Model name: model_name=MEAM_LAMMPS_KoShimLee_2011_AlH__MO_127847080751_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.044650807976723
cohesive_energy=3.360264280659711
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010384128094931267
Energy: 0.010868544780454509
Energy: 0.7158847750657945
Energy: 0.010868544780454509
Energy: 0.010868544780454509
Energy: 0.5098374027825423
Energy: 0.010868544780454509
Energy: 0.5098374027825423
Energy: 0.7158847750657945
Energy: 0.010868544780454509
Energy: 0.010384128094931267
Energy: 0.010868544780454509
Energy: 0.010868544780454509
Energy: 0.5098374027820691
Energy: 0.010868544780454509
Energy: 0.5098374027825423

minimum gb energy = 0.010384128094931267 eV
minimum distance =  2.70790585917735 Angstroms
sigma value = 1


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

Energy: 0.5704534576167908
Energy: 0.561782364651786
Energy: 0.5993765564222152
Energy: 0.5617823646523936
Energy: 0.5595525654677541
Energy: 0.5699692967362262
Energy: 0.5405121520353211
Energy: 0.5699692967356185
Energy: 0.5398599762723604
Energy: 0.5539290052810572
Energy: 0.5533685636787962
Energy: 0.5539290052810572
Energy: 0.543148152985726
Energy: 0.573006619900538
Energy: 0.5444400363811223
Energy: 0.5730066199011458
Energy: 0.5448644764646865
Energy: 0.5657697987371513
Energy: 0.552108754378699
Energy: 0.5657697987371513
Energy: 0.5390909986567913
Energy: 0.6251904910772624
Energy: 0.5356864475836272
Energy: 0.6251904910766548
Energy: 0.5609103113579094
Energy: 0.5521691833274873
Energy: 0.5394762226742957
Energy: 0.5521691833274873
Energy: 0.524212308184708
Energy: 0.5659087523633155
Energy: 0.5368641628780094
Energy: 0.5659087523633155
Energy: 0.5442310974706588
Energy: 0.5506992942643311
Energy: 0.5515418271550732
Energy: 0.5506992942649387
Energy: 0.5396394739034805
Energy: 0.5532121005407914
Energy: 0.5248011635481332
Energy: 0.5532121005401838
Energy: 0.5424192748412001
Energy: 0.5680346006941598
Energy: 0.5441830653940698
Energy: 0.5680346006947675
Energy: 0.5754032177972837
Energy: 0.565850406632232
Energy: 0.5447671089073713
Energy: 0.5658504066328396
Energy: 0.5394736083652674
Energy: 0.5541550289616164
Energy: 0.561315545311949
Energy: 0.554155028962224
Energy: 0.5520909366238451
Energy: 0.5620495813958232
Energy: 0.5431409077865672
Energy: 0.5620495813958232
Energy: 0.5521246403091733
Energy: 0.5668523589867159
Energy: 0.548360016497819
Energy: 0.5668523589873236
Energy: 0.55588016345714
Energy: 0.5619179919618812
Energy: 0.5522130804846838
Energy: 0.5619179919618812
Energy: 0.5539307952167106
Energy: 0.5538444740319437
Energy: 0.5306805684796331
Energy: 0.5538444740319437
Energy: 0.5405276532178726
Energy: 0.562393314447925
Energy: 0.5729046724336339
Energy: 0.562393314447925
Energy: 0.5730266715288149
Energy: 0.5641812677162702
Energy: 0.5457607374471877
Energy: 0.5641812677168779
Energy: 0.5514881978136436
Energy: 0.6248537830043008
Energy: 0.5452554281523094
Energy: 0.6248537830049085
Energy: 0.5401327180550044
Energy: 0.5538176326035466
Energy: 0.5296380555173347
Energy: 0.5538176326035466
Energy: 0.5443434860106394
Energy: 0.6363566784294847
Energy: 0.551968971140365
Energy: 0.6363566784294847
Energy: 0.5524891363226778
Energy: 0.568371801467666
Energy: 0.5340028325415626
Energy: 0.568371801467666
Energy: 0.5481501354896133
Energy: 0.5535427480523777
Energy: 0.5390739256948237
Energy: 0.55354274805177
Energy: 0.5395079663678909
Energy: 0.6273257595319146
Energy: 0.5617586109048276
Energy: 0.627325759531307
Energy: 0.5467690581391068
Energy: 0.5657783968119384
Energy: 0.5450431242292937
Energy: 0.5657783968131538
Energy: 0.556753066018762
Energy: 0.6220769415980729
Energy: 0.5441008775618353
Energy: 0.6220769415974653
Energy: 0.5361790104853075
Energy: 0.5521743127605774
Energy: 0.5596975156450764
Energy: 0.5521743127605774
Energy: 0.5588521214001274
Energy: 0.566902436232671
Energy: 0.5511714966674855
Energy: 0.5669024362320634
Energy: 0.5708547234830085
Energy: 0.5624348407806753
Energy: 0.575766995842288
Energy: 0.562434840781283
Energy: 0.5547238618632652
Energy: 0.5605325142193491
Energy: 0.5395391818563748
Energy: 0.5605325142193491
Energy: 0.5461840021622405
Energy: 0.5563171596238466
Energy: 0.5520086726725604
Energy: 0.5563171596244543
Energy: 0.5447223753420176
Energy: 0.5746229590166969
Energy: 0.5460742677860129
Energy: 0.5746229590166969

minimum gb energy = 0.524212308184708 eV
minimum distance =  2.57595628834548 Angstroms
sigma value = 1


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

Energy: 0.5947417169492473
Energy: 0.604041048068621
Energy: 0.6138302965112604
Energy: 0.6040410480700067
Energy: 0.5747315729261195
Energy: 0.5943228782580748
Energy: 0.5582324046978271
Energy: 0.5943228782594605
Energy: 0.5695493805377064
Energy: 0.6069258866789387
Energy: 0.5895482926054246
Energy: 0.6069258866796314
Energy: 0.5601616470451956
Energy: 0.6035234375080377
Energy: 0.5582137983184619
Energy: 0.6035234375080377
Energy: 0.5602429511158651
Energy: 0.5898794276777001
Energy: 0.5740613681049778
Energy: 0.5898794276777001
Energy: 0.6041013771384172
Energy: 0.5913333175578248
Energy: 0.5685851745136357
Energy: 0.5913333175578248
Energy: 0.5747560939607723
Energy: 0.6623126900219641
Energy: 0.5648459656557228
Energy: 0.6623126900219641
Energy: 0.5457429781440561
Energy: 0.6049585291301323
Energy: 0.5626926179117524
Energy: 0.6049585291301323
Energy: 0.5598085481766256
Energy: 0.6711851649501093
Energy: 0.5475199581641161
Energy: 0.6711851649480309
Energy: 0.5651164951689465
Energy: 0.6048987212316216
Energy: 0.579146740450906
Energy: 0.6048987212309287
Energy: 0.5749048110146202
Energy: 0.585609870402713
Energy: 0.558357784892013
Energy: 0.585609870402713
Energy: 0.5524783224130599
Energy: 0.5963180914141988
Energy: 0.5897680984053391
Energy: 0.5963180914148917
Energy: 0.5797296651257391
Energy: 0.5875514937238286
Energy: 0.564685304816527
Energy: 0.5875514937231359
Energy: 0.5797467176779338
Energy: 0.5875431137778503
Energy: 0.5769698813974568
Energy: 0.5875431137771576
Energy: 0.5525206792164724
Energy: 0.5963136450040479
Energy: 0.5712614100446708
Energy: 0.5963136450047409
Energy: 0.5748496156590546
Energy: 0.5858754902120624
Energy: 0.558215218675647
Energy: 0.5858754902120624
Energy: 0.565114967613348
Energy: 0.6048945649325647
Energy: 0.5596940314087792
Energy: 0.6048945649332576
Energy: 0.5598188905224406
Energy: 0.6712320853842594
Energy: 0.5475405893555829
Energy: 0.6712320853870307
Energy: 0.5457284438653914
Energy: 0.6067858103503264
Energy: 0.5610137947016578
Energy: 0.6067858103496336
Energy: 0.5747433963045209
Energy: 0.6591868855604809
Energy: 0.5608881610060227
Energy: 0.6591868855611736
Energy: 0.6064023876141186
Energy: 0.5898456353693494
Energy: 0.5537024883046863
Energy: 0.5898456353700422
Energy: 0.560234521313068
Energy: 0.5898678646616295
Energy: 0.5689011819528628
Energy: 0.5898678646623223
Energy: 0.5600778240119128
Energy: 0.603565213368435
Energy: 0.5583131303607695
Energy: 0.6035652133691279
Energy: 0.5695000649723627
Energy: 0.6068495647438731
Energy: 0.5692222182265277
Energy: 0.6068495647424874
Energy: 0.5747999673876083
Energy: 0.5950305505125476
Energy: 0.5581139329142929
Energy: 0.595030550514626
Energy: 0.5947417169492473
Energy: 0.604041048068621
Energy: 0.6120878349163192
Energy: 0.6040410480700067
Energy: 0.5747315729261195
Energy: 0.5943228782580748
Energy: 0.5582324046978271
Energy: 0.5943228782587678
Energy: 0.5695493805370134
Energy: 0.6069258866789387
Energy: 0.5785537329481855
Energy: 0.6069258866789387
Energy: 0.5601616470445027
Energy: 0.6035234375080377
Energy: 0.5585693971350966
Energy: 0.6035234375080377

minimum gb energy = 0.5457284438653914 eV
minimum distance =  2.52270323355844 Angstroms
sigma value = 25


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

Energy: 0.6085088694163273
Energy: 0.6264357664850229
Energy: 0.676211991592671
Energy: 0.6264357664850229
Energy: 0.5801598728020649
Energy: 0.627595650628166
Energy: 0.5876177691291957
Energy: 0.627595650628166
Energy: 0.5788829331000959
Energy: 0.6525337615023797
Energy: 0.5883737738731425
Energy: 0.6525337615023797
Energy: 0.5878716296528868
Energy: 0.6439574940141054
Energy: 0.5791088029814392
Energy: 0.6439574940132999
Energy: 0.579944714041838
Energy: 0.628158711855455
Energy: 0.58203935794208
Energy: 0.628158711855455
Energy: 0.6379880498977611
Energy: 0.6534119590466657
Energy: 0.5930153950603241
Energy: 0.6534119590466657
Energy: 0.5787499068422777
Energy: 0.6914238008211213
Energy: 0.5936431667092544
Energy: 0.6914238005482191
Energy: 0.6809606732949749
Energy: 0.628145316419457
Energy: 0.5708963051206014
Energy: 0.628145316419457
Energy: 0.5936227258275657
Energy: 0.6093375824247652
Energy: 0.5786967362959168
Energy: 0.6093375824247652
Energy: 0.5979151938412651
Energy: 0.6533731806584288
Energy: 0.5761362611298507
Energy: 0.6533731806576233
Energy: 0.5791626745338676
Energy: 0.6256679386095204
Energy: 0.5856517721395882
Energy: 0.6256679386095204
Energy: 0.5709757109675925
Energy: 0.6265312562571134
Energy: 0.585637331992114
Energy: 0.6265312562571134
Energy: 0.588368775452886
Energy: 0.6452571483397656
Energy: 0.5758328572032935
Energy: 0.6452571483389602
Energy: 0.5938569418958101
Energy: 0.6405310251556428
Energy: 0.5803638135499917
Energy: 0.6405310251564482
Energy: 0.6290342468666269
Energy: 0.6287143343121292
Energy: 0.5699531580452627
Energy: 0.6287143343121292
Energy: 0.5786300432723457
Energy: 0.589303019218521
Energy: 0.5808682445257266
Energy: 0.589303019218521
Energy: 0.5696265156863998
Energy: 0.6525793551338434
Energy: 0.5670843034542846
Energy: 0.6525793551346487
Energy: 0.5789458710646626
Energy: 0.6152792831155971
Energy: 0.5804578489344288
Energy: 0.6152792831155971
Energy: 0.5896912977240314
Energy: 0.6450777778077863
Energy: 0.5808011212452078
Energy: 0.6450777778077863
Energy: 0.5929917550354512
Energy: 0.6535318577904895
Energy: 0.5862253961138224
Energy: 0.6535318577904895
Energy: 0.5912252783371397
Energy: 0.6272840937519804
Energy: 0.5857292173638311
Energy: 0.6272840937519804
Energy: 0.6095565153808878
Energy: 0.6276209006785398
Energy: 0.63590781600406
Energy: 0.6276209006785398
Energy: 0.5787676056029788
Energy: 0.6151230600251884
Energy: 0.5862743611319488
Energy: 0.6151230600251884
Energy: 0.5789220861466824
Energy: 0.6518120487627447
Energy: 0.5970975975256776
Energy: 0.6518120487627447
Energy: 0.5859694527112493
Energy: 0.6244315225104152
Energy: 0.5788388865842118
Energy: 0.6244315225112206

minimum gb energy = 0.5670843034542846 eV
minimum distance =  2.52974267684072 Angstroms
sigma value = 9


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

Energy: 0.6369393747326518
Energy: 0.6950353700141713
Energy: 0.7427410374167521
Energy: 0.6950353700132106
Energy: 0.6237993392380392
Energy: 0.6613825409542827
Energy: 0.6035968956682818
Energy: 0.6613825409552435
Energy: 0.591002480034027
Energy: 0.6835524389741072
Energy: 0.6031081608390312
Energy: 0.6835524389731463
Energy: 0.5963148278263515
Energy: 0.6998312116549001
Energy: 0.5960062464832218
Energy: 0.6998312116549001
Energy: 0.6337085597716261
Energy: 0.6457607088901121
Energy: 0.5974028828035857
Energy: 0.6457607088901121
Energy: 0.59737265735122
Energy: 0.6859697686758652
Energy: 0.6100341794589669
Energy: 0.6859697686758652
Energy: 0.5964868980285392
Energy: 0.5949668579600296
Energy: 0.5955606723552903
Energy: 0.5949668579600296
Energy: 0.6264032344306191
Energy: 0.6860051844883659
Energy: 0.6098943699172462
Energy: 0.6860051844883659
Energy: 0.5963369541594816
Energy: 0.6469688808465451
Energy: 0.6116923109871552
Energy: 0.6469688808465451
Energy: 0.5963666481715957
Energy: 0.6954020075040939
Energy: 0.5973806205983206
Energy: 0.6954020075040939
Energy: 0.5963070129418737
Energy: 0.6813837437107235
Energy: 0.6088877481768236
Energy: 0.6813837437107235
Energy: 0.5964737862305077
Energy: 0.6579608985631074
Energy: 0.6097086382328334
Energy: 0.6579608985631074
Energy: 0.5988402033007222
Energy: 0.6842237252857372
Energy: 0.6181833780833632
Energy: 0.6842237252866978
Energy: 0.6238968869560361
Energy: 0.6707499134803155
Energy: 0.5970791935418032
Energy: 0.6707499134803155
Energy: 0.5991186588986037
Energy: 0.685756277931977
Energy: 0.635144629096685
Energy: 0.685756277931977
Energy: 0.5963292330366418
Energy: 0.695354962037936
Energy: 0.5961140193744124
Energy: 0.695354962037936
Energy: 0.6286205329711734
Energy: 0.6721821203661035
Energy: 0.6031128554457676
Energy: 0.6721821203651427
Energy: 0.6092159024510058
Energy: 0.6958675720281441
Energy: 0.5982174179248526
Energy: 0.6958675720291048
Energy: 0.6100365356691673
Energy: 0.6450894974671048
Energy: 0.6040443073071962
Energy: 0.6450894974671048
Energy: 0.6586993638981528
Energy: 0.683929354967813
Energy: 0.6098404160550943
Energy: 0.683929354967813
Energy: 0.5962969996224595
Energy: 0.6632076873344428
Energy: 0.6100632340761302
Energy: 0.663207687333482

minimum gb energy = 0.591002480034027 eV
minimum distance =  2.57154314578615 Angstroms
sigma value = 25


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

Energy: 0.6035004004403304
Energy: 0.708175752997233
Energy: 0.6798023673890284
Energy: 0.7081757529960448
Energy: 0.5929393937101871
Energy: 0.6015959523631216
Energy: 0.5880182700651414
Energy: 0.6015959522134631
Energy: 0.5880651802281756
Energy: 0.6727878001039708
Energy: 0.5951253688270978
Energy: 0.672787800105159
Energy: 0.6031859921697449
Energy: 0.6585499786548468
Energy: 0.6778935435906828
Energy: 0.6585499786548468
Energy: 0.6761841651182201
Energy: 0.5928188512472952
Energy: 0.6126972397897711
Energy: 0.5928188512472952
Energy: 0.5903461491363486
Energy: 0.7331032778515165
Energy: 0.5886178979387885
Energy: 0.7331032778515165
Energy: 0.6129196566563613
Energy: 0.6571179121092112
Energy: 0.5876584926832171
Energy: 0.6571179121092112
Energy: 0.6726248943681731
Energy: 0.708752748118289
Energy: 0.6033127653333906
Energy: 0.708752748118289
Energy: 0.595212863345197
Energy: 0.6597694619658843
Energy: 0.5931300096671485
Energy: 0.6597694619658843
Energy: 0.694947164753109
Energy: 0.673323638392961
Energy: 0.5902340364981364
Energy: 0.673323638392961
Energy: 0.6292303405966971
Energy: 0.7081449617188034
Energy: 0.7567920661396181
Energy: 0.7081449617188034
Energy: 0.5881728755244888
Energy: 0.6073217451764438
Energy: 0.6890893459448437
Energy: 0.6073217451764438
Energy: 0.6794545712169717
Energy: 0.6730341167621964
Energy: 0.5876017776048607
Energy: 0.6730341167610082
Energy: 0.5878178839226033
Energy: 0.6630564966794027
Energy: 0.6035183223570537
Energy: 0.6630564966794027
Energy: 0.5878683889881623
Energy: 0.7077611349395573
Energy: 0.6719746547966402
Energy: 0.7077611349395573
Energy: 0.5952786502928772
Energy: 0.6730857158224858
Energy: 0.5903568728310664
Energy: 0.6730857158212976
Energy: 0.5951148954748408
Energy: 0.625814321627542
Energy: 0.6873721712313995
Energy: 0.625814321627542

minimum gb energy = 0.5876017776048607 eV
minimum distance =  2.61425333171585 Angstroms
sigma value = 17


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

Energy: 0.6590969553785414
Energy: 0.6609101650010534
Energy: 0.7643161941091317
Energy: 0.6609101650010534
Energy: 0.6847528329273281
Energy: 0.6289731087886242
Energy: 0.600746291174515
Energy: 0.6289731087886242
Energy: 0.6902146244200404
Energy: 0.65800575397168
Energy: 0.6043700531381153
Energy: 0.6580057539710072
Energy: 0.5998162025343757
Energy: 0.6053185364510217
Energy: 0.6497116151251514
Energy: 0.6053185364516946
Energy: 0.702035299268103
Energy: 0.6747510380492482
Energy: 0.6176381513445257
Energy: 0.6747510380499211
Energy: 0.6045591256352234
Energy: 0.6132417347131155
Energy: 0.6856176841504896
Energy: 0.6132417347131155
Energy: 0.6014440383892168
Energy: 0.654586670933092
Energy: 0.6045941431144498
Energy: 0.6545866709324191
Energy: 0.6843420217335277
Energy: 0.6047263663439685
Energy: 0.6045497015267511
Energy: 0.6047263663439685
Energy: 0.6047746036743099
Energy: 0.676897537044412
Energy: 0.6970624239051005
Energy: 0.676897537044412
Energy: 0.7454947940168464
Energy: 0.6324893114845008
Energy: 0.6026687732889752
Energy: 0.6324893114838279
Energy: 0.6005892926841626
Energy: 0.6053914744091197
Energy: 0.6916419583139873
Energy: 0.6053914744097926
Energy: 0.6052603254765265
Energy: 0.6523499121093354
Energy: 0.6061106997605861
Energy: 0.6523499121093354
Energy: 0.6855568390656451
Energy: 0.6051069011342111
Energy: 0.6045768644550511
Energy: 0.6051069011342111
Energy: 0.602584443508505
Energy: 0.609959493881909
Energy: 0.6847474170436862
Energy: 0.6099594718207216
Energy: 0.6523066649098545
Energy: 0.6544707901696797
Energy: 0.6053486925740704
Energy: 0.6544707901696797
Energy: 0.6848146318079882
Energy: 0.6047546700909684
Energy: 0.6997102403245219
Energy: 0.6047546700909684
Energy: 0.6045898793256007
Energy: 0.6429711797165202
Energy: 0.6981617976964862
Energy: 0.6429711797158473
Energy: 0.6837293609523614
Energy: 0.6587724592814203
Energy: 0.6045032921200827
Energy: 0.6587724592814203
Energy: 0.6009879037115409
Energy: 0.6582455707217031
Energy: 0.6457264534319875
Energy: 0.6582455707217031
Energy: 0.600596473470014
Energy: 0.6052732408068713
Energy: 0.6000525294743475
Energy: 0.6052732408068713
Energy: 0.6489127733939972
Energy: 0.6589451419997461
Energy: 0.6905571280496393
Energy: 0.6589451419997461
Energy: 0.6016899539393136
Energy: 0.6886868267228001
Energy: 0.7449865043009191
Energy: 0.6886868267234731
Energy: 0.6997920199532446
Energy: 0.6600620590939937
Energy: 0.5988590896807192
Energy: 0.6600620590939937
Energy: 0.6037798724437425
Energy: 0.6562054331358946
Energy: 0.6833786177767155
Energy: 0.6562054331365675
Energy: 0.6039483892238641
Energy: 0.6581571650779211
Energy: 0.6816759571486666
Energy: 0.6581571650772481
Energy: 0.7027426085222109
Energy: 0.6046548755554837
Energy: 0.5994778754908575
Energy: 0.6046548755561567
Energy: 0.6072656245839767
Energy: 0.6890874707396041
Energy: 0.7680347534291709
Energy: 0.6890874707396041
Energy: 0.6861130500864047
Energy: 0.6130369546361845
Energy: 0.691021903501886
Energy: 0.6130369546348384
Energy: 0.728655154008621
Energy: 0.606243665996566
Energy: 0.601276928358525
Energy: 0.6062436664633699
Energy: 0.6053170871841405
Energy: 0.6779553365766888
Energy: 0.6851885454557832
Energy: 0.6779553365766888

minimum gb energy = 0.5988590896807192 eV
minimum distance =  2.4947362694523 Angstroms
sigma value = 53


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

Energy: 0.5521270153920366
Energy: 0.5523103558400324
Energy: 0.7153857227145878
Energy: 0.5523103558400324
Energy: 0.6722912239647549
Energy: 0.6007772900049985
Energy: 0.6461628257067652
Energy: 0.6007772900049985
Energy: 0.5528697500500488
Energy: 0.5526630717949498
Energy: 0.5738448910831656
Energy: 0.5526630717949498
Energy: 0.5527742955325198
Energy: 0.5526797587458235
Energy: 0.5737704332235476
Energy: 0.5526797587458235
Energy: 0.6723440628422308
Energy: 0.6007696961118726
Energy: 0.6576056430819162
Energy: 0.6007696961134219
Energy: 0.5521270153920366
Energy: 0.5523103558400324
Energy: 0.7742365650049541
Energy: 0.5523103558400324
Energy: 0.6722912239647549
Energy: 0.6007772900034494
Energy: 0.6664083952771243
Energy: 0.6007772900049985
Energy: 0.5528697500515979
Energy: 0.5526630717949498
Energy: 0.6408772512697481
Energy: 0.5526630717949498
Energy: 0.5527742955371674
Energy: 0.5526797587473729
Energy: 0.647685567314463
Energy: 0.5526797587473729
Energy: 0.6723440628422308
Energy: 0.6007696961118726
Energy: 0.6772697174264146
Energy: 0.6007696961134219
Energy: 0.5521270153920366
Energy: 0.5523103558400324
Energy: 0.805808751497329
Energy: 0.5523103558400324
Energy: 0.6722912239647549
Energy: 0.6007772900034494
Energy: 0.6664083952771243
Energy: 0.6007772900049985
Energy: 0.5528697500515979
Energy: 0.5526630717949498
Energy: 0.666721619071868
Energy: 0.5526630717964637

minimum gb energy = 0.5521270153920366 eV
minimum distance =  2.60658453972685 Angstroms
sigma value = 9


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

Energy: 0.6202436152082303
Energy: 0.6288205154448434
Energy: 0.809155255958553
Energy: 0.6288205154442701
Energy: 0.7512358538301268
Energy: 0.6502539653713606
Energy: 0.6342000416376588
Energy: 0.6502539653713606
Energy: 0.6277807503197956
Energy: 0.6145588175808883
Energy: 0.6377501802828021
Energy: 0.6145588175797415
Energy: 0.7029316735009667
Energy: 0.7304250510100497
Energy: 0.6351045474229382
Energy: 0.7304250510100497
Energy: 0.6889061969426963
Energy: 0.6414011644837355
Energy: 0.633135402927414
Energy: 0.6414011644837355
Energy: 0.6143642936701946
Energy: 0.6140246044070694
Energy: 0.725196212355401
Energy: 0.6140246044076428
Energy: 0.8219149328349766
Energy: 0.6383409261545793
Energy: 0.6347623344882547
Energy: 0.638340926154006
Energy: 0.629645650814905
Energy: 0.6858527514721398
Energy: 0.6878859029125048
Energy: 0.6858527514721398
Energy: 0.6295516839367934
Energy: 0.732605882056123
Energy: 0.621766420991062
Energy: 0.7326058820555496
Energy: 0.6274733820574777
Energy: 0.6428133360197231
Energy: 0.62829976305136
Energy: 0.6428133360197231
Energy: 0.6334685969134963
Energy: 0.7239804924198283
Energy: 0.7899803919078986
Energy: 0.7239804924204016
Energy: 0.6889417405793089
Energy: 0.7596787537210132
Energy: 0.635102636528431
Energy: 0.7596787537210132
Energy: 0.6306476644142459
Energy: 0.6794350329666845
Energy: 0.7290299599823404
Energy: 0.6794350329666845
Energy: 0.7244650149613523
Energy: 0.7238355183195054
Energy: 0.6247007715414707
Energy: 0.7238355183195054
Energy: 0.6356274536242918
Energy: 0.6886536837159851
Energy: 0.65196157467095
Energy: 0.6886536837165586
Energy: 0.6354843486676813
Energy: 0.7322236628335095
Energy: 0.7133317482936817
Energy: 0.732223662832936
Energy: 0.6487125006299258
Energy: 0.6886336845014409
Energy: 0.6315294865997919
Energy: 0.6886336845020142
Energy: 0.634423524609743
Energy: 0.6385349494583322
Energy: 0.7203342661592226
Energy: 0.6385349494577587
Energy: 0.6992305326605499
Energy: 0.6797308198676454
Energy: 0.6158529088998616
Energy: 0.6797308198687922
Energy: 0.6359995243047123
Energy: 0.6497852617342071
Energy: 0.6956492547509895
Energy: 0.6497852617342071
Energy: 0.6860921626301447
Energy: 0.7258434917689071
Energy: 0.7108107338598809
Energy: 0.7258434917694805
Energy: 0.6529757427381657
Energy: 0.6823864725295642
Energy: 0.6298281793965109
Energy: 0.6823864725295642
Energy: 0.6219784808137423
Energy: 0.6791224277821128
Energy: 0.6317372357363547
Energy: 0.6791224277826864
Energy: 0.781598924373041
Energy: 0.6837272413743825
Energy: 0.6300553444682102
Energy: 0.683727241374956
Energy: 0.6349766785835204
Energy: 0.760223433291906
Energy: 0.7809372288962094
Energy: 0.760223433291906
Energy: 0.6800597883945328
Energy: 0.6146147462620851
Energy: 0.6294511683722724
Energy: 0.6146147462620851
Energy: 0.645970357016787
Energy: 0.6531720229323336
Energy: 0.7083163006211234
Energy: 0.6531720229323336
Energy: 0.6296407503465552
Energy: 0.7221323943078917
Energy: 0.7224420856761518
Energy: 0.7221323943078917
Energy: 0.6769015075295801
Energy: 0.6142366101549374
Energy: 0.6285364451418426
Energy: 0.6142366101549374
Energy: 0.6340273574221746
Energy: 0.7903544683272316
Energy: 0.7811352056686024
Energy: 0.7903544683272316
Energy: 0.7798642779100408
Energy: 0.7275342746096893
Energy: 0.629092956126639
Energy: 0.7275342746091159
Energy: 0.6250074971300921
Energy: 0.6430331727906746
Energy: 0.6294937068268052
Energy: 0.6430331727906746
Energy: 0.6270368469926845
Energy: 0.6818285929374693
Energy: 0.6280942312753419
Energy: 0.6818285929374693
Energy: 0.6850053309132551
Energy: 0.723207248011338
Energy: 0.713582869423804
Energy: 0.7232072480107645
Energy: 0.6449943897778219
Energy: 0.6921316724959833
Energy: 0.8209081564384803
Energy: 0.6921316724959833

minimum gb energy = 0.6140246044070694 eV
minimum distance =  2.55539492234925 Angstroms
sigma value = 73


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

Energy: 0.6638577407722845
Energy: 0.6259905096415314
Energy: 0.7879962976210646
Energy: 0.6259905096406216
Energy: 0.6365344627753455
Energy: 0.6565495680308634
Energy: 0.6291176287275062
Energy: 0.6565495680308634
Energy: 0.6341413922589284
Energy: 0.6298499823837348
Energy: 0.6199247229920632
Energy: 0.6298499823837348
Energy: 0.6398285994163876
Energy: 0.6282375957930809
Energy: 0.644518683266276
Energy: 0.6282375957930809
Energy: 0.6552707303276788
Energy: 0.6589347187725759
Energy: 0.6199591922431192
Energy: 0.6589347187734856
Energy: 0.6323894637357727
Energy: 0.6209578500580376
Energy: 0.7848850711071499
Energy: 0.6209578500580376
Energy: 0.8253700138471679
Energy: 0.7055091138001928
Energy: 0.6393649256192888
Energy: 0.7055091137992829
Energy: 0.6327067567932065
Energy: 0.6147381165072049
Energy: 0.6942694100078328
Energy: 0.6147381165072049
Energy: 0.840420807971365
Energy: 0.6164084726998805
Energy: 0.6168892692580371
Energy: 0.6164084726998805
Energy: 0.6171659498918386
Energy: 0.6599803509043044
Energy: 0.616936624312109
Energy: 0.6599803509033946
Energy: 0.6289963486129823
Energy: 0.6169464433414079
Energy: 0.769218341944446
Energy: 0.6169464433414079
Energy: 0.6602283438484712
Energy: 0.6271666119471665
Energy: 0.6398973161644412
Energy: 0.6271666119462569
Energy: 0.6316921871140543
Energy: 0.649611453250117
Energy: 0.7286859475182709
Energy: 0.6496114532492074
Energy: 0.7815302111843998
Energy: 0.6863838880746819
Energy: 0.640118417289581
Energy: 0.6863838880746819
Energy: 0.6341477188710335
Energy: 0.6653821795530858
Energy: 0.7347954684712927
Energy: 0.6653821795539956
Energy: 0.7701847132167113
Energy: 0.6159277572064472
Energy: 0.6339484968372726
Energy: 0.6159277572055375
Energy: 0.6673399305297051
Energy: 0.6801727951359
Energy: 0.6342045264355386
Energy: 0.6801727951359
Energy: 0.6664655051495968
Energy: 0.679412865387195
Energy: 0.6408566446102197
Energy: 0.6794128653862853
Energy: 0.7130295370281965
Energy: 0.6144752361487348
Energy: 0.6325405853207063
Energy: 0.6144752361487348
Energy: 0.6360999716246282
Energy: 0.6652378422829104
Energy: 0.7999224735381241
Energy: 0.6652378422829104
Energy: 0.7703642387475356
Energy: 0.6209314483727348
Energy: 0.6382334398657263
Energy: 0.6209314483736444
Energy: 0.6444795469663559
Energy: 0.6557026597378158
Energy: 0.7117958676625497
Energy: 0.6557026597378158

minimum gb energy = 0.6144752361487348 eV
minimum distance =  2.54728255307452 Angstroms
sigma value = 7


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

Energy: 0.6312482305824131
Energy: 0.6310040834185264
Energy: 0.8181606319071048
Energy: 0.6310040834185264
Energy: 0.7479975708249337
Energy: 0.6546402727974607
Energy: 0.6187351529849213
Energy: 0.6546402727948878
Energy: 0.6245754705621704
Energy: 0.6315687978649511
Energy: 0.6420400500108383
Energy: 0.6315687978655944
Energy: 0.656793534867887
Energy: 0.660296140714017
Energy: 0.6285233553720257
Energy: 0.6602961407146604
Energy: 0.6248232756173764
Energy: 0.6494255686288616
Energy: 0.6317234743606005
Energy: 0.6494255686301481
Energy: 0.6251282476034609
Energy: 0.632108449122911
Energy: 0.7892282475057588
Energy: 0.632108449123525
Energy: 0.7316086296133876
Energy: 0.6923515447465168
Energy: 0.6504592774285424
Energy: 0.6923515447471602
Energy: 0.6250103369933022
Energy: 0.6313084178663102
Energy: 0.8271919698068395
Energy: 0.6313084178688834
Energy: 0.7058380472238666
Energy: 0.6558932310721236
Energy: 0.6269083414508985
Energy: 0.6558932310695504
Energy: 0.6248402886355252
Energy: 0.6656131334092386
Energy: 0.7028557891714304
Energy: 0.6656131334085953
Energy: 0.6560996037968754
Energy: 0.7082674231627123
Energy: 0.65072134442667
Energy: 0.7082674231639987
Energy: 0.6310939414466091
Energy: 0.6493513500231484
Energy: 0.6556852981771627
Energy: 0.6493513500237916
Energy: 0.6336307721740368
Energy: 0.6321322310459221
Energy: 0.6545134921409956
Energy: 0.6321322310465655
Energy: 0.6317040310813968
Energy: 0.628308215382441
Energy: 0.6443545449740385
Energy: 0.6283082153817977
Energy: 0.6163009524061684
Energy: 0.6599350644337545
Energy: 0.7555622601966145
Energy: 0.6599350644350408
Energy: 0.826111392364699
Energy: 0.6279531712004952
Energy: 0.6317440838233314
Energy: 0.6279531712017817
Energy: 0.6255722359997407
Energy: 0.6482033394025547
Energy: 0.6993882967967773
Energy: 0.6482033394006247
Energy: 0.62518050649329
Energy: 0.6256140606237418
Energy: 0.6439169817670234
Energy: 0.6256140606237418
Energy: 0.6257151637871491
Energy: 0.7079786295416286
Energy: 0.6510773578469747
Energy: 0.7079786295403422
Energy: 0.6171764617094438
Energy: 0.652851059216082
Energy: 0.6305208493266377
Energy: 0.6528510592147954
Energy: 0.6400488976911904
Energy: 0.7084737429025111
Energy: 0.6269959204746293
Energy: 0.708473742904441
Energy: 0.6245459521876744
Energy: 0.6319215480588956
Energy: 0.6439553936427918
Energy: 0.6319215480601821
Energy: 0.7932471956932131
Energy: 0.6562656468962602
Energy: 0.6509203666910583
Energy: 0.6562656468975467
Energy: 0.6314501957829974
Energy: 0.6311254029620507
Energy: 0.8160040721876529
Energy: 0.6311254029620507
Energy: 0.6314013902052282
Energy: 0.652471465082803
Energy: 0.6501916140945408
Energy: 0.6524714650834462
Energy: 0.6416657135130868
Energy: 0.6609721195606734
Energy: 0.6492299267367438
Energy: 0.6609721195613167
Energy: 0.6250285311791831
Energy: 0.6626418695639907
Energy: 0.6905667805443066
Energy: 0.662641869564634
Energy: 0.6713099560251494
Energy: 0.6485461041258793
Energy: 0.6282333376661289
Energy: 0.6485461041245927
Energy: 0.6286565601437751
Energy: 0.6309994449246266
Energy: 0.7425452952490269
Energy: 0.6309994449246266
Energy: 0.6832870974271089
Energy: 0.6449105521849939
Energy: 0.6390940030355329
Energy: 0.6449105521843507
Energy: 0.6286604723035351
Energy: 0.6310557983876366
Energy: 0.7575526565451172
Energy: 0.6310557983863501

minimum gb energy = 0.6163009524061684 eV
minimum distance =  2.53962783827104 Angstroms
sigma value = 29


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

Energy: 0.5940949044231323
Energy: 0.5810866651244204
Energy: 0.8570077361692086
Energy: 0.5810866651244204
Energy: 0.6586289315018399
Energy: 0.5718738626002559
Energy: 0.5728990406622445
Energy: 0.5718738625996086
Energy: 0.565728200787363
Energy: 0.6092303661696337
Energy: 0.6583704835731456
Energy: 0.6092303661696337
Energy: 0.5937578764261779
Energy: 0.5942482234527907
Energy: 0.6694885489843354
Energy: 0.5942482234530146
Energy: 0.5943343146728887
Energy: 0.5923997898379755
Energy: 0.6141624030603462
Energy: 0.5923997898377513
Energy: 0.5811156054501004
Energy: 0.6092586626175714
Energy: 0.5811303449917197
Energy: 0.6092586626175714
Energy: 0.5810965443695661
Energy: 0.5925393847322761
Energy: 0.5942616462972569
Energy: 0.5925393847324754
Energy: 0.669509748969962
Energy: 0.5944479233825759
Energy: 0.5937465956617003
Energy: 0.594447923383024
Energy: 0.6582344685885054
Energy: 0.6092214266717576
Energy: 0.6585754438130591
Energy: 0.6092214266719815

minimum gb energy = 0.565728200787363 eV
minimum distance =  2.60104203890653 Angstroms
sigma value = 5


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

Energy: 0.5940160720139912
Energy: 0.5916926409713457
Energy: 0.7097250377314146
Energy: 0.5916926409713457
Energy: 0.6220298543056311
Energy: 0.5867680397853952
Energy: 0.5913733027653943
Energy: 0.5867680397841799
Energy: 0.5821383477413284
Energy: 0.5877666581785452
Energy: 0.6987499967868316
Energy: 0.5877666581785452
Energy: 0.5947612983162784
Energy: 0.6143415562594471
Energy: 0.5850279450085057
Energy: 0.6143415562594471
Energy: 0.5861796279292452
Energy: 0.6172945343271411
Energy: 0.6401541288155546
Energy: 0.6172945343271411
Energy: 0.6177277908820562
Energy: 0.5922748764563561
Energy: 0.581112362958624
Energy: 0.5922748764563561
Energy: 0.5827409683663688
Energy: 0.6156287166987565
Energy: 0.5888698663863523
Energy: 0.6156287166981488
Energy: 0.5803832538986736
Energy: 0.5926338292589859
Energy: 0.5833140240774943
Energy: 0.5926338292589859
Energy: 0.5863596019211207
Energy: 0.6160579428376429
Energy: 0.5907912164669634
Energy: 0.6160579428382505
Energy: 0.5828577331671057
Energy: 0.6161342267112339
Energy: 0.6030299577851218
Energy: 0.6161342267106262
Energy: 0.5816909530491933
Energy: 0.6148378472416596
Energy: 0.588166987600649
Energy: 0.6148378472416596
Energy: 0.5880288481761128
Energy: 0.6180900292006056
Energy: 0.5933017251738296
Energy: 0.618090029199998
Energy: 0.618701730116124
Energy: 0.5918541759454452
Energy: 0.5938383299865977
Energy: 0.5918541759454452
Energy: 0.59203322991317
Energy: 0.5930265493922658
Energy: 0.6043760616781376
Energy: 0.5930265493928734
Energy: 0.7253380552050748
Energy: 0.5814336036858153
Energy: 0.5880114412258267
Energy: 0.5814336036870306
Energy: 0.5833583342155666
Energy: 0.5880928884116863
Energy: 0.7025172853200149
Energy: 0.5880928884116863
Energy: 0.6797195217726957
Energy: 0.5885114210540667
Energy: 0.5922533709128457
Energy: 0.5885114210540667
Energy: 0.5860251330872934
Energy: 0.5918327245999971
Energy: 0.7549956884249306
Energy: 0.5918327246006049
Energy: 0.5988266608228837
Energy: 0.6173562141312285
Energy: 0.583506770993568
Energy: 0.6173562141312285
Energy: 0.5831253270745937
Energy: 0.6450187441756794
Energy: 0.5845355022671066
Energy: 0.6450187441768946
Energy: 0.5931130166092595
Energy: 0.6129205929340737
Energy: 0.5870202872357212
Energy: 0.6129205929328584
Energy: 0.5945721745207498
Energy: 0.6159234141496069
Energy: 0.5815164653826755
Energy: 0.6159234141496069
Energy: 0.5911898738349975
Energy: 0.5926242625639635
Energy: 0.5968238195817201
Energy: 0.5926242625639635
Energy: 0.5917934362844743
Energy: 0.6175236713547316
Energy: 0.5910521721677402
Energy: 0.6175236713547316
Energy: 0.5969871513913968
Energy: 0.5924811933731944
Energy: 0.5890726302042604
Energy: 0.5924811933731944
Energy: 0.5916328152612856
Energy: 0.5930817184913342
Energy: 0.5860823399620861
Energy: 0.5930817184919418
Energy: 0.5833180010234285
Energy: 0.578877390255885
Energy: 0.6132871262203594
Energy: 0.578877390255885
Energy: 0.7093236876393967
Energy: 0.6155289203270143
Energy: 0.5833619577417196
Energy: 0.6155289203270143
Energy: 0.5922548419541627
Energy: 0.5862177731034209
Energy: 0.6439677744772283
Energy: 0.5862177731028132
Energy: 0.7619465349182469
Energy: 0.5918387172979191
Energy: 0.586246711701063
Energy: 0.5918387172979191
Energy: 0.5811384902195543
Energy: 0.5845862450826484
Energy: 0.7408571235449034
Energy: 0.5845862450826484
Energy: 0.6793774094337567
Energy: 0.6161132135220441
Energy: 0.5819892479974769
Energy: 0.6161132135214364
Energy: 0.5851411846486638
Energy: 0.6143670028736846
Energy: 0.5973134839805676
Energy: 0.6143670028730769

minimum gb energy = 0.578877390255885 eV
minimum distance =  2.52666731773543 Angstroms
sigma value = 1


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

Energy: 0.6330058849000203
Energy: 0.5706906638809458
Energy: 0.6943417159061253
Energy: 0.5706906638809458
Energy: 0.6050561577519799
Energy: 0.5536960149012713
Energy: 0.5669647809565646
Energy: 0.5536960149012713
Energy: 0.558221037148557
Energy: 0.566371433414514
Energy: 0.6399832805113489
Energy: 0.5663714334136738
Energy: 0.5677160328444109
Energy: 0.5973133893510253
Energy: 0.5665972223381277
Energy: 0.5973133893510253
Energy: 0.5574731404312929
Energy: 0.5690224699529186
Energy: 0.6390449350952018
Energy: 0.5690224699537588
Energy: 0.5539687366212264
Energy: 0.5970169489104471
Energy: 0.566467316944957
Energy: 0.5970169489104471
Energy: 0.55783822897753
Energy: 0.6155068700207967
Energy: 0.5642537687760717
Energy: 0.6155068700199564
Energy: 0.5572648507452331
Energy: 0.5660796494877275
Energy: 0.5877380165038742
Energy: 0.5660796494877275
Energy: 0.5658801887464866
Energy: 0.5711381850796644
Energy: 0.5892416898014968
Energy: 0.5711381850805047
Energy: 0.5659895947828449
Energy: 0.6643145123805766
Energy: 0.5858167976303483
Energy: 0.6643145123814169
Energy: 0.5575101018700185
Energy: 0.5663039386871732
Energy: 0.5786907378398118
Energy: 0.5663039386871732
Energy: 0.5569489441000991
Energy: 0.6085813339562409
Energy: 0.5640919527594345
Energy: 0.6085813339562409
Energy: 0.5541784090975255
Energy: 0.596455100489512
Energy: 0.5671108520131485
Energy: 0.596455100489512
Energy: 0.5539490947776435
Energy: 0.5707203558100633
Energy: 0.6439968411914341
Energy: 0.5707203558100633
Energy: 0.696209521871085
Energy: 0.5966741785905758
Energy: 0.5672034944238198
Energy: 0.5966741785897356
Energy: 0.5582198657253366
Energy: 0.5662414321421874
Energy: 0.5793887973691895
Energy: 0.5662414321430276
Energy: 0.6182870816405743
Energy: 0.5542263389463893
Energy: 0.5660118353068272
Energy: 0.5542263389455491
Energy: 0.6330058849000203
Energy: 0.5706906638809458
Energy: 0.6958147993851476
Energy: 0.5706906638809458
Energy: 0.6050561577528201
Energy: 0.5536960149012713
Energy: 0.5669647809557243
Energy: 0.5536960149012713
Energy: 0.558221037148557
Energy: 0.566371433414514
Energy: 0.6399832805113489
Energy: 0.5663714334136738
Energy: 0.5677160410694924
Energy: 0.5973133893510253
Energy: 0.5665972223372876
Energy: 0.5973133893510253
Energy: 0.5574731404312929
Energy: 0.5690224699529186
Energy: 0.6390449350952018
Energy: 0.5690224699537588
Energy: 0.5539687366212264
Energy: 0.5970169489104471
Energy: 0.5664673169441168
Energy: 0.5970169489104471
Energy: 0.55783822897753
Energy: 0.6155068700199564
Energy: 0.5711213472728673
Energy: 0.6155068700199564

minimum gb energy = 0.5536960149012713 eV
minimum distance =  2.53669583222117 Angstroms
sigma value = 17


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

Energy: 0.5628593435287347
Energy: 0.5630093830601948
Energy: 0.69562045165272
Energy: 0.5630093830601948
Energy: 0.5923145465119711
Energy: 0.5611968282502822
Energy: 0.5560056180277061
Energy: 0.5611968282492437
Energy: 0.5544694744349861
Energy: 0.5568941716854094
Energy: 0.5994507577652474
Energy: 0.556894171686448
Energy: 0.5879292960179319
Energy: 0.5504267099092133
Energy: 0.5532353389055079
Energy: 0.5504267099107711
Energy: 0.5506041911669601
Energy: 0.5915850887341192
Energy: 0.6925103744834937
Energy: 0.5915850887341192
Energy: 0.5671887441736084
Energy: 0.652119025672165
Energy: 0.5598428668513945
Energy: 0.6521190256716457
Energy: 0.5674659270321715
Energy: 0.5825234749510133
Energy: 0.5594816076751451
Energy: 0.5825234749510133
Energy: 0.5494700820937127
Energy: 0.6538077904629184
Energy: 0.5536682903971172
Energy: 0.6538077904629184
Energy: 0.5643035229583333
Energy: 0.6576533532425514
Energy: 0.5617393634365317
Energy: 0.6576533532430706
Energy: 0.5565934967397389
Energy: 0.5821107214462488
Energy: 0.5550322782538311
Energy: 0.5821107214467681
Energy: 0.5573947967944718
Energy: 0.647734342959083
Energy: 0.5566025449977896
Energy: 0.6477343429596022
Energy: 0.5506068420046181
Energy: 0.5814412429380842
Energy: 0.5474482969209232
Energy: 0.5814412429370456
Energy: 0.5506292681166175
Energy: 0.653155148817598
Energy: 0.5559504996359764
Energy: 0.653155148817598
Energy: 0.5616913648812183
Energy: 0.5903174871648967
Energy: 0.5630571095620385
Energy: 0.5903174871643775
Energy: 0.5565235057941053
Energy: 0.6479522052393477
Energy: 0.5685058745273252
Energy: 0.6479522052414249
Energy: 0.5576634717839822
Energy: 0.5573295001471081
Energy: 0.6389530131973623
Energy: 0.5573295001460695
Energy: 0.5751564113378097
Energy: 0.6474102970704868
Energy: 0.5561076787658528
Energy: 0.6474102970710061
Energy: 0.5502686350154188
Energy: 0.5632882314126028
Energy: 0.7608667960676664
Energy: 0.5632882314131221
Energy: 0.6060041591623326
Energy: 0.5838374873213088
Energy: 0.5559156844731716
Energy: 0.583837487321828
Energy: 0.5568954031120055
Energy: 0.55669738795552
Energy: 0.7111051454326536
Energy: 0.55669738795552
Energy: 0.5692254148962671
Energy: 0.5563052405148069
Energy: 0.5655757340329192
Energy: 0.5563052405158455
Energy: 0.5662332354797389
Energy: 0.5644606049685723
Energy: 0.5702458252274026
Energy: 0.5644606049685723
Energy: 0.5752536938843468
Energy: 0.5560364673726799
Energy: 0.5580630671683263
Energy: 0.5560364673716413
Energy: 0.5561474161444592
Energy: 0.5833383637305442
Energy: 0.6439992326098415
Energy: 0.5833383637305442
Energy: 0.6841188159329163
Energy: 0.5632060990729411
Energy: 0.5515601522977921
Energy: 0.5632060990734604
Energy: 0.557249976074757
Energy: 0.5910057091919441
Energy: 0.5558826609139264
Energy: 0.5910057091914248
Energy: 0.6208154167222381
Energy: 0.5793799233583456
Energy: 0.5587582504554365
Energy: 0.579379923358865
Energy: 0.5711450417177029
Energy: 0.6484769234182517
Energy: 0.5555248811552407
Energy: 0.6484769234182517
Energy: 0.5631196969361183
Energy: 0.5897694555645386
Energy: 0.5638538302898758
Energy: 0.5897694555650579
Energy: 0.5574401563022342
Energy: 0.6534132810687661
Energy: 0.565533418958485
Energy: 0.6534132810687661
Energy: 0.555026505373301
Energy: 0.5892031180144597
Energy: 0.558395791621812
Energy: 0.5892031180144597
Energy: 0.559585760440922
Energy: 0.6470592953243455
Energy: 0.5558179280600626
Energy: 0.6470592953243455
Energy: 0.5529313249533282
Energy: 0.582356943301541
Energy: 0.6274102422077165
Energy: 0.5823569433020603
Energy: 0.5768302265185927
Energy: 0.6568520056261623
Energy: 0.5619578672843636
Energy: 0.6568520056261623
Energy: 0.5531389747863517
Energy: 0.5636934643983195
Energy: 0.5787758793997737
Energy: 0.5636934643983195
Energy: 0.5605100330948226
Energy: 0.5835453681975677
Energy: 0.5681869439616875
Energy: 0.5835453681986064
Energy: 0.5579559852909807
Energy: 0.6518610993965602
Energy: 0.5687726614862887
Energy: 0.651861099397599
Energy: 0.5763856349623003
Energy: 0.5923806057159078
Energy: 0.5578416160317773
Energy: 0.5923806057169465

minimum gb energy = 0.5474482969209232 eV
minimum distance =  2.53520313968081 Angstroms
sigma value = 89


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

Energy: 0.49262430162985565
Energy: 0.49267536916221183
Energy: 0.7984461432261669
Energy: 0.49267536916221183
Energy: 0.4927326234755706
Energy: 0.5089136055873441
Energy: 0.5033430102559161
Energy: 0.5089136055873441
Energy: 0.5014157921609093
Energy: 0.5730147248314265
Energy: 0.6390061432753988
Energy: 0.5730147248314265
Energy: 0.6316305799575747
Energy: 0.5088738259598271
Energy: 0.5033808537639475
Energy: 0.5088738259598271
Energy: 0.5015061803436862
Energy: 0.4942603035039338
Energy: 0.7414669077052514
Energy: 0.4942603035039338
Energy: 0.5015177239663435
Energy: 0.49286010622030413
Energy: 0.49498139694380333
Energy: 0.49286010622030413
Energy: 0.5015804727236036
Energy: 0.5731615208663369
Energy: 0.4928182700285194
Energy: 0.5731615208663369
Energy: 0.5058138233772066
Energy: 0.6665786751718944
Energy: 0.5032103521658183
Energy: 0.6665786751718944
Energy: 0.5014747808039667
Energy: 0.5322754586361963
Energy: 0.6301415170052447
Energy: 0.5322754586361963
Energy: 0.5092952741228812
Energy: 0.620622481330013
Energy: 0.5014131579172709
Energy: 0.620622481330013
Energy: 0.492590442333415
Energy: 0.5089350894679466
Energy: 0.5013548217998293
Energy: 0.5089350894679466
Energy: 0.492657109036822
Energy: 0.5713011488034461
Energy: 0.5032722185361225
Energy: 0.5713011488034461
Energy: 0.501401355519633
Energy: 0.5304217942657311
Energy: 0.5043978672150092
Energy: 0.5304217942657311
Energy: 0.5014259222854014
Energy: 0.530090702370298
Energy: 0.5013030772652858
Energy: 0.530090702370298
Energy: 0.49550143551006126
Energy: 0.5304663449365213
Energy: 0.5013962103089029
Energy: 0.5304663449365213

minimum gb energy = 0.492590442333415 eV
minimum distance =  2.5522028400064 Angstroms
sigma value = 13


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

Energy: 0.5017749688174902
Energy: 0.49238617455599326
Energy: 0.6425361734742514
Energy: 0.4923861745548543
Energy: 0.5262288587092588
Energy: 0.5032740928783178
Energy: 0.49133910585944457
Energy: 0.5032740928788872
Energy: 0.49265144991078097
Energy: 0.4924962237190887
Energy: 0.565742210774496
Energy: 0.4924962237185192
Energy: 0.4909862823194106
Energy: 0.5033341460117131
Energy: 0.4883626509636811
Energy: 0.5033341460128522
Energy: 0.4962417494628079
Energy: 0.518607158646096
Energy: 0.5220596591125892
Energy: 0.5186071586455264
Energy: 0.48602250535759844
Energy: 0.5055766710762616
Energy: 0.4916209099949238
Energy: 0.5055766710785397
Energy: 0.49631186232587854
Energy: 0.621051512980747
Energy: 0.632834607517121
Energy: 0.621051512979608
Energy: 0.4859324065818888
Energy: 0.5037137771255954
Energy: 0.4916402106341853
Energy: 0.5037137771250261
Energy: 0.49626834605302855
Energy: 0.521085695334785
Energy: 0.5451439501086629
Energy: 0.5210856953353544
Energy: 0.5755401865476695
Energy: 0.5276129062864482
Energy: 0.48831621780084283
Energy: 0.5276129062858788
Energy: 0.4964142614778924
Energy: 0.5281218840558453
Energy: 0.4892220043060557
Energy: 0.5281218840552758
Energy: 0.5959111061296174
Energy: 0.5274899996073829
Energy: 0.4927196110877853
Energy: 0.5274899996062438
Energy: 0.5085993997185423
Energy: 0.49660368948400846
Energy: 0.48616216853449146
Energy: 0.4966036894834389
Energy: 0.6089174188697649
Energy: 0.527761233916901
Energy: 0.49288620524517995
Energy: 0.5277612339186095
Energy: 0.4983331589478204
Energy: 0.4918631112761639
Energy: 0.48605259854251387
Energy: 0.4918631112767333
Energy: 0.4842615990062493
Energy: 0.5277599524077671
Energy: 0.48687526829800326
Energy: 0.5277599524077671
Energy: 0.49269845904000265
Energy: 0.5143653029410352
Energy: 0.4869302868289797
Energy: 0.5143653029404657
Energy: 0.49137920104692884
Energy: 0.5197762931601612
Energy: 0.49002419600064606
Energy: 0.5197762931613003
Energy: 0.4925220918291921
Energy: 0.5220297643041034
Energy: 0.4901209669449426
Energy: 0.5220297643018255
Energy: 0.49230520871494404
Energy: 0.5224417953725392
Energy: 0.4900537573798616
Energy: 0.5224417953736783
Energy: 0.4910255306830605
Energy: 0.519769973612044
Energy: 0.4899572380004188
Energy: 0.5197699736114746
Energy: 0.4927317725891832
Energy: 0.5144035930900182
Energy: 0.4871347823964706
Energy: 0.5144035930883096
Energy: 0.4842442571788865
Energy: 0.5276051838228466
Energy: 0.486837895058959
Energy: 0.5276051838245551
Energy: 0.49637008201288685
Energy: 0.4917872304794762
Energy: 0.48755739823132044
Energy: 0.4917872304800457
Energy: 0.6085977435884489
Energy: 0.527771361585472
Energy: 0.4928998778338553
Energy: 0.527771361585472
Energy: 0.5082657798658133
Energy: 0.49651995068804355
Energy: 0.4877580825594468
Energy: 0.4965199506886131
Energy: 0.5958600248165357
Energy: 0.5278071455290595
Energy: 0.49267349231116575
Energy: 0.5278071455290595
Energy: 0.4968648714071565
Energy: 0.5280034507734092
Energy: 0.4853888201286037
Energy: 0.5280034507734092
Energy: 0.5757395765681883
Energy: 0.5275626000044503
Energy: 0.48830947903904454
Energy: 0.5275626000050198
Energy: 0.4985752916765247
Energy: 0.5211266011104467
Energy: 0.544690477651089
Energy: 0.5211266011098772
Energy: 0.48626536422840183
Energy: 0.503420068417128
Energy: 0.4916302964669644
Energy: 0.5034200684165586
Energy: 0.49612896614140645
Energy: 0.6199862556712356
Energy: 0.5872370937228623
Energy: 0.6199862556718051
Energy: 0.4861884879117338
Energy: 0.5058968650904587
Energy: 0.4917526748144296
Energy: 0.5058968650910282
Energy: 0.4990235086117984
Energy: 0.518613400292297
Energy: 0.6342385841353664
Energy: 0.5186134002928665
Energy: 0.4907327085065272
Energy: 0.5032326922794131
Energy: 0.4883698669463591
Energy: 0.5032326922788436

minimum gb energy = 0.4842442571788865 eV
minimum distance =  2.56820255980694 Angstroms
sigma value = 37


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

Energy: 0.5324784879863137
Energy: 0.542827449255045
Energy: 0.4552780316782732
Energy: 0.542827449255045
Energy: 0.5247256322935726
Energy: 0.586288944104903
Energy: 0.45144816935225446
Energy: 0.586288944104903
Energy: 0.4606479698703488
Energy: 0.6005253549934638
Energy: 0.602705591654889
Energy: 0.6005253549934638
Energy: 0.4956031695830453
Energy: 0.4623011744335853
Energy: 0.4534065118514309
Energy: 0.4623011744335853
Energy: 0.4527461524964312
Energy: 0.5865306088276657
Energy: 0.4833715550787331
Energy: 0.5865306088286456
Energy: 0.45537770350160817
Energy: 0.5879055975288588
Energy: 0.510070081571102
Energy: 0.5879055975288588
Energy: 0.4592731717193211
Energy: 0.7157151427189361
Energy: 0.5837488743917906
Energy: 0.7157151427179562
Energy: 0.441131593732044
Energy: 0.4619174964138773
Energy: 0.4634997453447808
Energy: 0.4619174964138773
Energy: 0.4518510899353227
Energy: 0.5867716105161451
Energy: 0.5886012974659042
Energy: 0.5867716105161451
Energy: 0.6027161408267973
Energy: 0.5871222472012712
Energy: 0.510048802222991
Energy: 0.5871222472022509
Energy: 0.4524389317264719
Energy: 0.6872071565738143
Energy: 0.49540841714701245
Energy: 0.6872071565738143
Energy: 0.6074873157118732
Energy: 0.4617073780510896
Energy: 0.4533001817075056
Energy: 0.4617073780510896
Energy: 0.5081742971987713
Energy: 0.5867257654960419
Energy: 0.44955893860920715
Energy: 0.5867257654950621
Energy: 0.598335671852586
Energy: 0.7134893395893218
Energy: 0.4456889783717154
Energy: 0.7134893395893218
Energy: 0.5325417398253772
Energy: 0.4842556628048662
Energy: 0.44591852549185795
Energy: 0.4842556628048662
Energy: 0.527180777276076
Energy: 0.5874515179526754
Energy: 0.45133747941833735
Energy: 0.5874515179526754
Energy: 0.5081730625705757
Energy: 0.5879710267997971
Energy: 0.4428984944339798
Energy: 0.5879710267997971
Energy: 0.4954558291444124
Energy: 0.6869026255558708
Energy: 0.4524197445340524
Energy: 0.6869026255558708
Energy: 0.45247840109722276
Energy: 0.4618257215421437
Energy: 0.45186226406440755
Energy: 0.46182572154312357
Energy: 0.45027677692631396
Energy: 0.5873679201387708
Energy: 0.503727883240798
Energy: 0.5873679201387708

minimum gb energy = 0.441131593732044 eV
minimum distance =  2.5451948694568 Angstroms
sigma value = 25


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

Energy: 0.48459724775315594
Energy: 0.6285405087135253
Energy: 0.4113433623634726
Energy: 0.6285405087142905
Energy: 0.5447997825385188
Energy: 0.6178945549244205
Energy: 0.41110570113378236
Energy: 0.6178945549236553
Energy: 0.45957732685811403
Energy: 0.46883444758120024
Energy: 0.5861343270753019
Energy: 0.46883444758120024
Energy: 0.45439874202689784
Energy: 0.5803369086919755
Energy: 0.41326490146309436
Energy: 0.5803369086919755
Energy: 0.41784163103416627
Energy: 0.6166224931327313
Energy: 0.4289262378060501
Energy: 0.6166224931319663
Energy: 0.4370681436899599
Energy: 0.4156138257421821
Energy: 0.4179738754209157
Energy: 0.41561382574371236
Energy: 0.412405226840444
Energy: 0.40956016559060954
Energy: 0.45506720892962965
Energy: 0.40956016559137465
Energy: 0.40740765170648446
Energy: 0.5326735493616731
Energy: 0.46059790224271496
Energy: 0.5326735493624383
Energy: 0.4116799947497833
Energy: 0.6178120352987521
Energy: 0.5835358481550709
Energy: 0.6178120352987521
Energy: 0.39889461504061924
Energy: 0.40839381982535067
Energy: 0.43201409845164973
Energy: 0.40839381982458556
Energy: 0.41218206042490185
Energy: 0.409273437783685
Energy: 0.5523967273964256
Energy: 0.409273437783685
Energy: 0.5114426819816692
Energy: 0.6518559761340295
Energy: 0.46058492053340266
Energy: 0.6518559761347944
Energy: 0.41406216616173785
Energy: 0.580318769651233
Energy: 0.5139600361329693
Energy: 0.5803187696504679
Energy: 0.5257852736934482
Energy: 0.6294618945910595
Energy: 0.4195243210137277
Energy: 0.6294618945918246
Energy: 0.4173689714467287
Energy: 0.40852852202598267
Energy: 0.43666617400704616
Energy: 0.4085285220252176
Energy: 0.5446664876645589
Energy: 0.6346582229440981
Energy: 0.41112029956978924
Energy: 0.6346582229448633
Energy: 0.4634304035703503
Energy: 0.5325418354900572
Energy: 0.4065902602962945
Energy: 0.532541835489292
Energy: 0.5261890840864032
Energy: 0.6164344382172706
Energy: 0.41244537843981033
Energy: 0.6164344382188008
Energy: 0.4882847915062417
Energy: 0.5322801418264819
Energy: 0.3990826485503627
Energy: 0.5322801418257169
Energy: 0.6081619950493108
Energy: 0.6345821000161136
Energy: 0.411341806682715
Energy: 0.6345821000153485
Energy: 0.46334247826386304
Energy: 0.6501458493832802
Energy: 0.4000911206516279
Energy: 0.650145849382515
Energy: 0.45093170877181943
Energy: 0.5286564751638612
Energy: 0.4168351722208995
Energy: 0.5286564751631309
Energy: 0.41734180778948576
Energy: 0.6282483346503972
Energy: 0.5255511827472399
Energy: 0.6282483346511623
Energy: 0.43851764650739244
Energy: 0.6343155615709205
Energy: 0.4173566073147872
Energy: 0.6343155615709205
Energy: 0.4112530995237681
Energy: 0.6502477094905653
Energy: 0.540894884157827
Energy: 0.6502477094905653
Energy: 0.4032772287558254
Energy: 0.5330384295395318
Energy: 0.4601018466435399
Energy: 0.5330384295395318

minimum gb energy = 0.39889461504061924 eV
minimum distance =  2.49280416454648 Angstroms
sigma value = 41


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

Energy: 0.5318821530542114
Energy: 0.550818292062031
Energy: 0.49537215318561834
Energy: 0.5508182920614038
Energy: 0.504781446425841
Energy: 0.3765178228479956
Energy: 0.37217167561818587
Energy: 0.3765178228479956
Energy: 0.38215308824447736
Energy: 0.3737297561483673
Energy: 0.47056749325049296
Energy: 0.37372975614962184
Energy: 0.4443643938747027
Energy: 0.37743687583935936
Energy: 0.3722401922508436
Energy: 0.37743687583747754
Energy: 0.3692748647385047
Energy: 0.5581929985681978
Energy: 0.3861425594851646
Energy: 0.5581929985681978
Energy: 0.38341309303026805
Energy: 0.37663715493517935
Energy: 0.37232478984880824
Energy: 0.37663715493517935
Energy: 0.37160575353399233
Energy: 0.37590894984068957
Energy: 0.38380094453582664
Energy: 0.3759089498400623
Energy: 0.365345473003427
Energy: 0.46806563475338075
Energy: 0.3698482964359399
Energy: 0.46806563475275353
Energy: 0.37390324724892016
Energy: 0.5762367735944567
Energy: 0.44344478263897213
Energy: 0.5762367735944567
Energy: 0.3692126325844632
Energy: 0.3719763411455376
Energy: 0.38266716916909327
Energy: 0.37197634114804673
Energy: 0.37162216098959017
Energy: 0.3789228501695224
Energy: 0.5050191636903435
Energy: 0.3789228501695224
Energy: 0.3648360519383334
Energy: 0.5494274640054799
Energy: 0.5325360285376911
Energy: 0.5494274640061071
Energy: 0.3739245566784175
Energy: 0.5778027265503679
Energy: 0.5053370745071537
Energy: 0.5778027265509952
Energy: 0.4645297567759689
Energy: 0.4979920307663385
Energy: 0.38269930124481094
Energy: 0.4979920307657113
Energy: 0.3716013054128124
Energy: 0.37923738584959704
Energy: 0.4895455377993028
Energy: 0.37923738585085154
Energy: 0.4663124621030303
Energy: 0.5782135954353885
Energy: 0.3698596208418457
Energy: 0.5782135954347613
Energy: 0.37384629275645015
Energy: 0.5767513794563354
Energy: 0.45961864878804803
Energy: 0.5767513794557082
Energy: 0.46145930436609783
Energy: 0.49630427033231017
Energy: 0.3721965488893678
Energy: 0.4963042703316829
Energy: 0.3716063869684294
Energy: 0.46804814753879426
Energy: 0.3653513165966575
Energy: 0.46804814753879426
Energy: 0.45035188023462597
Energy: 0.5782444878036765
Energy: 0.37613817000513045
Energy: 0.5782444878036765
Energy: 0.3844296360208913
Energy: 0.577517851354616
Energy: 0.3666871368085695
Energy: 0.577517851354616
Energy: 0.5880471909237854
Energy: 0.6070382681964678
Energy: 0.3721887921604101
Energy: 0.607038268197095
Energy: 0.5338679343308951
Energy: 0.5490633569377047
Energy: 0.36516852090983576
Energy: 0.5490633569370775
Energy: 0.5023216998126325
Energy: 0.5778249416130387
Energy: 0.37561959739984657
Energy: 0.5778249416130387
Energy: 0.384456000300978
Energy: 0.5765160811958232
Energy: 0.3672006089265495
Energy: 0.5765160811977049
Energy: 0.4883432838537729
Energy: 0.6054672108314841
Energy: 0.37223348630676456
Energy: 0.6054672108314841
Energy: 0.37161812096090197
Energy: 0.5756639975516384
Energy: 0.4675560011034013
Energy: 0.5756639975516384
Energy: 0.37334618372424944
Energy: 0.5763741307881641
Energy: 0.3739538916630916
Energy: 0.5763741307881641
Energy: 0.37394756763192055
Energy: 0.5993886883130397
Energy: 0.4649415631385836
Energy: 0.5993886883130397
Energy: 0.3696717097304496
Energy: 0.5948365895646568
Energy: 0.37432948319686576
Energy: 0.5948365895646568
Energy: 0.37183771613120375
Energy: 0.5758375486774956
Energy: 0.45211429425889305
Energy: 0.5758375486774956
Energy: 0.36937822348404
Energy: 0.5765780218130343
Energy: 0.3871781021188765
Energy: 0.5765780218136615

minimum gb energy = 0.3648360519383334 eV
minimum distance =  2.48884572350173 Angstroms
sigma value = 15


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

Energy: 0.4849073591007025
Energy: 0.5429701411410868
Energy: 0.5071446442300891
Energy: 0.5429701411410868
Energy: 0.5400301830346732
Energy: 0.5208643841193101
Energy: 0.349907689153692
Energy: 0.5208643841193101
Energy: 0.3604080985908653
Energy: 0.4998091978868251
Energy: 0.6031426431335389
Energy: 0.49980919788735656
Energy: 0.4583924442826727
Energy: 0.5331163057866063
Energy: 0.349917927754234
Energy: 0.5331163057866063
Energy: 0.3481148309923495
Energy: 0.5494449870665449
Energy: 0.35876518475421737
Energy: 0.5494449870670763
Energy: 0.40746631088071544
Energy: 0.5192754736166849
Energy: 0.3499327053684468
Energy: 0.5192754736166849
Energy: 0.3495003165055919
Energy: 0.5002916873634882
Energy: 0.35637537079712484
Energy: 0.5002916873640195
Energy: 0.35650351605499603
Energy: 0.5000684200191516
Energy: 0.3499789756634901
Energy: 0.5000684200191516
Energy: 0.3508812123826289
Energy: 0.547379323987991
Energy: 0.4327134077554164
Energy: 0.5473793239885225
Energy: 0.3425219913035615
Energy: 0.5187657537570087
Energy: 0.3484902752832949
Energy: 0.5187657537559459
Energy: 0.34950001978103235
Energy: 0.5195668097382288
Energy: 0.46021462796406826
Energy: 0.5195668097387601
Energy: 0.34627922760997565
Energy: 0.35086498195663607
Energy: 0.3609106553026678
Energy: 0.3508649819539792
Energy: 0.35101323203272455
Energy: 0.5468804830479754
Energy: 0.5388903750098958
Energy: 0.5468804830479754
Energy: 0.34141083312808523
Energy: 0.5539959767106524
Energy: 0.4852972198358186
Energy: 0.5539959767111837
Energy: 0.34961863874720983
Energy: 0.5221523545048796
Energy: 0.5411217779883792
Energy: 0.5221523545043482
Energy: 0.4260700707000931
Energy: 0.5005364703504996
Energy: 0.3608796521027257
Energy: 0.5005364703499683
Energy: 0.35101146760904095
Energy: 0.5469989212105669
Energy: 0.46017318503855276
Energy: 0.5469989212105669
Energy: 0.42634619293682724
Energy: 0.5599652015533595
Energy: 0.34839613631643707
Energy: 0.5599652015533595
Energy: 0.3494952522949717
Energy: 0.5223267203005342
Energy: 0.40966224541847146
Energy: 0.5223267203005342
Energy: 0.4209077847977391
Energy: 0.5220096847134894
Energy: 0.34997050677305863
Energy: 0.5220096847140209
Energy: 0.3509399686757868
Energy: 0.5337169617238859
Energy: 0.35732900936365497
Energy: 0.5337169617238859
Energy: 0.43298395394011036
Energy: 0.5588365263973997
Energy: 0.3528124522629165
Energy: 0.5588365263973997
Energy: 0.349533328885265
Energy: 0.521683207464149
Energy: 0.33827149893770847
Energy: 0.5216832074646803
Energy: 0.5088242839134706
Energy: 0.522114876828047
Energy: 0.3498090346978935
Energy: 0.522114876828047
Energy: 0.36200560474764043
Energy: 0.5335751066245745
Energy: 0.3405169403165449
Energy: 0.5335751066251059
Energy: 0.5385261309821023
Energy: 0.5585600367073337
Energy: 0.35263348644732473
Energy: 0.5585600367068022
Energy: 0.48602957822898313
Energy: 0.5402599430368631
Energy: 0.33868476759976013
Energy: 0.5402599430368631
Energy: 0.6151661114835757
Energy: 0.52250023989781
Energy: 0.34989015482607255
Energy: 0.5225002398972786
Energy: 0.3619453895016767
Energy: 0.5590449794421344
Energy: 0.34411669018970625
Energy: 0.5590449794421344
Energy: 0.4461340836804002
Energy: 0.5481105829103525
Energy: 0.3526122295169723
Energy: 0.5481105829103525
Energy: 0.34950188759181366
Energy: 0.5470121194962747
Energy: 0.4275600304144679
Energy: 0.5470121194957435
Energy: 0.44133019382656924
Energy: 0.5219014300625864
Energy: 0.3499088324669509
Energy: 0.5219014300631176
Energy: 0.3509489258005449
Energy: 0.5591559194774094
Energy: 0.42865149179949835
Energy: 0.5591559194779407
Energy: 0.35155528249899043
Energy: 0.5331425993316328
Energy: 0.3526935364351808
Energy: 0.5331425993316328
Energy: 0.34329102079038765
Energy: 0.5470117313501617
Energy: 0.42877149580922563
Energy: 0.5470117313501617
Energy: 0.350001620240366
Energy: 0.5217368930545656
Energy: 0.35132616553961216
Energy: 0.5217368930550972
Energy: 0.3510496834597322
Energy: 0.5597330270981796
Energy: 0.5167831343233907
Energy: 0.5597330270981796

minimum gb energy = 0.33827149893770847 eV
minimum distance =  2.56814362995666 Angstroms
sigma value = 85


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

Energy: 0.49559217270605577
Energy: 0.5158705855779591
Energy: 0.30991273687168236
Energy: 0.5158705855788808
Energy: 0.5949859198085299
Energy: 0.482383533706481
Energy: 0.31935358757753146
Energy: 0.482383533706481
Energy: 0.4765243635269964
Energy: 0.47310220044916906
Energy: 0.37990298480303025
Energy: 0.4731022004487082
Energy: 0.5255290146026923
Energy: 0.47921599688748634
Energy: 0.31935043629901005
Energy: 0.4792159968879472
Energy: 0.3638441336567699
Energy: 0.45809656371675195
Energy: 0.3345120397047687
Energy: 0.4580965637172128
Energy: 0.46017965882509515
Energy: 0.47349421725019386
Energy: 0.31920596427754
Energy: 0.47349421725019386
Energy: 0.3475059086894187
Energy: 0.4647701254314213
Energy: 0.35923187216691654
Energy: 0.4647701254304996
Energy: 0.4160927714726949
Energy: 0.4790760589867373
Energy: 0.32333086581229137
Energy: 0.4790760589858156
Energy: 0.32252323864719173
Energy: 0.4486991294406209
Energy: 0.4028659879430459
Energy: 0.4486991294410817
Energy: 0.3591333551865417
Energy: 0.46090615662125956
Energy: 0.34794784849533233
Energy: 0.460906156619877
Energy: 0.3200094098277578
Energy: 0.47999133571443037
Energy: 0.46033193887108254
Energy: 0.4799913357139695
Energy: 0.3285616172459063
Energy: 0.493772160070711
Energy: 0.3641734096367139
Energy: 0.4937721600716327
Energy: 0.3190955944073315
Energy: 0.4483962391785263
Energy: 0.5640123310333574
Energy: 0.4483962391799089
Energy: 0.3082521261688896
Energy: 0.4731586755558355
Energy: 0.47680899309534974
Energy: 0.4731586755558355
Energy: 0.32043065674439947
Energy: 0.47916672009528566
Energy: 0.5957461987019759
Energy: 0.47916672009528566
Energy: 0.30683288827684024
Energy: 0.5044489060250904
Energy: 0.4564928170633235
Energy: 0.5044489060241687
Energy: 0.31896093931735636
Energy: 0.44867625354778257
Energy: 0.5650755759001553
Energy: 0.4486762535473217
Energy: 0.36877467388008417
Energy: 0.47319270059592305
Energy: 0.47671267538260315
Energy: 0.4731927005950013
Energy: 0.320399624188441
Energy: 0.4789640510767819
Energy: 0.5254826675638731
Energy: 0.4789640510763211
Energy: 0.3788824814292158
Energy: 0.5138591459873446
Energy: 0.3641431747872876
Energy: 0.5138591459869047
Energy: 0.3194706337553259
Energy: 0.42310172438156446
Energy: 0.4608189687008907
Energy: 0.4231017243820253
Energy: 0.3995210575151324
Energy: 0.4796270335117987
Energy: 0.3478482727020137
Energy: 0.4796270335117987
Energy: 0.3232964694175255
Energy: 0.4788697036277255
Energy: 0.4164629156078956
Energy: 0.47886970362818637
Energy: 0.40230289243633827
Energy: 0.5117361589266096
Energy: 0.323331470929518
Energy: 0.511736158925688
Energy: 0.34886201808183975
Energy: 0.4267428257485024
Energy: 0.3596477443117729
Energy: 0.42674282574804145
Energy: 0.48881240522213454
Energy: 0.4796063344234438
Energy: 0.3196127473259737
Energy: 0.4796063344234438
Energy: 0.36518426839059087
Energy: 0.4898151422000734
Energy: 0.3282262056998218
Energy: 0.48981514220053424
Energy: 0.4952073982202455
Energy: 0.5121850380960178
Energy: 0.3194271886017917
Energy: 0.5121850380960178
Energy: 0.47765097384747596
Energy: 0.4763487872488335
Energy: 0.3071420800912729
Energy: 0.47634878724837265
Energy: 0.6433995362979189
Energy: 0.47911263936995707
Energy: 0.3200533978486825
Energy: 0.47911263937087883
Energy: 0.4968110239746493
Energy: 0.5117408810221927
Energy: 0.3057796078829688
Energy: 0.5117408810217527
Energy: 0.5869771750801768
Energy: 0.5150608539489573
Energy: 0.3193678770631006
Energy: 0.5150608539484963
Energy: 0.4777722853198757
Energy: 0.47634861012662993
Energy: 0.30595584282632593
Energy: 0.4763486101270908
Energy: 0.5774856996161115
Energy: 0.4789507587029794
Energy: 0.3199584404482283
Energy: 0.4789507587029794
Energy: 0.3652761589228425
Energy: 0.5099800093655374
Energy: 0.37847251875189114
Energy: 0.5099800093655374
Energy: 0.43741759121946727
Energy: 0.5051861057192074
Energy: 0.32062625589226823
Energy: 0.5051861057196683
Energy: 0.34894240281368677
Energy: 0.4794052756461813
Energy: 0.39952066822056487
Energy: 0.4794052756461813
Energy: 0.4311046829166202
Energy: 0.47875008168482125
Energy: 0.3226784486335456
Energy: 0.47875008168482125
Energy: 0.3245419540227524
Energy: 0.5100125606320053
Energy: 0.40217643334012854
Energy: 0.5100125606320053
Energy: 0.33067307583126204
Energy: 0.49834478726512127
Energy: 0.3428713031833887
Energy: 0.498344787265582
Energy: 0.3190995503018064
Energy: 0.47921474677462994
Energy: 0.5023586912224504
Energy: 0.4792147467750908
Energy: 0.32733847902527874
Energy: 0.4898960664388157
Energy: 0.35985614740600275
Energy: 0.4898960664388157
Energy: 0.3203124715781808
Energy: 0.509822183927809
Energy: 0.4952393010688532
Energy: 0.5098221839273481

minimum gb energy = 0.3057796078829688 eV
minimum distance =  2.55143562132439 Angstroms
sigma value = 113


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

Energy: 0.011735058095383569
Energy: 0.013136872270835456
Energy: 0.39294520625027624
Energy: 0.013136872270835456
Energy: 0.392613156957168
Energy: 0.17518202558257523
Energy: 0.17566358184732372
Energy: 0.17518202558326412
Energy: 0.011735058095383569
Energy: 0.013136872270835456
Energy: 0.392945228183189
Energy: 0.013136872270835456
Energy: 0.392613156957168
Energy: 0.17518202558257523
Energy: 0.17566255324627747
Energy: 0.17518202558290982
Energy: 0.011735058095383569
Energy: 0.013136872270835456
Energy: 0.39294522001349513
Energy: 0.013136872270835456
Energy: 0.39261315695683335
Energy: 0.17518202558257523
Energy: 0.17566195507011922
Energy: 0.17518202558290982

minimum gb energy = 0.011735058095383569 eV
minimum distance =  2.83530845004234 Angstroms
sigma value = 1