753
Energy: 0.6362046632721245
Energy: 0.6446233438363127
Energy: 0.6489071846238637
Energy: 0.6446233438332788

minimum gb energy = 0.6317170129957198 eV
minimum distance =  2.58380045635666 Angstroms
sigma value = 5


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

Energy: 0.9440699097171174
Energy: 0.6369592716991284
Energy: 0.7356016993319873
Energy: 0.6369592716949483
Energy: 0.7344713245453469
Energy: 0.6375247486671979
Energy: 0.7484638532920995
Energy: 0.6375247486660035
Energy: 0.740626164743576
Energy: 0.6858192453097869
Energy: 0.7483794159803084
Energy: 0.6858192453062312
Energy: 0.7047738286523042
Energy: 0.6893067018941443
Energy: 0.7249894513555682
Energy: 0.68930670189713
Energy: 0.6943349331512388
Energy: 0.6366120089319951
Energy: 0.7073699151835673
Energy: 0.636612008931398
Energy: 0.6370156101280507
Energy: 0.6396692013562132
Energy: 0.7076156118672806
Energy: 0.6396692013580046
Energy: 0.6351480629149711
Energy: 0.6352683718382951
Energy: 0.7257585329457299
Energy: 0.635268371837698
Energy: 0.64278383719266
Energy: 0.6379113141918733
Energy: 0.7785438720016875
Energy: 0.6379113141954562
Energy: 0.715655324762318
Energy: 0.6517914237136679
Energy: 0.7683377502360786
Energy: 0.6517914237130709
Energy: 0.8180864299175077
Energy: 0.6246303410292774
Energy: 0.6299122192203341
Energy: 0.6246303410286803
Energy: 0.7164501471588357
Energy: 0.6228955583864993
Energy: 0.624514732159734
Energy: 0.6228955583817221
Energy: 0.797595727886198
Energy: 0.6238116859074017
Energy: 0.6265172184145748
Energy: 0.6238116859038187
Energy: 0.8004449052129162
Energy: 0.6225874760411627
Energy: 0.6328594917054697
Energy: 0.6225874760435514
Energy: 0.6587831919623778
Energy: 0.6148461065527022
Energy: 0.7989003590580106
Energy: 0.6148461065544667
Energy: 0.6733058804127694
Energy: 0.6182173076845441
Energy: 0.7972858764431486
Energy: 0.6182173076881271
Energy: 0.6735188553242946
Energy: 0.6135348995177783
Energy: 0.6501443300970576
Energy: 0.6135348995201669
Energy: 0.6696305908322466
Energy: 0.6161622254249696
Energy: 0.6501617442723087
Energy: 0.6161622254219838
Energy: 0.7509232049123807
Energy: 0.6151194130377183
Energy: 0.6503819126143627
Energy: 0.6151194130383156
Energy: 0.7680889762261213
Energy: 0.6657559346008971
Energy: 0.6600376288166757
Energy: 0.6657559345985086
Energy: 0.7480191553604099
Energy: 0.7112857382926017
Energy: 0.7052138330392621
Energy: 0.7112857382884215
Energy: 0.7076322991257086
Energy: 0.646820967611903
Energy: 0.6526309236733815
Energy: 0.6468209676113059
Energy: 0.7050860077126125
Energy: 0.6418541910629936
Energy: 0.6411475887533311
Energy: 0.6418541910629936
Energy: 0.7445410825420612
Energy: 0.640290596808003
Energy: 0.641196933291398
Energy: 0.6402905968050444
Energy: 0.80127662615285
Energy: 0.6423021343903671
Energy: 0.6476564199437056
Energy: 0.6423021343897699
Energy: 0.7892982931950945
Energy: 0.691969770045185
Energy: 0.6555760087793792
Energy: 0.691969770045185
Energy: 0.6263574918590633
Energy: 0.6200494060217888
Energy: 0.8182595650246156
Energy: 0.6200494060217888
Energy: 0.6226320755809739
Energy: 0.6192756123427979
Energy: 0.6632348586982216
Energy: 0.6192756123451865
Energy: 0.621730802327182
Energy: 0.6193284913995111
Energy: 0.6641381423942888
Energy: 0.6193284914007054
Energy: 0.61839273765716
Energy: 0.6183063888704791
Energy: 0.8045948065947998
Energy: 0.6183063888728676
Energy: 0.7981178915227813
Energy: 0.6482743034720866
Energy: 0.6555255353144512
Energy: 0.6482743034691008
Energy: 0.79517071332802
Energy: 0.6357625877732302
Energy: 0.6385570677007858
Energy: 0.6357625877732302
Energy: 0.7249507933002106
Energy: 0.6356070442699373
Energy: 0.6384423248910618
Energy: 0.6356070442699373
Energy: 0.6427282912311834
Energy: 0.6353253419053234
Energy: 0.6359191471444641
Energy: 0.635325341903532

minimum gb energy = 0.6135348995177783 eV
minimum distance =  2.56399782667647 Angstroms
sigma value = 1


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

Energy: 0.9313294467638995
Energy: 0.6012650374149796
Energy: 0.7090877749464196
Energy: 0.6012650374166308
Energy: 0.6021112868085069
Energy: 0.602071478661553
Energy: 0.7297712067476931
Energy: 0.6020714786648557
Energy: 0.7301679776174627
Energy: 0.6641579972590723
Energy: 0.7325428583521167
Energy: 0.6641579972557697
Energy: 0.6191108151722244
Energy: 0.6648451988421222
Energy: 0.7235208884710244
Energy: 0.6648451988412964
Energy: 0.6009792071153279
Energy: 0.5996039326574215
Energy: 0.7275962929827972
Energy: 0.5996039326590729
Energy: 0.6003911176288229
Energy: 0.601814287033593
Energy: 0.7285003158606821
Energy: 0.6018142870352443
Energy: 0.5978432980589341
Energy: 0.5991150960324575
Energy: 0.7241091258514877
Energy: 0.5991150960349344
Energy: 0.6046432652895812
Energy: 0.6043030649388799
Energy: 0.8233198259156291
Energy: 0.6043030649397055
Energy: 0.7259896958153075
Energy: 0.6244427459527824
Energy: 0.8228577352984665
Energy: 0.624442745953608
Energy: 0.7324379358731926
Energy: 0.6039150368179699
Energy: 0.6166463022666232
Energy: 0.6039150368179699
Energy: 0.7249563611342307
Energy: 0.5994191836041352
Energy: 0.5983613877731274
Energy: 0.5994191836057866
Energy: 0.8214244315497035
Energy: 0.6056299675919699
Energy: 0.6006155687173683
Energy: 0.6056299675944468
Energy: 0.8203392957466804
Energy: 0.5997434648169241
Energy: 0.6002990815554252
Energy: 0.5997434648144471
Energy: 0.7228586515562165
Energy: 0.664381239200064
Energy: 0.7311447799502474
Energy: 0.664381239200064
Energy: 0.6208195983188635
Energy: 0.663352871740499
Energy: 0.7308904745308278
Energy: 0.663352871740499
Energy: 0.6231321463023344
Energy: 0.6008687610273524
Energy: 0.723311998562077
Energy: 0.6008687610265268
Energy: 0.5996912108886634
Energy: 0.6003415806416189
Energy: 0.7308729004844671
Energy: 0.600341580634188
Energy: 0.6043609709658687
Energy: 0.603440967818733
Energy: 0.7218869943507386
Energy: 0.6034409678154303
Energy: 0.598380058771224
Energy: 0.5997263381564376
Energy: 0.8228292989300489
Energy: 0.599726338160566
Energy: 0.6006550961983484
Energy: 0.6077866734556218
Energy: 0.8237016081221791
Energy: 0.6077866734580987
Energy: 0.7282938502748578
Energy: 0.620997038592838
Energy: 0.6011055402503972
Energy: 0.6209970385944892
Energy: 0.729676758997102
Energy: 0.6009759892490675
Energy: 0.6038746557799364
Energy: 0.6009759892490675
Energy: 0.723632440431499
Energy: 0.5996280595292786
Energy: 0.5995257278523594
Energy: 0.5996280595284527
Energy: 0.8203975007810336
Energy: 0.5997570288674596
Energy: 0.599837507897354
Energy: 0.599757028866634

minimum gb energy = 0.5978432980589341 eV
minimum distance =  2.5749902090846 Angstroms
sigma value = 17


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

Energy: 0.9986727862648288
Energy: 0.5993416427321939
Energy: 0.7138095183305778
Energy: 0.599341642727601
Energy: 0.6062009281256233
Energy: 0.5978862151421309
Energy: 0.680632490269425
Energy: 0.5978862151426413
Energy: 0.7442339088626486
Energy: 0.603217395484216
Energy: 0.6990343589581821
Energy: 0.6032173954837056
Energy: 0.7889157201124396
Energy: 0.6250590375385245
Energy: 0.6748633425311364
Energy: 0.6250590375395453
Energy: 0.6623722164694342
Energy: 0.5823859381051355
Energy: 0.791893293810877
Energy: 0.5823859381051355
Energy: 0.5829454288200356
Energy: 0.5819005442517378
Energy: 0.7725302550549438
Energy: 0.5819005442512275
Energy: 0.5831252018274243
Energy: 0.5826305674281717
Energy: 0.6094904499254008
Energy: 0.5826305674291923
Energy: 0.5887135018997348
Energy: 0.5837953853944997
Energy: 0.7791260426891397
Energy: 0.5837953853929686
Energy: 0.7658586833913664
Energy: 0.584077895588202
Energy: 0.7428815501017277
Energy: 0.584077895589733
Energy: 0.7014153804324851
Energy: 0.6276562921363033
Energy: 0.6880885560141842
Energy: 0.627656292137324
Energy: 0.7634962605712557
Energy: 0.5957023003100316
Energy: 0.6063783958487117
Energy: 0.595702300309011
Energy: 0.769804544507549
Energy: 0.5991558472013541
Energy: 0.6749062071490431
Energy: 0.5991558472003333
Energy: 0.7764823786890216
Energy: 0.5951781032719774
Energy: 0.5962015867030018
Energy: 0.5951781032745291
Energy: 0.6952834999909092
Energy: 0.5956938480420061
Energy: 0.597007219668934
Energy: 0.5956938480420061
Energy: 0.7837589666097103
Energy: 0.596898779366758
Energy: 0.6027654163868296
Energy: 0.5968987793677786
Energy: 0.7806856841928295
Energy: 0.5956390613599858
Energy: 0.5985412571107334
Energy: 0.595639061360496
Energy: 0.5961111831464516
Energy: 0.6005685711031302
Energy: 0.6896517094827165
Energy: 0.6005685711204811
Energy: 0.5956521272612558
Energy: 0.5952592606680249
Energy: 0.767053291459294
Energy: 0.595259260666494
Energy: 0.6066104964258443
Energy: 0.5977054164481952
Energy: 0.6767580451408881
Energy: 0.5977054164466642
Energy: 0.596924105054896
Energy: 0.5952492070463713
Energy: 0.6841262312633843
Energy: 0.5952492070427989
Energy: 0.6794032956069548
Energy: 0.5966031938783165
Energy: 0.596354182726312
Energy: 0.5966031938778062
Energy: 0.6992560963389313
Energy: 0.6006135074052252
Energy: 0.7459403680454499
Energy: 0.6006135074057355
Energy: 0.6748270821713473
Energy: 0.6237865855421134
Energy: 0.784891508940894
Energy: 0.6237865855411391
Energy: 0.7961628846814125
Energy: 0.5834304605853269
Energy: 0.6619187665558351
Energy: 0.5834304605858371
Energy: 0.7702250997911728
Energy: 0.5819887946883026
Energy: 0.5820351272541769
Energy: 0.5819887946877923
Energy: 0.6758911426086432
Energy: 0.5833122827453823
Energy: 0.5859644998404394
Energy: 0.5833122827438514
Energy: 0.5884156367838401
Energy: 0.584400585111963
Energy: 0.5903538161595238
Energy: 0.5844005851129837
Energy: 0.6770709711087695
Energy: 0.5834973777874174
Energy: 0.7678858805257159
Energy: 0.5834973777869071
Energy: 0.6816837838886767
Energy: 0.6264610729551049
Energy: 0.6997704574481798
Energy: 0.6264610729551049
Energy: 0.6073968339639956
Energy: 0.5955173086471872
Energy: 0.7620901224370656
Energy: 0.5955173086507595
Energy: 0.6743892222703882
Energy: 0.5958223953910144
Energy: 0.771160766312027
Energy: 0.5958223953915247
Energy: 0.5956375273501647
Energy: 0.5956293802161555
Energy: 0.7727632021475577
Energy: 0.5956293802156453
Energy: 0.5954880653976957
Energy: 0.595122129860127
Energy: 0.6960971200044278
Energy: 0.595122129858596
Energy: 0.6021781573714522
Energy: 0.5980212114109026
Energy: 0.7857004244898609
Energy: 0.598021211408351
Energy: 0.6997106873689094
Energy: 0.6086924574678247
Energy: 0.7948066877292767
Energy: 0.608692457468335
Energy: 0.8977200418912484
Energy: 0.5992775692750901
Energy: 0.596550166669367
Energy: 0.5992775692750901
Energy: 0.764648421854002
Energy: 0.5952022875672793
Energy: 0.5959917216588103
Energy: 0.5952022875677896
Energy: 0.743886275564863
Energy: 0.5986574321323657
Energy: 0.5961390981049243
Energy: 0.5986574321318553

minimum gb energy = 0.5819005442512275 eV
minimum distance =  2.56570165532761 Angstroms
sigma value = 89


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

Energy: 1.05342526393986
Energy: 0.540377052974368
Energy: 0.5420893819092395
Energy: 0.5403770529690268
Energy: 0.5439216057496653
Energy: 0.5887884047756369
Energy: 0.5420006895492806
Energy: 0.5887884047756369
Energy: 0.5360894207574282
Energy: 0.5888326526883535
Energy: 0.5547751185623151
Energy: 0.5888326526870183
Energy: 0.5372524999946003
Energy: 0.5900921449167172
Energy: 0.5408941452590579
Energy: 0.5900921449167172
Energy: 0.5398022590893728
Energy: 0.5398786285174836
Energy: 0.5497355091378152
Energy: 0.5398786285174836
Energy: 0.5409221397767485
Energy: 0.5395037926861355
Energy: 0.5490282717594017
Energy: 0.5395037926861355
Energy: 0.5404040530793628
Energy: 0.5390554015058575
Energy: 0.5417799689007128
Energy: 0.5390554015058575
Energy: 0.5420626293810705
Energy: 0.5421956018969875
Energy: 0.5355980814750804
Energy: 0.5421956018956522
Energy: 0.5437431798324265
Energy: 0.5418838336274675
Energy: 0.5451218488093821
Energy: 0.5418838336261321
Energy: 0.5564933725782689
Energy: 0.5916237442494633
Energy: 0.5431060562123448
Energy: 0.5916237442494633
Energy: 0.5420464936809768
Energy: 0.5833586513119208
Energy: 0.534867152264867
Energy: 0.5833586513105856
Energy: 0.5487947879221783
Energy: 0.5413981432792023
Energy: 0.5422589701132643
Energy: 0.5413981432778671
Energy: 0.5505102798954846
Energy: 0.5408773774562964
Energy: 0.5415341801071695
Energy: 0.5408773774562964
Energy: 0.5414436502706802
Energy: 0.53881843409433
Energy: 0.5390400461728692
Energy: 0.53881843409433
Energy: 0.536237451998647
Energy: 0.5401198362092016
Energy: 0.5438618630684499
Energy: 0.5401198362092016

minimum gb energy = 0.534867152264867 eV
minimum distance =  2.59535704392266 Angstroms
sigma value = 13


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

Energy: 0.9240546034374493
Energy: 0.5208405011900272
Energy: 0.6623493071035484
Energy: 0.5208405016168971
Energy: 0.6026574134558504
Energy: 0.5176003959478892
Energy: 0.6115536511787243
Energy: 0.5176003959534858
Energy: 0.5356910995845778
Energy: 0.5163571848561593
Energy: 0.6164586764462275
Energy: 0.5163571848623155
Energy: 0.7073628361628607
Energy: 0.5195615953608574
Energy: 0.6056012527810616
Energy: 0.5195615953888406
Energy: 0.6090813857014725
Energy: 0.5173550240320892
Energy: 0.6258778386204898
Energy: 0.5173550240399245
Energy: 0.6072542719837569
Energy: 0.5171307193048529
Energy: 0.7158368406329407
Energy: 0.517130719311569
Energy: 0.6071867288670302
Energy: 0.5160559353382245
Energy: 0.6038759626058138
Energy: 0.5160559353393437
Energy: 0.6060651509093185
Energy: 0.5155827107956811
Energy: 0.6146352993871632
Energy: 0.5155827107968005
Energy: 0.5150543070343927
Energy: 0.5175579727222892
Energy: 0.6079637211320628
Energy: 0.5175579727239682
Energy: 0.5151221855541225
Energy: 0.516549905515133
Energy: 0.6064991780944322
Energy: 0.5165499055207295
Energy: 0.5174369701639868
Energy: 0.5167655377862551
Energy: 0.9243012776183228
Energy: 0.5167655377868147
Energy: 0.714910871186966
Energy: 0.5158068073967443
Energy: 0.6072421431354422
Energy: 0.515806807398983
Energy: 0.6188217965524156
Energy: 0.5417410648206871
Energy: 0.6029857655803039
Energy: 0.5417410648173292
Energy: 0.6056824510767488
Energy: 0.54372477457736
Energy: 0.7080657752755678
Energy: 0.5437247745706442
Energy: 0.6133292397931074
Energy: 0.5177862095626177
Energy: 0.6065298081627944
Energy: 0.5177862095682144
Energy: 0.6111634927993704
Energy: 0.5162451884704048
Energy: 0.5187386586419054
Energy: 0.5162451884771209
Energy: 0.7101943222635176
Energy: 0.5169141011533018
Energy: 0.5183514155193555
Energy: 0.5169141011493842
Energy: 0.5180128294657966
Energy: 0.5156943061669772
Energy: 0.5178119741961531
Energy: 0.5156943061720141
Energy: 0.6834834366878898
Energy: 0.5191619251600458
Energy: 0.6024452180494297
Energy: 0.5191619251566877
Energy: 0.7165470854089441
Energy: 0.5155450536071192
Energy: 0.6144774846480101
Energy: 0.5155450536115965
Energy: 0.7070216766948793
Energy: 0.5163915006217555
Energy: 0.6034551000805218
Energy: 0.516391500626233
Energy: 0.7162330978673132
Energy: 0.5507212571579793
Energy: 0.6024381663988033
Energy: 0.5507212571557407
Energy: 0.6100370280635321
Energy: 0.5189588911546992
Energy: 0.7280152505091058
Energy: 0.5189588911502219
Energy: 0.5199044243976428
Energy: 0.5153235248015663
Energy: 0.6062436022794034
Energy: 0.5153235248021258
Energy: 0.6045603237098912
Energy: 0.516329535310897
Energy: 0.6122091296321834
Energy: 0.516329535312576
Energy: 0.5160495382169317
Energy: 0.5154309584073892
Energy: 0.6093628361452433
Energy: 0.5154309584040311
Energy: 0.5159632768318916
Energy: 0.5155266653423349
Energy: 0.7120716084290839
Energy: 0.5155266653428947
Energy: 0.5161485987869394
Energy: 0.5182019617526391
Energy: 0.5209444254938935
Energy: 0.5182019617520794
Energy: 0.7126628405241815
Energy: 0.5172962291413711
Energy: 0.6847513124496917
Energy: 0.5172962291396921
Energy: 0.6136675223677945
Energy: 0.5440442783423144
Energy: 0.7106340376918397
Energy: 0.544044278344553
Energy: 0.6065105870538062
Energy: 0.5412860579349706
Energy: 0.7076436015329386
Energy: 0.5412860579366495
Energy: 0.6098226130712151
Energy: 0.5163597093580902
Energy: 0.7102105478442872
Energy: 0.5163597093608885
Energy: 0.6139157259235741
Energy: 0.5179417068358407
Energy: 0.5265460068862299
Energy: 0.5179417068308036
Energy: 0.7108994258949671
Energy: 0.5157730428193092
Energy: 0.5158495645546555
Energy: 0.515773042823227
Energy: 0.6834578541029386
Energy: 0.5163006869586524
Energy: 0.5195275273464746
Energy: 0.5163006869625701

minimum gb energy = 0.5150543070343927 eV
minimum distance =  2.59771846886049 Angstroms
sigma value = 37


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

Energy: 0.8981659026507337
Energy: 0.48457898177537784
Energy: 0.4844594878979096
Energy: 0.4845789817715263
Energy: 0.7698604121758525
Energy: 0.48307521848994567
Energy: 0.6372743077985038
Energy: 0.48307521849090856
Energy: 0.6994306384602116
Energy: 0.48218738220379315
Energy: 0.6340238499554015
Energy: 0.4821873822018674
Energy: 0.6993673506062821
Energy: 0.537006018504933
Energy: 0.6335690048696161
Energy: 0.537006018504933
Energy: 0.61740810578006
Energy: 0.47001290167480436
Energy: 0.7015729237386136
Energy: 0.4700129016690271
Energy: 0.6218564025903626
Energy: 0.46982926015646725
Energy: 0.6221285358785023
Energy: 0.469829260158393
Energy: 0.5534339046609504
Energy: 0.46993309898524144
Energy: 0.7635861715507892
Energy: 0.46993309898430047
Energy: 0.5547617448133626
Energy: 0.46898842267615176
Energy: 0.705258909482251
Energy: 0.46898842267711466
Energy: 0.5461521097673369
Energy: 0.47069441170831516
Energy: 0.7025814149166973
Energy: 0.47069441170735227
Energy: 0.5460364258929031
Energy: 0.4671390746820884
Energy: 0.7626312168660669
Energy: 0.4671390746820884
Energy: 0.5791012878476388
Energy: 0.5787530068487688
Energy: 0.7947600822753421
Energy: 0.5787530068487688
Energy: 0.6954642652422954
Energy: 0.46704091263547004
Energy: 0.7623690508454843
Energy: 0.46704091263547004
Energy: 0.6972478196385988
Energy: 0.46668591028905554
Energy: 0.7768094962617258
Energy: 0.4666859102880926
Energy: 0.6954888694278971
Energy: 0.5186524252016583
Energy: 0.7004131517669567
Energy: 0.5186524252026213
Energy: 0.7015729237386136
Energy: 0.5178384830623413
Energy: 0.6216921596297605
Energy: 0.5178384830613784
Energy: 0.7657956094454178
Energy: 0.5178591663472544
Energy: 0.47096626406614045
Energy: 0.5178591663482172
Energy: 0.7669287771560238
Energy: 0.5169299488407901
Energy: 0.553160173439419
Energy: 0.5169299488417529
Energy: 0.7052589095438534
Energy: 0.4897445669063234
Energy: 0.4891671560200489
Energy: 0.4897445669072863
Energy: 0.7025814149917582
Energy: 0.4846101709491648
Energy: 0.48310713991416276
Energy: 0.48461017094723907
Energy: 0.698326351987663
Energy: 0.48371160331380153
Energy: 0.4885340111500025
Energy: 0.48371160331380153

minimum gb energy = 0.4666859102880926 eV
minimum distance =  2.58708995372121 Angstroms
sigma value = 25


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

Energy: 0.9552600303911432
Energy: 0.4231752017920866
Energy: 0.5874645681151325
Energy: 0.4231752018153608
Energy: 0.7620151019991707
Energy: 0.42101822458605903
Energy: 0.5423281583044894
Energy: 0.4210182245868109
Energy: 0.8597212058288766
Energy: 0.4200156013610504
Energy: 0.5440921258862058
Energy: 0.4200156013618022
Energy: 0.6626776722737658
Energy: 0.42146601131006245
Energy: 0.5415228784959535
Energy: 0.4214660113093106
Energy: 0.6692773124298785
Energy: 0.4625080092369608
Energy: 0.7682750980454318
Energy: 0.4625080092377126
Energy: 0.6630205779367536
Energy: 0.4598450925925721
Energy: 0.7637467689064403
Energy: 0.4598450925925721
Energy: 0.6639663062463865
Energy: 0.4623209915440044
Energy: 0.6689864632061933
Energy: 0.4623209915440044
Energy: 0.5416924361848826
Energy: 0.4214823030216371
Energy: 0.7665785697755884
Energy: 0.4214823030223889
Energy: 0.5443631767698224
Energy: 0.42018452171738413
Energy: 0.7617348790495975
Energy: 0.42018452171512843
Energy: 0.5453895653587436
Energy: 0.4209649031337293
Energy: 0.7626359761590561
Energy: 0.42096490313222557
Energy: 0.42070260923835767
Energy: 0.4212124368195095
Energy: 0.8092405304680882
Energy: 0.42121243682026144
Energy: 0.42332998967343066
Energy: 0.4212286899172019
Energy: 0.7625106644591658
Energy: 0.42122868991644996
Energy: 0.42178774588972556
Energy: 0.4228827570486938
Energy: 0.6632110192540972
Energy: 0.4228827570486938
Energy: 0.4298011201792358
Energy: 0.4211512543211606
Energy: 0.8562028340209986
Energy: 0.42115125431439365
Energy: 0.5433035267858722
Energy: 0.4198859886494854
Energy: 0.6701028703232385
Energy: 0.41988598864873355
Energy: 0.5467337749296011
Energy: 0.420969306993382
Energy: 0.862321967007114
Energy: 0.4209693069941338
Energy: 0.6693661718644643
Energy: 0.4218791468950875
Energy: 0.8666213907635725
Energy: 0.42187914689659123
Energy: 0.5423482270669567
Energy: 0.4630686567911013
Energy: 0.6692029254696925
Energy: 0.4630686567926051
Energy: 0.7615845366547549
Energy: 0.4602986695660952
Energy: 0.6639157268293225
Energy: 0.4602986695645914
Energy: 0.669467194269872
Energy: 0.460298536768834
Energy: 0.6630516651641652
Energy: 0.460298536768834
Energy: 0.8101542664384583
Energy: 0.4225033106788808
Energy: 0.5465551986042657
Energy: 0.4225033106788808
Energy: 0.7623516296221031
Energy: 0.4197387116402676
Energy: 0.4211857741001707
Energy: 0.4197387116402676
Energy: 0.760685650216294
Energy: 0.42247149983197674
Energy: 0.5413544069881975
Energy: 0.42247149983122484
Energy: 0.7658668914975008
Energy: 0.42183303293618224
Energy: 0.42643118184901646
Energy: 0.42183303293242286
Energy: 0.6703697907863952
Energy: 0.42022328465120695
Energy: 0.420392286866256
Energy: 0.42022328465120695
Energy: 0.861942548183019
Energy: 0.4214988000744838
Energy: 0.4250694833026724
Energy: 0.4214988000744838

minimum gb energy = 0.4197387116402676 eV
minimum distance =  2.60748894403408 Angstroms
sigma value = 41


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

Energy: 1.0590562643866923
Energy: 0.38628899423697977
Energy: 0.5598142056970498
Energy: 0.3862890166856846
Energy: 0.8419223165575287
Energy: 0.3845939649462808
Energy: 0.4838815369175103
Energy: 0.3845939649456644
Energy: 0.9260094031333114
Energy: 0.38345416712793473
Energy: 0.48621089202433565
Energy: 0.38345416712916763
Energy: 0.7649899383148516
Energy: 0.38579410636093314
Energy: 0.5936022599142655
Energy: 0.38579410636154954
Energy: 0.7649362371318675
Energy: 0.38277267230210216
Energy: 0.6737311862119519
Energy: 0.3827726723212112
Energy: 0.7605966422480496
Energy: 0.49953803623867066
Energy: 0.6744380160154165
Energy: 0.4995380362392871
Energy: 0.7639528260214752
Energy: 0.4181273356429568
Energy: 0.7652622506303022
Energy: 0.4181273356404911
Energy: 0.6798764044202599
Energy: 0.4176021109035361
Energy: 0.6737315689194274
Energy: 0.41760211095775307
Energy: 0.5831299045614804
Energy: 0.498177342827908
Energy: 0.8430983333788507
Energy: 0.49817734282852444
Energy: 0.5847987226675752
Energy: 0.3828900101984247
Energy: 0.7665439193102095
Energy: 0.3828900101971919
Energy: 0.4924528624432514
Energy: 0.38787722892051196
Energy: 0.9334609428406222
Energy: 0.38787722892112836
Energy: 0.4823679480655346
Energy: 0.3828731339981989
Energy: 0.8424658169770544
Energy: 0.3828731339988153
Energy: 0.4844427223648327
Energy: 0.38625135119756865
Energy: 0.8419351518848014
Energy: 0.38625135119756865
Energy: 0.3914496608522213
Energy: 0.3860941116010055
Energy: 0.8501842154853321
Energy: 0.3860941116022383
Energy: 0.3838468958105154
Energy: 0.38388800654201355
Energy: 0.7651223256929576
Energy: 0.38388800654260197
Energy: 0.38826580664008165
Energy: 0.38520430901974895
Energy: 0.9279924476093709
Energy: 0.38520430902098174
Energy: 0.4901099382005124
Energy: 0.3866134248173843
Energy: 0.9302824573735183
Energy: 0.38661342481615146
Energy: 0.481188482193675
Energy: 0.3830721125246826
Energy: 0.7629136481921103
Energy: 0.38307211252591544
Energy: 0.48518200842289805
Energy: 0.38558912931141265
Energy: 0.7623815096049457
Energy: 0.385589129308947
Energy: 0.6744669713559249
Energy: 0.3841864873771109
Energy: 0.7612696223323775
Energy: 0.3841864873777273
Energy: 0.6926557088588918
Energy: 0.38679843488544136
Energy: 0.7629255724107986
Energy: 0.38679843488544136
Energy: 0.6743950352388469
Energy: 0.41679186357747744
Energy: 0.7655519343569116
Energy: 0.4167918635817644
Energy: 0.8436771418516921
Energy: 0.41595830494039315
Energy: 0.7584767388657987
Energy: 0.415958304941626
Energy: 0.6732167566216629
Energy: 0.4172189059367469
Energy: 0.6745096017837549
Energy: 0.4172189059348977
Energy: 0.8418997749431978
Energy: 0.3845733608913629
Energy: 0.5774657591858823
Energy: 0.3845733608907465
Energy: 0.8435764460085026
Energy: 0.38407222708143374
Energy: 0.6723704886033629
Energy: 0.38407222708081734
Energy: 0.8467368172029366
Energy: 0.3860542439786425
Energy: 0.4857951086634561
Energy: 0.38605424397987537
Energy: 0.7644696010652471
Energy: 0.38340979413651066
Energy: 0.48020267797205723
Energy: 0.38340979413712706
Energy: 0.8460884061462081
Energy: 0.38671937045682686
Energy: 0.4893960661434192
Energy: 0.3867193704562104
Energy: 0.8444203126446654
Energy: 0.38526049567457377
Energy: 0.3850662425420689
Energy: 0.38526049567457377
Energy: 0.763498959390486
Energy: 0.3838384065634234
Energy: 0.3833136066809395
Energy: 0.38383840656465623
Energy: 0.9198662815162495
Energy: 0.3855227343746879
Energy: 0.3907529856753347
Energy: 0.3855227344018105

minimum gb energy = 0.38277267230210216 eV
minimum distance =  2.60718734351884 Angstroms
sigma value = 15


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

Energy: 0.9101051809913838
Energy: 0.36036690735445215
Energy: 0.5371044572209913
Energy: 0.3603668842716707
Energy: 0.8969133605813295
Energy: 0.35618754462182045
Energy: 0.44375839267369693
Energy: 0.35618754462338703
Energy: 0.9715087656002106
Energy: 0.35594310495963344
Energy: 0.44226713817724767
Energy: 0.3559431049565002
Energy: 0.8352215213290478
Energy: 0.3581575743753792
Energy: 0.6114446394202859
Energy: 0.3581575743727682
Energy: 0.8301122821787607
Energy: 0.35415015772361713
Energy: 0.6031559178691116
Energy: 0.35415015772309494
Energy: 0.82950962104191
Energy: 0.360647118142408
Energy: 0.6048530443625549
Energy: 0.36064711815285194
Energy: 0.6832172395210235
Energy: 0.35861686124245706
Energy: 0.7549330409366554
Energy: 0.3586168609574334
Energy: 0.7599110031658326
Energy: 0.3857833778741393
Energy: 0.601972012106904
Energy: 0.3857833778762281
Energy: 0.6819794979909131
Energy: 0.5541150859127021
Energy: 0.753664917238531
Energy: 0.5541150859106133
Energy: 0.6802783394349097
Energy: 0.46386734728974305
Energy: 0.8329740379582865
Energy: 0.4638673472881764
Energy: 0.6109682015210851
Energy: 0.35729184095746575
Energy: 0.8082431729587055
Energy: 0.3572918409548547
Energy: 0.5199103317460055
Energy: 0.36035727578657795
Energy: 0.8976150987989273
Energy: 0.3603572757944109
Energy: 0.6046205048438893
Energy: 0.35489106629972694
Energy: 0.8994423682281506
Energy: 0.3548910662981603
Energy: 0.4479461098818656
Energy: 0.35817924113327265
Energy: 0.7603716306574066
Energy: 0.35817924113327265
Energy: 0.4368383085785587
Energy: 0.3547226530658592
Energy: 0.8303863594694999
Energy: 0.3547226530648148
Energy: 0.4442722910036306
Energy: 0.35693905676425736
Energy: 0.9004916487144519
Energy: 0.356939056763213
Energy: 0.36086734972226914
Energy: 0.3566634501889395
Energy: 0.9041078934175661
Energy: 0.35666345018789514
Energy: 0.35558165742537834
Energy: 0.3549008115026743
Energy: 0.8299248215188401
Energy: 0.3549008115026743
Energy: 0.3592891903026506
Energy: 0.35808015033032903
Energy: 0.8313256420117591
Energy: 0.35808015032876245
Energy: 0.44630561230732013
Energy: 0.35858945594389285
Energy: 0.9742214487016981
Energy: 0.35858945594702607
Energy: 0.435567814680107
Energy: 0.35476447754869683
Energy: 0.8299535560506884
Energy: 0.354764477546608
Energy: 0.4469756851488547
Energy: 0.3572997324077511
Energy: 0.8339132890345387
Energy: 0.3572997324082733
Energy: 0.6047016551895855
Energy: 0.3551351253008869
Energy: 0.8268482757240477
Energy: 0.3551351253071533
Energy: 0.6018907670186799
Energy: 0.3601224138293086
Energy: 0.898035619622346
Energy: 0.3601224138313974
Energy: 0.6097240266586635
Energy: 0.35731737077193243
Energy: 0.7047026684647425
Energy: 0.3573173707651439
Energy: 0.7554904808306618
Energy: 0.4650205569720755
Energy: 0.8340316883875446
Energy: 0.4650205569725977
Energy: 0.6024612725365507
Energy: 0.3834479224143982
Energy: 0.7542048425858545
Energy: 0.38344792241335385
Energy: 0.7589806588885855
Energy: 0.3855591279823502
Energy: 0.6875086129645219
Energy: 0.3855591280183342
Energy: 0.7568697880498986
Energy: 0.35742318746079266
Energy: 0.7553217178088455
Energy: 0.35742318749421315
Energy: 0.755730093986964
Energy: 0.3616508162085557
Energy: 0.6047729287427681
Energy: 0.36165081621638867
Energy: 0.8292746813223321
Energy: 0.3545297058054791
Energy: 0.519934304536176
Energy: 0.35452970581278986
Energy: 0.7609546920472524
Energy: 0.3576314548830347
Energy: 0.6102374533399575
Energy: 0.3576314548840791
Energy: 0.8996600187031336
Energy: 0.356121791845677
Energy: 0.44262505266464236
Energy: 0.35612179184776577
Energy: 0.8969538235751269
Energy: 0.3555169240033335
Energy: 0.43996053758328957
Energy: 0.35551692400542234
Energy: 0.9087525437416322
Energy: 0.35767548133586236
Energy: 0.36352275697634273
Energy: 0.35767548133277666
Energy: 0.8968778658898567
Energy: 0.3576928306399712
Energy: 0.3584028818553364
Energy: 0.35769283064049345
Energy: 0.9691419363956251
Energy: 0.3586708068727631
Energy: 0.35692861048794694
Energy: 0.35867080687432973

minimum gb energy = 0.35415015772309494 eV
minimum distance =  2.61174419614129 Angstroms
sigma value = 85


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

Energy: 0.9748698340520962
Energy: 0.3220504860289591
Energy: 0.32152944090562346
Energy: 0.3220504860398287
Energy: 0.8682172509422594
Energy: 0.3196196504257425
Energy: 0.3916086629333187
Energy: 0.31961965042528956
Energy: 0.8645999444133813
Energy: 0.31933952017785083
Energy: 0.39579214413246855
Energy: 0.31933952017785083
Energy: 0.7329879561883471
Energy: 0.32114871545359613
Energy: 0.5375004212869239
Energy: 0.3211487154531433
Energy: 0.867348338412792
Energy: 0.31852017108403113
Energy: 0.5357710899458316
Energy: 0.3185201710853692
Energy: 0.7354644299419512
Energy: 0.31904213064671955
Energy: 0.5391890526490768
Energy: 0.31904213064536086
Energy: 0.7343020122412223
Energy: 0.3191081093142599
Energy: 0.6747024109753355
Energy: 0.31910810931516576
Energy: 0.8052815006773957
Energy: 0.31970736594411675
Energy: 0.5334258660830632
Energy: 0.3197073659463812
Energy: 0.7382774182769684
Energy: 0.3185726849528224
Energy: 0.6713608140911523
Energy: 0.31857268495101076
Energy: 0.7379795174011626
Energy: 0.506843955638292
Energy: 0.7994583412858172
Energy: 0.506843955637839
Energy: 0.6769400482018462
Energy: 0.42815536591725656
Energy: 0.7063300085792891
Energy: 0.4281553659168036
Energy: 0.6082502455536435
Energy: 0.31943098611266746
Energy: 0.8000839369881437
Energy: 0.31943098620275356
Energy: 0.6708793627424426
Energy: 0.3201369717310247
Energy: 0.8001451451157198
Energy: 0.3201369717332892
Energy: 0.5378223019327769
Energy: 0.3196800723611366
Energy: 0.6689222238031587
Energy: 0.3196800723615895
Energy: 0.45788032762710545
Energy: 0.3185858937516943
Energy: 0.8666100773391168
Energy: 0.31858589375124136
Energy: 0.5410945452555094
Energy: 0.3197835634929195
Energy: 0.8014825303248804
Energy: 0.31978356349382525
Energy: 0.39861756598593456
Energy: 0.3201389984096142
Energy: 0.7989788740708779
Energy: 0.3201389984109729
Energy: 0.388865722574845
Energy: 0.3185070420951894
Energy: 0.8665860367628997
Energy: 0.31850704209609515
Energy: 0.3935018246650045
Energy: 0.32004012737795157
Energy: 0.8641188687340878
Energy: 0.32004012737795157
Energy: 0.3216302078427123
Energy: 0.322180357575991
Energy: 0.8656672104914296
Energy: 0.322180357575991
Energy: 0.3191937900330397
Energy: 0.3188260208300613
Energy: 0.8673663236348504
Energy: 0.31882602082960837
Energy: 0.32142768141491496
Energy: 0.3205032341370823
Energy: 0.8619817532577536
Energy: 0.32050323414342297
Energy: 0.3968912478638262
Energy: 0.32017886387920824
Energy: 0.8630674617961674
Energy: 0.3201788638787554
Energy: 0.39059254852734426
Energy: 0.31850876580996484
Energy: 0.8674942201431832
Energy: 0.3185087658104178
Energy: 0.39332024626878753
Energy: 0.3195349029184144
Energy: 0.7333966942444434
Energy: 0.3195349029270195
Energy: 0.5384367820435771
Energy: 0.3187983041842753
Energy: 0.8653362147279656
Energy: 0.3187983042222984
Energy: 0.5365169777042734
Energy: 0.31857474725572216
Energy: 0.8637131296829522
Energy: 0.31857474725526924
Energy: 0.5379003782532137
Energy: 0.3201463840050881
Energy: 0.7343471281191809
Energy: 0.3201463840041823
Energy: 0.6740678057350912
Energy: 0.31881531112048833
Energy: 0.8682138137822333
Energy: 0.3188153111182238
Energy: 0.67174354282263
Energy: 0.5048877347985196
Energy: 0.7354692749175162
Energy: 0.5048877347985196
Energy: 0.7422917273031321
Energy: 0.36654844336692394
Energy: 0.6068879447526284
Energy: 0.36654844336692394
Energy: 0.6700031617355875
Energy: 0.3662433278450176
Energy: 0.7408947994973792
Energy: 0.3662433277888785
Energy: 0.8007047359478493
Energy: 0.504695004886337
Energy: 0.6048405714368816
Energy: 0.5046950048854313
Energy: 0.8689739779385366
Energy: 0.3187695326001761
Energy: 0.6056064526443822
Energy: 0.3187695326372934
Energy: 0.6689821095895528
Energy: 0.31944193536285936
Energy: 0.5376562922920075
Energy: 0.3194419353375175
Energy: 0.9267651321469418
Energy: 0.3186001141044232
Energy: 0.5357938203231161
Energy: 0.3186001141048761
Energy: 0.9267511447643122
Energy: 0.318981465687179
Energy: 0.5384224309697481
Energy: 0.31898146568536734
Energy: 0.7987198303204552
Energy: 0.3218664195304659
Energy: 0.393616311451419
Energy: 0.321866419530013
Energy: 0.8676149826208266
Energy: 0.31855807703618544
Energy: 0.39015837908474243
Energy: 0.31855807703663835
Energy: 0.8646041189897199
Energy: 0.3204489383517517
Energy: 0.39713211554849176
Energy: 0.320448938350393
Energy: 0.7978943761908883
Energy: 0.3195485110622552
Energy: 0.3184149024970698
Energy: 0.31954851106316096
Energy: 0.8668425855060385
Energy: 0.31880171534621177
Energy: 0.3188535776457027
Energy: 0.31880171534621177
Energy: 0.8618780089301464
Energy: 0.31983382196020194
Energy: 0.3210681476967717
Energy: 0.319833821959749

minimum gb energy = 0.3184149024970698 eV
minimum distance =  2.61106778653612 Angstroms
sigma value = 113


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

Energy: 0.01346226210659856
Energy: 0.2597924237542951
Energy: 0.7482814234082912
Energy: 0.25979242375497213
Energy: 0.5534500907313454
Energy: 0.07086912107654746
Energy: 0.5536513276286336
Energy: 0.07086912107654746
Energy: 0.01402228174525332
Energy: 0.06967959178948824
Energy: 0.5529552432025348
Energy: 0.06967959178778609
Energy: 0.01489339219283275
Energy: 0.07189555046669079
Energy: 0.5559064858865158
Energy: 0.0718955504663426
Energy: 0.5548152022685464
Energy: 0.07085456822739888
Energy: 0.555531273976215
Energy: 0.07085456823012617
Energy: 0.014039098515486318
Energy: 0.06956225599144467
Energy: 0.5527880037238285
Energy: 0.06956225599246983

minimum gb energy = 0.01346226210659856 eV
minimum distance =  2.84935028100891 Angstroms
sigma value = 1