Model name: model_name=EAM_Dynamo_MendelevKramerHao_2012_Ni__MO_832600236922_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.518121153116226
cohesive_energy=4.385853675380362
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.017911061564852403
Energy: 1.3305228930747675
Energy: 0.017911061564852403
Energy: 1.3305228930747675
Energy: 0.017911061564852403
Energy: 1.3305228930750987
Energy: 1.3305228930747675
Energy: 0.018174610914829168
Energy: 1.3305228930747675
Energy: 0.018174610895403592
Energy: 1.3305228930744364
Energy: 0.018174610905741826
Energy: 0.017911061564852403
Energy: 1.3305228930744364
Energy: 0.017911061564852403
Energy: 1.3305228930747675
Energy: 0.017911061564852403
Energy: 1.3305228930747675
Energy: 1.3305228930747675
Energy: 0.01817461089441024
Energy: 1.3305228930747675
Energy: 0.01817461091254813
Energy: 1.3305228930744364
Energy: 0.018174610903497583
Energy: 0.017911061564852403
Energy: 1.3305228930747675
Energy: 0.017911061564852403
Energy: 1.3305228930744364
Energy: 0.017911061564852403
Energy: 1.3305228930750987
Energy: 1.3305228930750987
Energy: 0.01817461090897942
Energy: 1.3305228930750987
Energy: 0.018174610902209905
Energy: 1.3305228930747675
Energy: 0.018174610900591106

minimum gb energy = 0.017911061564852403 eV
minimum distance =  2.4861477205138 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.3613763794690836
Energy: 1.3024691966851325
Energy: 1.3613763794682867
Energy: 1.3024691966843356
Energy: 1.3613763794682867
Energy: 1.3024691966835384
Energy: 1.4658928913092615
Energy: 1.2019586620598322
Energy: 1.465892891302885
Energy: 1.2019586620606293
Energy: 1.4658928913076672
Energy: 1.2019586620606293
Energy: 1.2803652006640773
Energy: 1.3664738876926612
Energy: 1.2803652006648745
Energy: 1.3664738876934581
Energy: 1.2803652006632804
Energy: 1.366473887687082
Energy: 1.489557146123579
Energy: 1.2543149266152265
Energy: 1.489557146122782
Energy: 1.2543149266144296
Energy: 1.489557146122782
Energy: 1.2543149266152265
Energy: 1.314710624243969
Energy: 1.436008989213535
Energy: 1.3147106242423752
Energy: 1.4360089892143322
Energy: 1.3147106242447661
Energy: 1.436008989211941
Energy: 1.3957610142540453
Energy: 1.2199941069583988
Energy: 1.3957610142540453
Energy: 1.219994106959993
Energy: 1.3957610142556394
Energy: 1.219994106959196
Energy: 1.2896732946867935
Energy: 1.3385882271651603
Energy: 1.2896732946883875
Energy: 1.3385882271651603
Energy: 1.2896732946844023
Energy: 1.3385882271683485
Energy: 1.2472989851474454
Energy: 1.4433990857761998
Energy: 1.2472989851442575
Energy: 1.4433990857849672
Energy: 1.2472989851434604
Energy: 1.4433990857754027
Energy: 1.4071973313237134
Energy: 1.3391140324871276
Energy: 1.4071973313229165
Energy: 1.3391140324871276
Energy: 1.4071973313237134
Energy: 1.3391140324871276
Energy: 1.1852795357476973
Energy: 1.4297861487191892
Energy: 1.1852795357453785
Energy: 1.4297861487319417
Energy: 1.1852795357476973
Energy: 1.4297861487215802
Energy: 1.3694159036994946
Energy: 1.2197447481199284
Energy: 1.3694159037002918
Energy: 1.2197447481199284
Energy: 1.3694159036986977
Energy: 1.2197447481199284
Energy: 1.1496064292800703
Energy: 1.3821254934292528
Energy: 1.1496064292808672
Energy: 1.3821254934308467
Energy: 1.1496064292800703
Energy: 1.3821254934308467
Energy: 1.5063891965548242
Energy: 1.1379742913284272
Energy: 1.5063891965580125
Energy: 1.1379742913284272
Energy: 1.5063891965532303
Energy: 1.1379742913292243
Energy: 1.2380976631562333
Energy: 1.2806254763619116
Energy: 1.2380976631554363
Energy: 1.2806254763611145
Energy: 1.2380976631547116
Energy: 1.2806254763635057
Energy: 1.5285448645931352
Energy: 1.1900459307831603
Energy: 1.5285448645907442
Energy: 1.1900459307815663
Energy: 1.5285448645787885
Energy: 1.1900459307815663
Energy: 1.5269755060436028
Energy: 1.3710962508625637
Energy: 1.5269755060428056
Energy: 1.3710962508553903
Energy: 1.5269755060436028
Energy: 1.371096250861767
Energy: 1.327929337835987
Energy: 1.3226088752434553
Energy: 1.327929337839175
Energy: 1.322608875241064
Energy: 1.3279293378407693
Energy: 1.3226088752418612
Energy: 1.3289951267378413
Energy: 1.2615433544901025
Energy: 1.328995126733059
Energy: 1.2615433544908994
Energy: 1.3289951267346531
Energy: 1.2615433544908994
Energy: 1.2545914099296218
Energy: 1.2537215717107544
Energy: 1.2545914099280278
Energy: 1.2537215717107544
Energy: 1.2545914099296218
Energy: 1.2537215717115515
Energy: 1.3801538098346107
Energy: 1.219835789490099
Energy: 1.3801538098242494
Energy: 1.2198357894932874
Energy: 1.3801538098250463
Energy: 1.219835789490099
Energy: 1.211414519471615
Energy: 1.4586332013028975
Energy: 1.211414519470818
Energy: 1.4586332013084768
Energy: 1.211414519471615
Energy: 1.45863320129413
Energy: 1.3884267071474015
Energy: 1.3415538276638517
Energy: 1.3884267071434164
Energy: 1.3415538276630548
Energy: 1.3884267071466045
Energy: 1.3415538276638517
Energy: 1.1443574117869657
Energy: 1.531151500373943
Energy: 1.1443574117869657
Energy: 1.531151500372349
Energy: 1.1443574117877626
Energy: 1.531151500372349

minimum gb energy = 1.1379742913284272 eV
minimum distance =  2.25538103953321 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.3666226175821878
Energy: 1.4333505204336519
Energy: 1.3666226175821878
Energy: 1.4333505204322916
Energy: 1.3666226175840015
Energy: 1.4333505204345582
Energy: 1.3939822849243115
Energy: 1.2688909513949411
Energy: 1.3939822849238581
Energy: 1.2688909513958477
Energy: 1.3939822849238581
Energy: 1.2688909513926743
Energy: 1.1459204049127385
Energy: 1.2670931435861887
Energy: 1.1459204049150054
Energy: 1.267093143582562
Energy: 1.1459204049140987
Energy: 1.2670931435848287
Energy: 1.4000895336837702
Energy: 1.4348016396633791
Energy: 1.4000895336842234
Energy: 1.4348016396633791
Energy: 1.4000895336846768
Energy: 1.4348016396638326
Energy: 1.268366217475318
Energy: 1.327413076247163
Energy: 1.268366217476678
Energy: 1.327413076241723
Energy: 1.268366217478945
Energy: 1.3274130762412695
Energy: 1.2671528297820445
Energy: 1.1459350858994302
Energy: 1.2671528297793242
Energy: 1.1459350858994302
Energy: 1.2671528297788712
Energy: 1.1459350858985238
Energy: 1.440251853629735
Energy: 1.3665399920238552
Energy: 1.440251853636082
Energy: 1.3665399920252155
Energy: 1.4402518536442424
Energy: 1.366539992024762
Energy: 1.1456924806715139
Energy: 1.36771936009181
Energy: 1.1456924806697004
Energy: 1.3677193600922632
Energy: 1.1456924806724205
Energy: 1.3677193600981572
Energy: 1.2229332594021518
Energy: 1.1502540511077757
Energy: 1.2229332594003384
Energy: 1.1502540511077757
Energy: 1.2229332593980715
Energy: 1.1502540511077757
Energy: 1.1329052476957568
Energy: 1.2819288211172675
Energy: 1.1329052476957568
Energy: 1.2819288211295081
Energy: 1.1329052476939434
Energy: 1.2819288211453757
Energy: 1.2820536621312373
Energy: 1.1372000684144081
Energy: 1.2820536621058904
Energy: 1.1372000684139547
Energy: 1.282053662113103
Energy: 1.1372000684144081
Energy: 1.1467953704806764
Energy: 1.225921066667568
Energy: 1.1467953704788632
Energy: 1.2259210666680214
Energy: 1.1467953704797695
Energy: 1.225921066667568
Energy: 1.367339658903455
Energy: 1.1462437802593675
Energy: 1.3673396589102553
Energy: 1.1462437802593675
Energy: 1.367339658917509
Energy: 1.1462437802598207
Energy: 1.3662953416081114
Energy: 1.4447984926545214
Energy: 1.3662953416081114
Energy: 1.4447984926572417
Energy: 1.366295341607205
Energy: 1.444798492657695
Energy: 1.2796025995273117
Energy: 1.2680928680858305
Energy: 1.2796025995254983
Energy: 1.268092868082204
Energy: 1.2796025995236846
Energy: 1.2680928680849242
Energy: 1.1461774824547406
Energy: 1.268878910445969
Energy: 1.1461774824547406
Energy: 1.2688789104464224
Energy: 1.1461774824533806
Energy: 1.268878910444609
Energy: 1.4316055184779612
Energy: 1.405664109296463
Energy: 1.4316055184775078
Energy: 1.405664109297823
Energy: 1.4316055184766014
Energy: 1.405664109297823
Energy: 1.2669218945770149
Energy: 1.1460456139379738
Energy: 1.2669218945684013
Energy: 1.1460456139370672
Energy: 1.2669218945697613
Energy: 1.1460456139366137
Energy: 1.2691708971309115
Energy: 1.2795737889692465
Energy: 1.2691708971309115
Energy: 1.2795737889701533
Energy: 1.2691708971318183
Energy: 1.2795737889733267
Energy: 1.4396153773757188
Energy: 1.3704369094380742
Energy: 1.4396153773766254
Energy: 1.3704369094385276
Energy: 1.4396153773793456
Energy: 1.3704369094380742
Energy: 1.1446143830368085
Energy: 1.4853092701031045
Energy: 1.1446143830327282
Energy: 1.4853092700922241
Energy: 1.1446143830354483
Energy: 1.485309270099931
Energy: 1.2674223189411038
Energy: 1.1501001447909056
Energy: 1.2674223189424638
Energy: 1.1501001447909056
Energy: 1.2674223189397436
Energy: 1.150100144790452
Energy: 1.1334703334109333
Energy: 1.2819982061514734
Energy: 1.1334703334104799
Energy: 1.2819982061451263
Energy: 1.1334703334136536
Energy: 1.2819982061401394
Energy: 1.2792288407664816
Energy: 1.2687771506562546
Energy: 1.2792288407551478
Energy: 1.2687771506571615
Energy: 1.2792288407488008
Energy: 1.2687771506571615
Energy: 1.1458965011935298
Energy: 1.2682789754556865
Energy: 1.1458965011912632
Energy: 1.2682789754416326
Energy: 1.1458965011912632
Energy: 1.268278975434379
Energy: 1.3669810149483441
Energy: 1.3939553576953838
Energy: 1.3669810149497041
Energy: 1.3939553576999175
Energy: 1.3669810149492507
Energy: 1.3939553577030908
Energy: 1.3670013489905426
Energy: 1.3939571038597798
Energy: 1.3670013489919026
Energy: 1.3939571038570595
Energy: 1.3670013489919026
Energy: 1.3939571038643133
Energy: 1.145953312110987
Energy: 1.2680587460529418
Energy: 1.1459533121118937
Energy: 1.2680587460443695
Energy: 1.1459533121118937
Energy: 1.2680587460525299
Energy: 1.2795347870660092
Energy: 1.2687949966250534
Energy: 1.2795347870487817
Energy: 1.2687949966255068
Energy: 1.2795347870542222
Energy: 1.2687949966264134
Energy: 1.1332302003048247
Energy: 1.280694489537424
Energy: 1.1332302003061845
Energy: 1.2806944895831716
Energy: 1.133230200306638
Energy: 1.2806944895636772
Energy: 1.2676253588021686
Energy: 1.1504089106287445
Energy: 1.2676253588044355
Energy: 1.1504089106291981
Energy: 1.2676253588021686
Energy: 1.1504089106291981
Energy: 1.1446638370180362
Energy: 1.4855790628219796
Energy: 1.144663837018943
Energy: 1.4855790628296452
Energy: 1.1446638370171294
Energy: 1.4855790628359922
Energy: 1.439626328378088
Energy: 1.370312140557433
Energy: 1.4396263283812614
Energy: 1.3703121405578864
Energy: 1.4396263283844348
Energy: 1.3703121405583396
Energy: 1.2694501980512731
Energy: 1.279554448396982
Energy: 1.2694501980444728
Energy: 1.279554448400609
Energy: 1.2694501980517263
Energy: 1.2795544484028756
Energy: 1.2670497464268609
Energy: 1.1460541231755348
Energy: 1.2670497464159804
Energy: 1.1460541231755348
Energy: 1.2670497464227808
Energy: 1.1460541231759882
Energy: 1.431819160331723
Energy: 1.400885618237493
Energy: 1.431819160331723
Energy: 1.4008856182379466
Energy: 1.4318191603308577
Energy: 1.4008856182370395
Energy: 1.1462197616481244
Energy: 1.2673050494882612
Energy: 1.1462197616454042
Energy: 1.2673050494891682
Energy: 1.146219761647671
Energy: 1.2673050494914349
Energy: 1.279436744762182
Energy: 1.2681314561930819
Energy: 1.2794367447581017
Energy: 1.2681314561948953
Energy: 1.2794367447617288
Energy: 1.2681314561921753
Energy: 1.3662570367431195
Energy: 1.4447967385821472
Energy: 1.3662570367444797
Energy: 1.4447967385798806
Energy: 1.3662570367444797
Energy: 1.4447967385780671
Energy: 1.3672477928956936
Energy: 1.1461944459689262
Energy: 1.3672477929043074
Energy: 1.1461944459675664
Energy: 1.367247792902494
Energy: 1.146194445968473
Energy: 1.1467976957430546
Energy: 1.2259380144739838
Energy: 1.146797695743508
Energy: 1.2259380144744372
Energy: 1.1467976957448678
Energy: 1.2259380144735306

minimum gb energy = 1.1329052476939434 eV
minimum distance =  2.32335888781698 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.33211868748914
Energy: 1.3599302984525972
Energy: 1.33211868748914
Energy: 1.3599302984525972
Energy: 1.33211868748914
Energy: 1.3599302984536477
Energy: 1.447696543782499
Energy: 1.2668359201953017
Energy: 1.4476965437803981
Energy: 1.2668359201953017
Energy: 1.447696543782499
Energy: 1.2668359201942512
Energy: 1.2293886713497257
Energy: 1.34279310896074
Energy: 1.2293886713497257
Energy: 1.3427931089617902
Energy: 1.2293886713497257
Energy: 1.342793108958639
Energy: 1.3242360981334655
Energy: 1.1640346111881852
Energy: 1.3242360981334655
Energy: 1.1640346111892355
Energy: 1.3242360981334655
Energy: 1.1640346111892355
Energy: 1.3493651968543705
Energy: 1.2931679852042766
Energy: 1.3493651968512195
Energy: 1.2931679852032263
Energy: 1.3493651968501688
Energy: 1.2931679852042766
Energy: 1.256830115408422
Energy: 1.293078342373945
Energy: 1.256830115411573
Energy: 1.293078342373945
Energy: 1.2568301154147243
Energy: 1.293078342373945
Energy: 1.3341575293070174
Energy: 1.2928492188313236
Energy: 1.334157529305967
Energy: 1.2928492188313236
Energy: 1.3341575293080679
Energy: 1.2928492188302734
Energy: 1.2450642933050655
Energy: 1.2944462400621073
Energy: 1.2450642933050655
Energy: 1.2944462400631578
Energy: 1.245064293304015
Energy: 1.2944462400631578
Energy: 1.5077298797870533
Energy: 1.1641174044243394
Energy: 1.5077298797902046
Energy: 1.1641174044243394
Energy: 1.5077298797891538
Energy: 1.1641174044243394
Energy: 1.1859847798147711
Energy: 1.5113434920067625
Energy: 1.1859847798137209
Energy: 1.511343492005712
Energy: 1.1859847798147711
Energy: 1.5113434920046616
Energy: 1.4103379678449306
Energy: 1.1846624659771636
Energy: 1.4103379678438803
Energy: 1.1846624659771636
Energy: 1.4103379678449306
Energy: 1.1846624659771636
Energy: 1.3292315177988285
Energy: 1.362909150329878
Energy: 1.3292315177988285
Energy: 1.362909150329878
Energy: 1.3292315177977783
Energy: 1.3629091503288273
Energy: 1.4425802020026557
Energy: 1.2665036372294913
Energy: 1.4425802020005547
Energy: 1.2665036372305418
Energy: 1.4425802020047565
Energy: 1.2665036372305418
Energy: 1.2814246023458593
Energy: 1.2631557478926714
Energy: 1.2814246023448086
Energy: 1.2631557478926714
Energy: 1.2814246023448086
Energy: 1.263155747891621
Energy: 1.3347586877812871
Energy: 1.3359422613155614
Energy: 1.3347586877812871
Energy: 1.3359422613166119
Energy: 1.3347586877812871
Energy: 1.3359422613155614
Energy: 1.3494440050305043
Energy: 1.2930458324288108
Energy: 1.3494440050326053
Energy: 1.2930458324288108
Energy: 1.3494440050326053
Energy: 1.2930458324298613
Energy: 1.3496005787537035
Energy: 1.4007672519758212
Energy: 1.3496005787568548
Energy: 1.4007672519789727
Energy: 1.3496005787537035
Energy: 1.400767251980023
Energy: 1.3359690279153857
Energy: 1.2981520968150249
Energy: 1.3359690279153857
Energy: 1.2981520968150249
Energy: 1.335969027916436
Energy: 1.2981520968150249

minimum gb energy = 1.1640346111881852 eV
minimum distance =  2.18991705003855 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.1110788814842416
Energy: 1.1389273761705745
Energy: 1.1110788814836186
Energy: 1.1389273761705745
Energy: 1.1110788814836186
Energy: 1.1389273761699512
Energy: 1.2466987647173429
Energy: 1.339055004119763
Energy: 1.2466987647123582
Energy: 1.339055004117894
Energy: 1.2466987647279066
Energy: 1.3390550041216325
Energy: 1.0703260961662842
Energy: 1.3382810711954933
Energy: 1.0703260961669074
Energy: 1.3382810711961164
Energy: 1.0703260961669074
Energy: 1.3382810711948703
Energy: 1.1684612123230746
Energy: 1.0703825961871896
Energy: 1.1684612123205822
Energy: 1.0703825961865663
Energy: 1.1684612123243208
Energy: 1.0703825961871896
Energy: 1.0973194894102996
Energy: 1.1075586487842335
Energy: 1.0973194894102996
Energy: 1.1075586487842335
Energy: 1.0973194894096765
Energy: 1.1075586487867257
Energy: 1.0973691106464107
Energy: 1.1077527953220243
Energy: 1.0973691106476569
Energy: 1.1077527953220243
Energy: 1.0973691106464107
Energy: 1.1077527953201551
Energy: 1.1684531420529418
Energy: 1.0704281947738044
Energy: 1.168453142055434
Energy: 1.070428194773181
Energy: 1.168453142056057
Energy: 1.0704281947750502
Energy: 1.0703308223792665
Energy: 1.3388187902870508
Energy: 1.0703308223767742
Energy: 1.3388187902876738
Energy: 1.0703308223780201
Energy: 1.3388187902882966
Energy: 1.246710091853983
Energy: 1.3390600825342713
Energy: 1.2467100918471574
Energy: 1.3390600825342713
Energy: 1.246710091850896
Energy: 1.339060082533648
Energy: 1.1110788814842416
Energy: 1.1389273761711973
Energy: 1.1110788814842416
Energy: 1.1389273761699512
Energy: 1.1110788814842416
Energy: 1.1389273761699512
Energy: 1.2466987647198349
Energy: 1.3390550041216325
Energy: 1.2466987647192123
Energy: 1.3390550041203861
Energy: 1.2466987647148506
Energy: 1.3390550041203861
Energy: 1.0703260961662842
Energy: 1.3382810711973625
Energy: 1.0703260961669074
Energy: 1.3382810711942472
Energy: 1.0703260961656613
Energy: 1.3382810711942472
Energy: 1.1684612123193363
Energy: 1.0703825961878124
Energy: 1.1684612123230746
Energy: 1.0703825961859434
Energy: 1.1684612123243208
Energy: 1.0703825961865663
Energy: 1.0973194894102996
Energy: 1.1075586487848565
Energy: 1.097319489411546
Energy: 1.1075586487836104
Energy: 1.0973194894109226
Energy: 1.1075586487848565
Energy: 1.0973691106464107
Energy: 1.107752795318286
Energy: 1.0973691106470338
Energy: 1.107752795319532
Energy: 1.0973691106457877
Energy: 1.1077527953201551
Energy: 1.1684531420529418
Energy: 1.0704281947738044
Energy: 1.1684531420529418
Energy: 1.0704281947738044
Energy: 1.168453142056057
Energy: 1.0704281947750502
Energy: 1.0703308223786434
Energy: 1.3388187902870508
Energy: 1.0703308223786434
Energy: 1.3388187902882966
Energy: 1.0703308223786434
Energy: 1.338818790282066
Energy: 1.2467100918570984
Energy: 1.3390600825355172
Energy: 1.2467100918459113
Energy: 1.3390600825355172
Energy: 1.246710091845288
Energy: 1.3390600825367636
Energy: 1.1110788814836186
Energy: 1.1389273761699512
Energy: 1.1110788814848647
Energy: 1.1389273761705745
Energy: 1.1110788814836186
Energy: 1.1389273761711973
Energy: 1.2466987647223275
Energy: 1.339055004119763
Energy: 1.2466987647148506
Energy: 1.3390550041222553
Energy: 1.2466987647148506
Energy: 1.3390550041216325
Energy: 1.0703260961662842
Energy: 1.3382810711954933
Energy: 1.0703260961669074
Energy: 1.3382810711942472
Energy: 1.0703260961669074
Energy: 1.3382810711948703
Energy: 1.1684612123236977
Energy: 1.0703825961865663
Energy: 1.1684612123243208
Energy: 1.0703825961859434
Energy: 1.1684612123230746
Energy: 1.0703825961859434
Energy: 1.097319489411546
Energy: 1.1075586487854798
Energy: 1.097319489411546
Energy: 1.1075586487823925
Energy: 1.0973194894109226
Energy: 1.107558648787972
Energy: 1.0973691106464107
Energy: 1.1077527953189088
Energy: 1.0973691106464107
Energy: 1.1077527953189088
Energy: 1.09736911064828
Energy: 1.1077527953220243
Energy: 1.168453142054188
Energy: 1.0704281947738044
Energy: 1.1684531420535649
Energy: 1.0704281947744274
Energy: 1.1684531420523185
Energy: 1.0704281947744274
Energy: 1.0703308223792665
Energy: 1.3388187902876738
Energy: 1.0703308223786434
Energy: 1.33881879028892
Energy: 1.0703308223786434
Energy: 1.3388187902858046
Energy: 1.246710091853983
Energy: 1.3390600825342713
Energy: 1.2467100918371883
Energy: 1.3390600825367636
Energy: 1.2467100918440421
Energy: 1.3390600825330252
Energy: 1.1110788814842416
Energy: 1.1389273761705745
Energy: 1.1110788814848647
Energy: 1.1389273761705745
Energy: 1.1110788814854875
Energy: 1.1389273761711973
Energy: 1.2466987647229504
Energy: 1.3390550041216325
Energy: 1.2466987647198349
Energy: 1.339055004119763
Energy: 1.2466987647204582
Energy: 1.339055004119763
Energy: 1.0703260961656613
Energy: 1.3382810711942472
Energy: 1.0703260961675305
Energy: 1.3382810711930009
Energy: 1.0703260961675305
Energy: 1.3382810711967397

minimum gb energy = 1.0703260961656613 eV
minimum distance =  2.20535026877995 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.1025749994639682
Energy: 1.0811313877610076
Energy: 1.1025749994639682
Energy: 1.0811313877610076
Energy: 1.1025749994639682
Energy: 1.0811313877610076
Energy: 1.2470255540229662
Energy: 1.1215806341349202
Energy: 1.2470255540229662
Energy: 1.1215806341349202
Energy: 1.2470255540229662
Energy: 1.1215806341349202
Energy: 1.1423619844601811
Energy: 1.245562653382039
Energy: 1.1423619844601811
Energy: 1.245562653382039
Energy: 1.142361984461707
Energy: 1.245562653382039
Energy: 1.2578975340154062
Energy: 1.048630274626954
Energy: 1.25789753401388
Energy: 1.0486302746284801
Energy: 1.2578975340168979
Energy: 1.0486302746284801
Energy: 1.2553653340073012
Energy: 1.0486303167074322
Energy: 1.2553653340073012
Energy: 1.0486303167074322
Energy: 1.2553653340118798
Energy: 1.0486303167074322
Energy: 1.2772703493228026
Energy: 1.3213619366203948
Energy: 1.2772703493228026
Energy: 1.3213619366188685
Energy: 1.2772703493166977
Energy: 1.3213619366188685
Energy: 1.0494518999319464
Energy: 1.1229266240792612
Energy: 1.0494518999334725
Energy: 1.1229266240792612
Energy: 1.0494518999319464
Energy: 1.1229266240792612
Energy: 1.0972380107888435
Energy: 1.0828242436347797
Energy: 1.0972380107888435
Energy: 1.0828242436332536
Energy: 1.0972380107888435
Energy: 1.0828242436332536
Energy: 1.249516087670692
Energy: 1.142052622554105
Energy: 1.249516087669166
Energy: 1.142052622638012
Energy: 1.249516087670692
Energy: 1.1420526222749112
Energy: 1.230156177859057
Energy: 1.2602415523641592
Energy: 1.230156177859057
Energy: 1.260241552362633
Energy: 1.230156177859057
Energy: 1.2602415523641592
Energy: 1.0824950335634893
Energy: 1.0497438409984559
Energy: 1.0824950335634893
Energy: 1.0497438409984559
Energy: 1.0824950335634893
Energy: 1.0497438409984559
Energy: 1.3231169796151327
Energy: 1.1909233100075454
Energy: 1.3231169796151327
Energy: 1.1909233100075454
Energy: 1.3231169796151327
Energy: 1.1909233100075454

minimum gb energy = 1.048630274626954 eV
minimum distance =  2.1728771687353 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.1123703684423585
Energy: 1.056816181659015
Energy: 1.1123703684419295
Energy: 1.0568161816607302
Energy: 1.1123703684419295
Energy: 1.0568161816624455
Energy: 1.061404256833683
Energy: 1.0663128742322632
Energy: 1.0614042568341115
Energy: 1.0663128742318342
Energy: 1.06140425683111
Energy: 1.0663128742331207
Energy: 0.9922937421981077
Energy: 1.1009607068670042
Energy: 0.9922937421985365
Energy: 1.1009607068631448
Energy: 0.9922937421976787
Energy: 1.1009607068644314
Energy: 1.0115415106414565
Energy: 0.9710223213186331
Energy: 1.0115415106402088
Energy: 0.9710223213190619
Energy: 1.0115415106402088
Energy: 0.9710223213173467
Energy: 1.0721302513497561
Energy: 1.05133373504256
Energy: 1.0721302513497561
Energy: 1.0513337350438465
Energy: 1.0721302513480406
Energy: 1.05133373504256
Energy: 1.0799043403461144
Energy: 1.1098086393789366
Energy: 1.0799043403512603
Energy: 1.1098086393883706
Energy: 1.0799043403452566
Energy: 1.1098086393780788
Energy: 1.0291769894117528
Energy: 1.0831065192659886
Energy: 1.029176989414326
Energy: 1.083106519267704
Energy: 1.029176989416899
Energy: 1.0831065192664175
Energy: 0.9553310493263145
Energy: 1.0873286249191239
Energy: 0.9553310493241703
Energy: 1.0873286249182663
Energy: 0.9553310493254569
Energy: 1.0873286249195528
Energy: 1.116728504580296
Energy: 1.0523254816690952
Energy: 1.116728504579438
Energy: 1.052325481669524
Energy: 1.1167285045790092
Energy: 1.052325481669953
Energy: 1.11348726787729
Energy: 1.1559207307875297
Energy: 1.1134872678785765
Energy: 1.155920730786672
Energy: 1.1134872678811496
Energy: 1.1559207307875297
Energy: 1.0089843233481766
Energy: 0.9784166920077099
Energy: 1.0089843233520357
Energy: 0.978416692007281
Energy: 1.0089843233498916
Energy: 0.9784166920068522
Energy: 1.0911076336180257
Energy: 1.1006246024830504
Energy: 1.0911076336188836
Energy: 1.1006246024779434
Energy: 1.0911076336141665
Energy: 1.1006246024796587
Energy: 1.0560750777980723
Energy: 1.0947455786719207
Energy: 1.0560750777937842
Energy: 1.0947455786719207
Energy: 1.0560750778006454
Energy: 1.0947455786719207
Energy: 1.1075858873449196
Energy: 1.0367074052588299
Energy: 1.1075858873453486
Energy: 1.0367074052562568
Energy: 1.107585887344491
Energy: 1.0367074052566856
Energy: 0.9931393146407987
Energy: 1.0696617076324462
Energy: 0.9931393146390833
Energy: 1.069661707635019
Energy: 0.99313931464037
Energy: 1.0696617076324462
Energy: 1.03100671562544
Energy: 1.0308172849556394
Energy: 1.0310067156245828
Energy: 1.0308172849552106
Energy: 1.03100671562544
Energy: 1.0308172849590702
Energy: 1.3109483767013141
Energy: 0.971994292130207
Energy: 1.3109483766978836
Energy: 0.971994292130207
Energy: 1.3109483766987415
Energy: 0.9719942921310647
Energy: 1.0021859285549013
Energy: 1.0381455863375526
Energy: 1.0021859285553303
Energy: 1.038145586336266
Energy: 1.0021859285527572
Energy: 1.0381455863375526
Energy: 0.952290830936804
Energy: 1.2780658597470398
Energy: 0.952290830939377
Energy: 1.2780658597483265
Energy: 0.9522908309380906
Energy: 1.2780658597478975
Energy: 1.1543513771177623
Energy: 1.069079136497772
Energy: 1.1543513771181912
Energy: 1.0690791364951995
Energy: 1.1543513771186198
Energy: 1.0690791364947705
Energy: 0.9522862933313031
Energy: 1.278234183930021
Energy: 0.9522862933265861
Energy: 1.2782341839313076
Energy: 0.9522862933308743
Energy: 1.2782341839338807
Energy: 1.0021649743556351
Energy: 1.038030061587837
Energy: 1.0021649743556351
Energy: 1.0380300615891236
Energy: 1.0021649743539196
Energy: 1.0380300615899811
Energy: 1.3110773473845163
Energy: 0.9717037393742449
Energy: 1.3110773473845163
Energy: 0.9717037393759603
Energy: 1.311077347384945
Energy: 0.9717037393729586
Energy: 1.0307244927770143
Energy: 1.0929648854163747
Energy: 1.0307244927744412
Energy: 1.0929648854150882
Energy: 1.0307244927727257
Energy: 1.0929648854138017
Energy: 0.9931868418822613
Energy: 1.069519538147526
Energy: 0.9931868418826901
Energy: 1.0695195381440952
Energy: 0.9931868418796883
Energy: 1.0695195381479548
Energy: 1.1076678336014942
Energy: 1.0700765862889774
Energy: 1.1076678336014942
Energy: 1.0700765862928365
Energy: 1.1076678336002077
Energy: 1.0700765862906927
Energy: 1.0558688003403556
Energy: 1.0946088960634224
Energy: 1.0558688003424996
Energy: 1.0946088960625646
Energy: 1.0558688003472168
Energy: 1.0946088960634224
Energy: 1.0906604581273207
Energy: 1.0561294109816868
Energy: 1.0906604581247477
Energy: 1.0561294109804003
Energy: 1.0906604581260342
Energy: 1.0561294109825443
Energy: 1.00902590444946
Energy: 0.9787702299999124
Energy: 1.0090259044468872
Energy: 0.9787702299990547
Energy: 1.0090259044481735
Energy: 0.9787702299994835
Energy: 1.1124184978352551
Energy: 1.02264642827559
Energy: 1.1124184978369704
Energy: 1.022646428285453
Energy: 1.1124184978365415
Energy: 1.0226464282794494
Energy: 1.1172168673240501
Energy: 1.0522866346382895
Energy: 1.1172168673266232
Energy: 1.0522866346391468
Energy: 1.117216867324479
Energy: 1.0522866346387183
Energy: 0.9553436971195276
Energy: 1.0877002437695014
Energy: 0.9553436971203851
Energy: 1.0877002437699301
Energy: 0.9553436971182412
Energy: 1.0877002437695014
Energy: 1.0293677580796214
Energy: 1.0829485939751975
Energy: 1.0293677580757623
Energy: 1.082948593976484
Energy: 1.0293677580774776
Energy: 1.0829485939751975
Energy: 1.0798556557477141
Energy: 1.0744617257529647
Energy: 1.079855655742997
Energy: 1.074461725756824
Energy: 1.0798556557391377
Energy: 1.074461725743959
Energy: 1.071971829651006
Energy: 1.0512238434039232
Energy: 1.0719718296522924
Energy: 1.0512238434030654
Energy: 1.071971829651435
Energy: 1.0512238434026364
Energy: 1.011508271937811
Energy: 0.9707744657403521
Energy: 1.011508271935667
Energy: 0.9707744657407809
Energy: 1.0115082719390975
Energy: 0.9707744657394944
Energy: 0.9923065077836324
Energy: 1.101035854623265
Energy: 0.9923065077840613
Energy: 1.1010358546254089
Energy: 0.992306507782346
Energy: 1.1010358546245513
Energy: 1.0610382345519862
Energy: 1.030062207671731
Energy: 1.061038234557132
Energy: 1.0300622076721597
Energy: 1.0610382345537015
Energy: 1.0300622076721597
Energy: 1.1123703684470756
Energy: 1.0568161816598725
Energy: 1.1123703684479331
Energy: 1.056816181661588
Energy: 1.1123703684483621
Energy: 1.0568161816607302
Energy: 1.0614042568302524
Energy: 1.0663128742318342
Energy: 1.0614042568328252
Energy: 1.0663128742322632
Energy: 1.0614042568328252
Energy: 1.0663128742314052
Energy: 0.9922937421998229
Energy: 1.100960706867862
Energy: 0.9922937422032536
Energy: 1.1009607068717213
Energy: 0.9922937422023959
Energy: 1.1009607068747231
Energy: 1.0115415106478889
Energy: 0.9710223213087701
Energy: 1.0115415106466024
Energy: 0.9710223213083412
Energy: 1.0115415106461736
Energy: 0.9710223213087701
Energy: 1.072130251350614
Energy: 1.0513337350545675
Energy: 1.072130251350185
Energy: 1.051333735052852
Energy: 1.0721302513480406
Energy: 1.051333735053281

minimum gb energy = 0.9522862933265861 eV
minimum distance =  2.23582191386269 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.5786366073536637
Energy: 0.5909982925535421
Energy: 0.5786366073536637
Energy: 0.5909982925496374
Energy: 0.5786366073536637
Energy: 0.5909982925437803
Energy: 0.6829474043925665
Energy: 0.5793897635646116
Energy: 0.682947404401352
Energy: 0.5793897635782779
Energy: 0.6829474044033044
Energy: 0.5793897635753494
Energy: 0.6246749881143097
Energy: 0.6824730609768374
Energy: 0.6246749881143097
Energy: 0.6824730609749294
Energy: 0.6246749881143097
Energy: 0.682473060961263
Energy: 0.5910204892416421
Energy: 0.5783603345159738
Energy: 0.5910204892416421
Energy: 0.5783603345198786
Energy: 0.5910204892406659
Energy: 0.5783603345315926
Energy: 0.6832862427424601
Energy: 0.6829902002390666
Energy: 0.6832862427541742
Energy: 0.6829902002390666
Energy: 0.6832862427453886
Energy: 0.6829902002390666
Energy: 0.5786047048075958
Energy: 0.6249270510424513
Energy: 0.5786047048115004
Energy: 0.6249270510307371
Energy: 0.5786047047997864
Energy: 0.6249270510424513
Energy: 0.5786211531212763
Energy: 0.6249073551572306
Energy: 0.578621153131038
Energy: 0.6249073551864713
Energy: 0.5786211531427521
Energy: 0.624907355176754
Energy: 0.6829974405145218
Energy: 0.6829811718869551
Energy: 0.68299744050476
Energy: 0.6829811718879312
Energy: 0.6829974405115933
Energy: 0.6829811718869551
Energy: 0.5910216076983573
Energy: 0.5783480619322495
Energy: 0.5910216076973811
Energy: 0.5783480619478683
Energy: 0.5910216077031938
Energy: 0.5783480619293654
Energy: 0.624818431954785
Energy: 0.6822815384529625
Energy: 0.624818431954785
Energy: 0.6822815384558909
Energy: 0.6248184319528326
Energy: 0.6822815384383643
Energy: 0.6828733255060317
Energy: 0.5793904386799562
Energy: 0.6828733254972461
Energy: 0.5793904386858133
Energy: 0.6828733255040794
Energy: 0.5793904386887418
Energy: 0.5786366073526875
Energy: 0.5909982925408963
Energy: 0.5786366073536637
Energy: 0.5909982925428042
Energy: 0.5786366073546398
Energy: 0.5909982925457328
Energy: 0.682947404377924
Energy: 0.57938976356754
Energy: 0.6829474043857333
Energy: 0.579389763584135
Energy: 0.6829474043759716
Energy: 0.5793897635929205
Energy: 0.6246749881133334
Energy: 0.6824730609865991
Energy: 0.6246749881143097
Energy: 0.6824730609797659
Energy: 0.6246749881133334
Energy: 0.682473060985623
Energy: 0.5910204892387135
Energy: 0.5783603345159738
Energy: 0.5910204892416421
Energy: 0.5783603345286641
Energy: 0.5910204892416421
Energy: 0.578360334527688
Energy: 0.6832862427561266
Energy: 0.6829902002390666
Energy: 0.6832862427561266
Energy: 0.6829902002390666
Energy: 0.6832862427531979
Energy: 0.6829902002390666
Energy: 0.5786047047997864
Energy: 0.6249270510424513
Energy: 0.5786047048095482
Energy: 0.6249270510424513
Energy: 0.5786047048134084
Energy: 0.6249270510483084
Energy: 0.5786211531261573
Energy: 0.6249073551513736
Energy: 0.5786211531378712
Energy: 0.6249073551494213
Energy: 0.578621153131038
Energy: 0.6249073551396596
Energy: 0.6829974405057362
Energy: 0.6829811718869551
Energy: 0.6829974405135456
Energy: 0.6829811718869551
Energy: 0.6829974405076885
Energy: 0.6829811718869551

minimum gb energy = 0.5783480619293654 eV
minimum distance =  2.42719918532707 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.0012336270373312
Energy: 1.123204419410874
Energy: 1.0012336270380466
Energy: 1.1232044194094437
Energy: 1.0012336270373312
Energy: 1.123204419410159
Energy: 1.1400764708662903
Energy: 1.0052050352822222
Energy: 1.14007647086772
Energy: 1.0052050352822222
Energy: 1.14007647086772
Energy: 1.005205035281507
Energy: 1.146792112582196
Energy: 1.2602915631047562
Energy: 1.146792112582196
Energy: 1.2602915631011808
Energy: 1.1467921125814813
Energy: 1.2602915631061864
Energy: 1.2872667510835758
Energy: 0.9343919632827322
Energy: 1.287266751085006
Energy: 0.9343919632834472
Energy: 1.2872667510842908
Energy: 0.9343919632827322
Energy: 1.098690688933083
Energy: 0.8945147143154203
Energy: 1.098690688933083
Energy: 0.8945147143154203
Energy: 1.098690688932368
Energy: 0.8945147143147053
Energy: 1.0814006746208804
Energy: 0.921961474050149
Energy: 1.0814006746194504
Energy: 0.9219614740437135
Energy: 1.0814006746215954
Energy: 0.9219614740515794
Energy: 0.9113659389067522
Energy: 0.9687996127927395
Energy: 0.9113659389074672
Energy: 0.9687996127948847
Energy: 0.9113659389038918
Energy: 0.9687996127913093
Energy: 1.141360626026145
Energy: 0.8785302047129272
Energy: 1.14136062602686
Energy: 0.8785302047136422
Energy: 1.1413606260282902
Energy: 0.8785302047136422
Energy: 1.1383731124768945
Energy: 0.8787072773089668
Energy: 1.1383731124761796
Energy: 0.8787072773089668
Energy: 1.13837311247761
Energy: 0.8787072773082518
Energy: 0.8988629224227246
Energy: 1.1888508999046692
Energy: 0.8988629224234396
Energy: 1.1888508999046692
Energy: 0.8988629224220096
Energy: 1.1888508999046692
Energy: 1.1179670696433996
Energy: 1.0968466047723475
Energy: 1.1179670696448298
Energy: 1.0968466047702021
Energy: 1.1179670696426847
Energy: 1.0968466047730625
Energy: 1.0056344227898733
Energy: 0.8972056753852441
Energy: 1.0056344227877279
Energy: 0.8972056753852441
Energy: 1.0056344227898733
Energy: 0.8972056753859591
Energy: 1.1641009267593718
Energy: 0.9357228579033141
Energy: 1.1641009267593718
Energy: 0.935722857902599
Energy: 1.1641009267572269
Energy: 0.9357228579033141
Energy: 1.1204134106310264
Energy: 1.2320408297422587
Energy: 1.1204134106324564
Energy: 1.2320408297401135
Energy: 1.1204134106338868
Energy: 1.2320408297408285
Energy: 1.1605946917593284
Energy: 1.0360643902032642
Energy: 1.160594691757898
Energy: 1.0360643902032642
Energy: 1.1605946917614733
Energy: 1.036064390201834
Energy: 0.9634898456872772
Energy: 1.1479417719263374
Energy: 0.9634898456872772
Energy: 1.1479417719270524
Energy: 0.9634898456879923
Energy: 1.1479417719263374
Energy: 0.9749828928845045
Energy: 1.0022060836152835
Energy: 0.9749828928816442
Energy: 1.002206083615999
Energy: 0.9749828928823593
Energy: 1.0022060836152835
Energy: 1.2714802803972578
Energy: 1.140892967843428
Energy: 1.271480280397973
Energy: 1.140892967843428
Energy: 1.2714802803951126
Energy: 1.140892967843428
Energy: 1.285944911360776
Energy: 0.9347585636642933
Energy: 1.285944911363636
Energy: 0.9347585636635782
Energy: 1.285944911363636
Energy: 0.9347585636642933
Energy: 1.1012497348657964
Energy: 1.0337180624314346
Energy: 1.1012497348643662
Energy: 1.0337180624314346
Energy: 1.1012497348665113
Energy: 1.0337180624314346
Energy: 0.8955997980744654
Energy: 0.9208605576682823
Energy: 0.8955997980744654
Energy: 0.9208605576711426
Energy: 0.8955997980723202
Energy: 0.9208605576675674
Energy: 0.9536826879364559
Energy: 0.9771267823911735
Energy: 0.9536826879343105
Energy: 0.9771267823926034
Energy: 0.9536826879307354
Energy: 0.9771267823961788
Energy: 1.0266866823302283
Energy: 1.058023693713426
Energy: 1.0266866823287981
Energy: 1.058023693712711
Energy: 1.0266866823295133
Energy: 1.058023693712711
Energy: 1.1375090238679733
Energy: 0.9990199440717489
Energy: 1.1375090238686885
Energy: 0.9990199440717489
Energy: 1.1375090238701184
Energy: 0.9990199440717489
Energy: 0.8961469940501293
Energy: 1.1904535081557037
Energy: 0.8961469940508444
Energy: 1.1904535081564191
Energy: 0.8961469940486994
Energy: 1.1904535081564191
Energy: 1.4630968836740297
Energy: 1.1011344531748999
Energy: 1.4630968836761749
Energy: 1.1011344531741847
Energy: 1.4630968836747449
Energy: 1.1011344531748999

minimum gb energy = 0.8785302047129272 eV
minimum distance =  2.25098001480267 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.092585711836799
Energy: 0.9729649355945179
Energy: 1.0925857118356719
Energy: 0.9729649355945179
Energy: 1.0925857118373627
Energy: 0.9729649355945179
Energy: 1.0502347805451355
Energy: 1.1945495204278984
Energy: 1.0502347805456993
Energy: 1.1945495204233898
Energy: 1.0502347805451355
Energy: 1.1945495204273349
Energy: 1.1435514444214545
Energy: 1.1320627881848342
Energy: 1.1435514444175092
Energy: 1.132062788185961
Energy: 1.1435514444197639
Energy: 1.1320627881870884
Energy: 1.0298121113233323
Energy: 0.9728566382949629
Energy: 1.0298121113244596
Energy: 0.9728566382955264
Energy: 1.0298121113238958
Energy: 0.9728566382955264
Energy: 0.9491818440646503
Energy: 0.9978788059408814
Energy: 0.9491818440640867
Energy: 0.9978788059414451
Energy: 0.9491818440640867
Energy: 0.9978788059420087
Energy: 1.22316323289319
Energy: 1.2099799660840953
Energy: 1.22316323289319
Energy: 1.2099799660829682
Energy: 1.22316323289319
Energy: 1.2099799660852226
Energy: 0.9837077079218836
Energy: 1.3035424555345994
Energy: 0.9837077079213199
Energy: 1.3035424555351627
Energy: 0.9837077079230105
Energy: 1.3035424555351627
Energy: 0.9609268060767359
Energy: 0.9725593196094291
Energy: 0.960926806077863
Energy: 0.9725593196094291
Energy: 0.9609268060772995
Energy: 0.9725593196094291
Energy: 0.9502493621937711
Energy: 0.9836039927789457
Energy: 0.9502493621937711
Energy: 0.9836039927789457
Energy: 0.9502493621948984
Energy: 0.9836039927795093
Energy: 1.0305060175199645
Energy: 1.0550120611258522
Energy: 1.0305060175199645
Energy: 1.0550120611274918
Energy: 1.0305060175199645
Energy: 1.055012061124725
Energy: 1.0334417813399122
Energy: 1.3023890478941593
Energy: 1.0334417813399122
Energy: 1.3023890478952862
Energy: 1.0334417813382215
Energy: 1.3023890478947229
Energy: 0.9426461415776991
Energy: 1.1733750096631779
Energy: 0.9426461415776991
Energy: 1.1733750096631779
Energy: 0.9426461415776991
Energy: 1.1733750096631779
Energy: 0.9612604660486564
Energy: 0.9717187794294372
Energy: 0.9612604660503473
Energy: 0.9717187794300007
Energy: 0.9612604660497837
Energy: 0.9717187794311278
Energy: 0.9354381751687837
Energy: 1.0661178281699373
Energy: 0.9354381751693474
Energy: 1.0661178281682469
Energy: 0.9354381751687837
Energy: 1.0661178281716281
Energy: 1.0319837892401489
Energy: 1.2108112257302313
Energy: 1.0319837892407127
Energy: 1.2108112257307948
Energy: 1.0319837892424033
Energy: 1.2108112257307948
Energy: 0.934879718748851
Energy: 1.171842931203498
Energy: 0.9348797187477238
Energy: 1.171842931203498
Energy: 0.9348797187482875
Energy: 1.171842931203498
Energy: 0.9765216482009998
Energy: 0.9718126414647265
Energy: 0.9765216482004362
Energy: 0.9718126414658536
Energy: 0.9765216482009998
Energy: 0.9718126414652899
Energy: 0.9999746870383001
Energy: 1.3741179861996675
Energy: 0.9999746870399909
Energy: 1.374117986199104
Energy: 0.999974687037173
Energy: 1.3741179862007946
Energy: 1.0487118648253948
Energy: 1.1944855402437637
Energy: 1.0487118648225768
Energy: 1.1944855402443273
Energy: 1.0487118648231404
Energy: 1.1944855402437637
Energy: 1.0298185333593504
Energy: 0.9788015624753901
Energy: 1.029818533361041
Energy: 0.9788015624753901
Energy: 1.029818533359914
Energy: 0.9788015624787717
Energy: 0.9501908708547545
Energy: 1.151893283475898
Energy: 0.9501908708553181
Energy: 1.151893283475898
Energy: 0.9501908708553181
Energy: 1.151893283475898
Energy: 1.0246108172556847
Energy: 1.299320361129915
Energy: 1.0246108172658295
Energy: 1.299320361129915
Energy: 1.0246108172534303
Energy: 1.299320361132169
Energy: 1.029111189281165
Energy: 0.9729405994872465
Energy: 1.029111189281165
Energy: 0.9729405994861193
Energy: 1.029111189281165
Energy: 0.9729405994872465
Energy: 0.9349582677049624
Energy: 1.1488046146782265
Energy: 0.9349582677049624
Energy: 1.1488046146770994
Energy: 0.9349582677043987
Energy: 1.1488046146770994
Energy: 0.9339910071306083
Energy: 1.3481038161104963
Energy: 0.9339910071311719
Energy: 1.3481038161088057
Energy: 0.9339910071300447
Energy: 1.3481038161099326
Energy: 0.9801911070424536
Energy: 1.0322656968237394
Energy: 0.9801911070435808
Energy: 1.0322656968237394
Energy: 0.9801911070435808
Energy: 1.0322656968243031
Energy: 0.9595365833818202
Energy: 0.972731960783294
Energy: 0.9595365833829475
Energy: 0.9727319607827304
Energy: 0.9595365833812566
Energy: 0.9727319607827304
Energy: 0.950605006742538
Energy: 1.1339091634957272
Energy: 0.9506050067431014
Energy: 1.1339091634957272
Energy: 0.9506050067419743
Energy: 1.1339091634951635
Energy: 1.0351226792556578
Energy: 1.2007789991499225
Energy: 1.035122679255094
Energy: 1.2007789991487954
Energy: 1.0351226792545305
Energy: 1.2007789991499225
Energy: 1.1167846054069113
Energy: 0.9810232903173649
Energy: 1.116784605405784
Energy: 0.9810232903173649
Energy: 1.1167846054108563
Energy: 0.9810232903173649
Energy: 0.9401829517734783
Energy: 1.1755525302782324
Energy: 0.9401829517734783
Energy: 1.1755525302776688
Energy: 0.9401829517740419
Energy: 1.1755525302782324
Energy: 0.9636020260839057
Energy: 0.9849767002296326
Energy: 0.9636020260839057
Energy: 0.9849767002290691
Energy: 0.9636020260839057
Energy: 0.9849767002296326
Energy: 0.9338751199481768
Energy: 1.172689699764789
Energy: 0.9338751199481768
Energy: 1.172689699764789
Energy: 0.9338751199493041
Energy: 1.172689699764789

minimum gb energy = 0.9338751199481768 eV
minimum distance =  2.29302583805294 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.0945358510848058
Energy: 1.0169385211890984
Energy: 1.094535851085597
Energy: 1.016938521189458
Energy: 1.0945358510848058
Energy: 1.0169385211883073
Energy: 1.1691250849744295
Energy: 1.000549537516882
Energy: 1.1691250849724157
Energy: 1.000549537516091
Energy: 1.1691250849716248
Energy: 1.000549537516091
Energy: 1.0788039003987222
Energy: 1.1624025056878602
Energy: 1.0788039003991536
Energy: 1.1624025056834733
Energy: 1.0788039003959893
Energy: 1.162402505686278
Energy: 1.1025916722376516
Energy: 1.0110595990270992
Energy: 1.10259167223571
Energy: 1.0110595990270992
Energy: 1.1025916722352787
Energy: 1.0110595990258766
Energy: 1.0392588052133493
Energy: 1.1031766866621227
Energy: 1.039258805212558
Energy: 1.1031766866640644
Energy: 1.0392588052113354
Energy: 1.1031766866632733
Energy: 1.3838594473188714
Energy: 1.0245879946678995
Energy: 1.38385944731844
Energy: 1.0245879946671086
Energy: 1.3838594473188714
Energy: 1.0245879946678995
Energy: 1.0413900171408121
Energy: 1.122557845754347
Energy: 1.0413900171444077
Energy: 1.1225578457547785
Energy: 1.0413900171431851
Energy: 1.122557845754347
Energy: 1.0826880293660806
Energy: 1.1019871358525812
Energy: 1.0826880293660806
Energy: 1.1019871358533724
Energy: 1.0826880293644985
Energy: 1.1019871358533724
Energy: 1.1267549321714636
Energy: 1.0338672299888987
Energy: 1.1267549321714636
Energy: 1.0338672299881075
Energy: 1.1267549321702413
Energy: 1.0338672299881075
Energy: 1.4326824225166022
Energy: 1.0179780309493727
Energy: 1.4326824225154515
Energy: 1.0179780309501638
Energy: 1.4326824225186157
Energy: 1.0179780309493727
Energy: 1.0807387561954709
Energy: 1.0840229723682517
Energy: 1.0807387561954709
Energy: 1.084022972369834
Energy: 1.0807387561954709
Energy: 1.0840229723682517
Energy: 1.6734385340701288
Energy: 1.0111272390150217
Energy: 1.6734385340689781
Energy: 1.0111272390142305
Energy: 1.6734385340701288
Energy: 1.0111272390146622
Energy: 1.0348936509877695
Energy: 1.129625870511603
Energy: 1.0348936509921565
Energy: 1.1296258704970041
Energy: 1.034893650989783
Energy: 1.1296258704949904
Energy: 1.0977510469044405
Energy: 1.0791566002873691
Energy: 1.0977510469032896
Energy: 1.0791566002889514
Energy: 1.0977510469032896
Energy: 1.0791566002889514
Energy: 1.0930204133337051
Energy: 1.0450432411063535
Energy: 1.0930204133324823
Energy: 1.0450432411055623
Energy: 1.0930204133332737
Energy: 1.045043241106785
Energy: 1.0264862735378453
Energy: 1.3862348044132558
Energy: 1.0264862735382048
Energy: 1.3862348044128963
Energy: 1.0264862735378453
Energy: 1.3862348044128963
Energy: 1.39666239870742
Energy: 1.0211541808375546
Energy: 1.396662398693972
Energy: 1.0211541808379863
Energy: 1.3966623987034648
Energy: 1.0211541808375546
Energy: 1.0082064595635578
Energy: 1.09799071463855
Energy: 1.008206459563198
Energy: 1.0979907146397725
Energy: 1.008206459565931
Energy: 1.0979907146401322
Energy: 1.160973944768805
Energy: 1.078230004132168
Energy: 1.160973944765209
Energy: 1.078230004129795
Energy: 1.160973944768805
Energy: 1.0782300041318087
Energy: 1.3903975794604937
Energy: 1.0372830187382676
Energy: 1.3903975794585521
Energy: 1.0372830187382676
Energy: 1.3903975794609251
Energy: 1.0372830187398498
Energy: 1.0204689858638476
Energy: 1.0995410618764223
Energy: 1.0204689858646387
Energy: 1.0995410618756314
Energy: 1.0204689858622655
Energy: 1.0995410618756314
Energy: 0.9983789754529592
Energy: 1.1331585085713387
Energy: 0.9983789754517367
Energy: 1.1331585085709788
Energy: 0.9983789754529592
Energy: 1.1331585085673832
Energy: 1.0934017399722553
Energy: 0.9982163085001511
Energy: 1.0934017399746285
Energy: 0.9982163085001511
Energy: 1.093401739974988
Energy: 0.9982163085013017
Energy: 1.0140837511232335
Energy: 1.1102390703962324
Energy: 1.0140837511220826
Energy: 1.110239070395801
Energy: 1.014083751123665
Energy: 1.110239070396592
Energy: 1.1031840899164005
Energy: 1.021393732613531
Energy: 1.103184089918774
Energy: 1.0213937326154725
Energy: 1.1031840899215786
Energy: 1.0213937326159042
Energy: 1.024591761588091
Energy: 1.0939564534349409
Energy: 1.0245917615868687
Energy: 1.0939564534349409
Energy: 1.0245917615896734
Energy: 1.0939564534349409
Energy: 1.1327858213850148
Energy: 1.0400928836014551
Energy: 1.1327858213877475
Energy: 1.0400928835998728
Energy: 1.1327858213901207
Energy: 1.0400928835998728
Energy: 1.087589655749641
Energy: 1.015915715633077
Energy: 1.0875896557476274
Energy: 1.0159157156322858
Energy: 1.0875896557480587
Energy: 1.015915715633077
Energy: 1.0361275760352717
Energy: 1.1275361813362346
Energy: 1.0361275760344804
Energy: 1.1275361813370255
Energy: 1.0361275760344804
Energy: 1.1275361813354434
Energy: 1.0187311510666004
Energy: 1.4319780356896838
Energy: 1.0187311510666004
Energy: 1.431978035690475
Energy: 1.0187311510661692
Energy: 1.4319780356869511
Energy: 1.0612331880588897
Energy: 1.0096166042159123
Energy: 1.0612331880565162
Energy: 1.0096166042163435
Energy: 1.061233188060472
Energy: 1.0096166042163435
Energy: 1.0141762285541476
Energy: 1.3953750665580775
Energy: 1.014176228552997
Energy: 1.3953750665707345
Energy: 1.0141762285573117
Energy: 1.3953750665667792
Energy: 1.3903890193648636
Energy: 1.0316286489400706
Energy: 1.3903890193645039
Energy: 1.0316286489388478
Energy: 1.3903890193624902
Energy: 1.0316286489400706
Energy: 1.0787820163679374
Energy: 1.09372475775155
Energy: 1.0787820163671462
Energy: 1.0937247577519817
Energy: 1.0787820163682968
Energy: 1.0937247577519817
Energy: 1.0785830960214868
Energy: 1.0937378213109576
Energy: 1.0785830960211273
Energy: 1.093737821310167
Energy: 1.078583096017963
Energy: 1.093737821310167
Energy: 1.3903716430802804
Energy: 1.0317277338193498
Energy: 1.3903716430834445
Energy: 1.0317277338197093
Energy: 1.3903716430838042
Energy: 1.0317277338189184
Energy: 1.0148779132968446
Energy: 1.3974180713562012
Energy: 1.0148779132968446
Energy: 1.3974180713577833
Energy: 1.014877913300009
Energy: 1.3974180713546192
Energy: 1.06082400149016
Energy: 1.0092956835854212
Energy: 1.06082400149016
Energy: 1.0092956835862121
Energy: 1.0608240014893688
Energy: 1.0092956835858526
Energy: 1.0187835219003993
Energy: 1.4319023871688135
Energy: 1.0187835218996082
Energy: 1.431902387168382
Energy: 1.0187835218988173
Energy: 1.4319023871688135
Energy: 1.0361382309059906
Energy: 1.1278782860596326
Energy: 1.0361382309051996
Energy: 1.1278782860671837
Energy: 1.0361382309067817
Energy: 1.1278782859644163
Energy: 1.0875778309096826
Energy: 1.015919880868265
Energy: 1.0875778309081006
Energy: 1.0159198808686245
Energy: 1.08757783090695
Energy: 1.015919880868265
Energy: 1.1326907147132326
Energy: 1.0400573367463104
Energy: 1.1326907147132326
Energy: 1.040057336745951
Energy: 1.1326907147116505
Energy: 1.040057336746742
Energy: 1.0246709783119579
Energy: 1.0937233840574954
Energy: 1.024670978312749
Energy: 1.0937233840595093
Energy: 1.0246709783123173
Energy: 1.0937233840571359
Energy: 1.1033584260398703
Energy: 1.0214762234845332
Energy: 1.1033584260449762
Energy: 1.0214762234841017
Energy: 1.1033584260394387
Energy: 1.0214762234845332
Energy: 1.014050717515585
Energy: 1.1099993536023043
Energy: 1.014050717516376
Energy: 1.1099993536023043
Energy: 1.0140507175147937
Energy: 1.1099993536003623
Energy: 1.093142332525541
Energy: 1.00657795381394
Energy: 1.0931423325259724
Energy: 1.0065779538150907
Energy: 1.0931423325267633
Energy: 1.0065779538142996
Energy: 0.9983513719292941
Energy: 1.132358114444995
Energy: 0.9983513719285031
Energy: 1.1323581144470085
Energy: 0.9983513719316675
Energy: 1.1323581144462176

minimum gb energy = 0.9982163085001511 eV
minimum distance =  2.29143181966944 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.1697744133068044
Energy: 1.0798220062632353
Energy: 1.1697744133068044
Energy: 1.0798220062632353
Energy: 1.1697744133068044
Energy: 1.0798220062632353
Energy: 1.1489382628703295
Energy: 1.0551707327324888
Energy: 1.1489382628703295
Energy: 1.0551707327324888
Energy: 1.1489382628729727
Energy: 1.0551707327324888
Energy: 1.1282790686656028
Energy: 1.2552816883271576
Energy: 1.1282790686682462
Energy: 1.2552816883271576
Energy: 1.1282790686682462
Energy: 1.2552816883271576
Energy: 1.1489476679659856
Energy: 1.0553729738318616
Energy: 1.1489476679659856
Energy: 1.055372973834505
Energy: 1.1489476679633421
Energy: 1.055372973834505
Energy: 1.1697744133094479
Energy: 1.0798220062632353
Energy: 1.1697744133120913
Energy: 1.0798220062632353
Energy: 1.1697744133120913
Energy: 1.0798220062658785
Energy: 1.1489382628703295
Energy: 1.0551707327324888
Energy: 1.1489382628703295
Energy: 1.0551707327324888
Energy: 1.1489382628703295
Energy: 1.0551707327324888
Energy: 1.4461351313752357
Energy: 1.2552816883271576
Energy: 1.1282790686735333
Energy: 1.2552816883271576
Energy: 1.1282790686735333
Energy: 1.2552816883271576

minimum gb energy = 1.0551707327324888 eV
minimum distance =  2.2911061580086 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.400130156672061
Energy: 1.253972820108637
Energy: 1.4001301566756583
Energy: 1.253972820108637
Energy: 1.400130156672061
Energy: 1.253972820108637
Energy: 1.2489391438903754
Energy: 1.1852507653727287
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Energy: 1.2035405078525352
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Energy: 1.2881056724244602
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Energy: 1.2881056724208628
Energy: 1.2303731878839421
Energy: 1.2881056724244602
Energy: 1.2303731878767477
Energy: 1.2635909551049922
Energy: 1.3663550207338555
Energy: 1.2635909551085895
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Energy: 1.3347683573298652
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Energy: 1.2737237544694018
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Energy: 1.2737237544694018
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Energy: 1.2737237544729991
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Energy: 1.3116205022779666
Energy: 1.1762362378271638
Energy: 1.311620502285096
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Energy: 1.3754318677241717
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Energy: 1.3754318677241717
Energy: 1.3349696818472672
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Energy: 1.3349696818472672
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Energy: 1.2035568403002428
Energy: 1.2571659685077559
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Energy: 1.2571659685077559
Energy: 1.2035568402966454
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Energy: 1.2999049015830095
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Energy: 1.2990236572001208
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Energy: 1.2112238792754961
Energy: 1.2441239102486077
Energy: 1.2112238792754961
Energy: 1.2441239102486077
Energy: 1.2699554818063752
Energy: 1.2769366382827698
Energy: 1.2699554818027778
Energy: 1.2769366382827698
Energy: 1.2699554818027778
Energy: 1.2769366382827698
Energy: 1.2674033094281918
Energy: 1.1801963036325844
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Energy: 1.2674033094281918
Energy: 1.1801963036325844
Energy: 1.3002244051364322
Energy: 1.1762441802329322
Energy: 1.3002244051364322
Energy: 1.1762441802329322
Energy: 1.3002244051400293
Energy: 1.1762441802365295
Energy: 1.2858011854653317
Energy: 1.2467505811528248
Energy: 1.2858011854581368
Energy: 1.2467505811564221
Energy: 1.2858011854617344
Energy: 1.2467505811564221
Energy: 1.33866555210459
Energy: 1.2107286588303043
Energy: 1.33866555210459
Energy: 1.2107286588303043
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Energy: 1.2971603467013344
Energy: 1.1750402032256515
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Energy: 1.1750402032256515
Energy: 1.297160346697737
Energy: 1.1750402032256515
Energy: 1.2598024798352259
Energy: 1.2712472827277062
Energy: 1.2598024798316283
Energy: 1.2712472827277062
Energy: 1.2598024798424206
Energy: 1.2712472827348353
Energy: 1.4152611502391519
Energy: 1.2793676553174935
Energy: 1.4152611502391519
Energy: 1.2793676553174935
Energy: 1.4152611502391519
Energy: 1.2793676553174935
Energy: 1.2115241093406715
Energy: 1.2397976366494776
Energy: 1.2115241093406715
Energy: 1.239797636653075
Energy: 1.211524109337074
Energy: 1.239797636653075
Energy: 1.3018562341586035
Energy: 1.2325898185823674
Energy: 1.3018562341622009
Energy: 1.2325898185859647
Energy: 1.3018562341586035
Energy: 1.2325898185859647
Energy: 1.2032002947477032
Energy: 1.3213747477567064
Energy: 1.2032002947441058
Energy: 1.3213747477567064
Energy: 1.2032002947477032
Energy: 1.3213747477567064
Energy: 1.4100873119578325
Energy: 1.2458280376889697
Energy: 1.4100873119613646
Energy: 1.2458280376889697
Energy: 1.4100873119721566
Energy: 1.2458280376889697
Energy: 1.16266932423812
Energy: 1.3044974437597092
Energy: 1.16266932423812
Energy: 1.3044974437597092
Energy: 1.16266932423812
Energy: 1.3044974437597092
Energy: 1.3364611508800006
Energy: 1.232718752335478
Energy: 1.336461150883598
Energy: 1.232718752335478
Energy: 1.3364611508800006
Energy: 1.2327187523318806
Energy: 1.2033884219662436
Energy: 1.3377408268754074
Energy: 1.2033884219626463
Energy: 1.3377408268861994
Energy: 1.203388421969841
Energy: 1.3377408268861994
Energy: 1.38506578641705
Energy: 1.1902094928385785
Energy: 1.38506578641705
Energy: 1.1902094928385785
Energy: 1.3850657864134526
Energy: 1.1902094928385785
Energy: 1.2165726824368355
Energy: 1.2440619891210483
Energy: 1.2165726824368355
Energy: 1.2440619891138536
Energy: 1.2165726824332381
Energy: 1.244061989117451
Energy: 1.3116347185011843
Energy: 1.175401682594096
Energy: 1.311634718497587
Energy: 1.175401682594096
Energy: 1.3116347185011843
Energy: 1.175401682594096
Energy: 1.274615809220508
Energy: 1.2590193579150977
Energy: 1.274615809220508
Energy: 1.2590193579150977
Energy: 1.2746158092241053
Energy: 1.2590193579115003
Energy: 1.3057789758212117
Energy: 1.2078532678134932
Energy: 1.3057789758176144
Energy: 1.2078532678134932
Energy: 1.3057789758212117
Energy: 1.2078532678134932
Energy: 1.2753020737224778
Energy: 1.2418806844884591
Energy: 1.2753020737260752
Energy: 1.2418806844848618
Energy: 1.2753020737224778
Energy: 1.2418806844884591
Energy: 1.2877482507129039
Energy: 1.2298886180989317
Energy: 1.2877482507129039
Energy: 1.229888618091737
Energy: 1.2877482507129039
Energy: 1.229888618091737
Energy: 1.2033247659918278
Energy: 1.3145460068471622
Energy: 1.203324765995425
Energy: 1.3145460068471622
Energy: 1.203324765995425
Energy: 1.3145460068471622
Energy: 1.2393635527325537
Energy: 1.2400537634765927
Energy: 1.2393635527325537
Energy: 1.2400537634801903
Energy: 1.2393635527325537
Energy: 1.2400537634765927
Energy: 1.2697215659413288
Energy: 1.2428513884352053
Energy: 1.2697215659377314
Energy: 1.2428513884352053
Energy: 1.2697215659377314
Energy: 1.2428513884352053

minimum gb energy = 1.16266932423812 eV
minimum distance =  2.23015594887412 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.4433390145464062
Energy: 1.3036009835415356
Energy: 1.3840044313237427
Energy: 1.3036009835528914
Energy: 1.443339014541469
Energy: 1.303600983551904
Energy: 1.366698535268024
Energy: 1.3272325660943665
Energy: 1.3666985352650618
Energy: 1.3272325660928854
Energy: 1.3666985352586434
Energy: 1.3272325660928854
Energy: 1.2714445456406493
Energy: 1.1605584106727553
Energy: 1.27121629964525
Energy: 1.1605584106618936
Energy: 1.2714445456436119
Energy: 1.1605584106628812
Energy: 1.2811818011667404
Energy: 1.2689487043722314
Energy: 1.2811818011623417
Energy: 1.2689487043648255
Energy: 1.2811818011559233
Energy: 1.2689487043643317
Energy: 1.384171912772852
Energy: 1.2728599240632548
Energy: 1.3841719127772956
Energy: 1.27285992406128
Energy: 1.3841719127733458
Energy: 1.272859924060786
Energy: 1.2723511376338401
Energy: 1.2868787684354726
Energy: 1.2723511376328527
Energy: 1.286878768437941
Energy: 1.2723511376318652
Energy: 1.2868787684369536
Energy: 1.255451431763457
Energy: 1.2906030070274077
Energy: 1.2550648091574028
Energy: 1.290603007032839
Energy: 1.255451431770863
Energy: 1.290603007032839
Energy: 1.378520448210487
Energy: 1.3613095711446133
Energy: 1.3785172516019726
Energy: 1.3613095711475756
Energy: 1.3785204482154239
Energy: 1.3613095711480694
Energy: 1.3538243649455872
Energy: 1.317493820296793
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Energy: 1.3174938203046476
Energy: 1.3538243649480557
Energy: 1.3174938203022237
Energy: 1.3483008443442246
Energy: 1.3591548801775408
Energy: 1.3483008443348887
Energy: 1.3591548801829718
Energy: 1.34830084433242
Energy: 1.3591548801829718
Energy: 1.3299522845510456
Energy: 1.2850539685225482
Energy: 1.329952284547096
Energy: 1.285053968508275
Energy: 1.329952284548577
Energy: 1.285053968508275
Energy: 1.274019318656518
Energy: 1.3064392011409385
Energy: 1.2740193186555306
Energy: 1.3064392011369885
Energy: 1.2740193186505935
Energy: 1.306439201136001
Energy: 1.3785987533725135
Energy: 1.3851283892790203
Energy: 1.3785987533735011
Energy: 1.3851283892726016
Energy: 1.3785987533725135
Energy: 1.3851283892716142
Energy: 1.3197801744737456
Energy: 1.1567976372369948
Energy: 1.3197801744732518
Energy: 1.1567976372369948
Energy: 1.3197801744727582
Energy: 1.1567976372369948
Energy: 1.2994336472978771
Energy: 1.2517018997586944
Energy: 1.2994336473018269
Energy: 1.2517018997582006
Energy: 1.299433647299852
Energy: 1.2517018997586944
Energy: 1.379108888373681
Energy: 1.2519727633429074
Energy: 1.379108888377137
Energy: 1.2519727633498197
Energy: 1.379108888375162
Energy: 1.2519727633503135
Energy: 1.3750386183368357
Energy: 1.2874335100209924
Energy: 1.3752406704269524
Energy: 1.287433510007662
Energy: 1.3750386183338732
Energy: 1.287433510007662
Energy: 1.256083711368204
Energy: 1.4427636906392987
Energy: 1.2560431361582662
Energy: 1.442763690647692
Energy: 1.2560837113657353
Energy: 1.442763690647692
Energy: 1.1582807810510902
Energy: 1.2537067464831408
Energy: 1.1582807810525713
Energy: 1.2537067464831408
Energy: 1.1582807810515838
Energy: 1.253706746482647
Energy: 1.2750867601034648
Energy: 1.36570940687042
Energy: 1.2750867601039586
Energy: 1.365709406865034
Energy: 1.2750867601034648
Energy: 1.3657094068660214
Energy: 1.2736481057520304
Energy: 1.3847544899540511
Energy: 1.2736481057470932
Energy: 1.3847544899486202
Energy: 1.2736481057461058
Energy: 1.3847544899486202
Energy: 1.3422842053638024
Energy: 1.287138081852912
Energy: 1.2761542860158548
Energy: 1.2871380818588367
Energy: 1.3422842053761455
Energy: 1.2871380818588367
Energy: 1.341669501323602
Energy: 1.1160447793318593
Energy: 1.2754142818739245
Energy: 1.1160447793427213
Energy: 1.3416695013270579
Energy: 1.1160447793437087
Energy: 1.3619873597828598
Energy: 1.3775091253449954
Energy: 1.3619873597853285
Energy: 1.3775091253459828
Energy: 1.3619873597838472
Energy: 1.3775091253459828
Energy: 1.318851848682899
Energy: 1.2570487152570877
Energy: 1.318851848682899
Energy: 1.2570487152565941
Energy: 1.3188518486824055
Energy: 1.2570487152570877
Energy: 1.3008013759204118
Energy: 1.496153252805404
Energy: 1.3008013759149806
Energy: 1.4961532527984918
Energy: 1.3008013759154742
Energy: 1.496153252797998
Energy: 1.256608242664437
Energy: 1.282536658566383
Energy: 1.2566082426634495
Energy: 1.2825366585693456
Energy: 1.256608242664437
Energy: 1.2825366585698392
Energy: 1.3298415378279347
Energy: 1.287819212170133
Energy: 1.32956550461619
Energy: 1.2878192121721082
Energy: 1.3298415378220547
Energy: 1.2878192121721082
Energy: 1.3265642940813571
Energy: 1.3807105859783215
Energy: 1.3264545378268302
Energy: 1.3807105859714093
Energy: 1.3265642940921742
Energy: 1.3807105859709157
Energy: 1.156697045800071
Energy: 1.195019498919838
Energy: 1.156697045808958
Energy: 1.1950194989277374
Energy: 1.156697045808958
Energy: 1.1950194989272438
Energy: 1.2733512294572382
Energy: 1.2998958468877444
Energy: 1.2733512294606941
Energy: 1.2998958468926816
Energy: 1.2733512294567444
Energy: 1.2998958468926816
Energy: 1.2764094638840107
Energy: 1.3774840603624336
Energy: 1.2764094638864796
Energy: 1.3774840603604588
Energy: 1.276409463883517
Energy: 1.3774840603604588
Energy: 1.2739085718337186
Energy: 1.2722360877893004
Energy: 1.2739085718376684
Energy: 1.2722360877952252
Energy: 1.273908571844087
Energy: 1.272236087795719
Energy: 1.276361699742031
Energy: 1.1136919905868343
Energy: 1.276361699742031
Energy: 1.1136919905863405
Energy: 1.2763616997454874
Energy: 1.1136919905868343
Energy: 1.2786989584826591
Energy: 1.4787659163812639
Energy: 1.2784368613258312
Energy: 1.4787659163674396
Energy: 1.2786989584826591
Energy: 1.4787659163679332
Energy: 1.3121814157256262
Energy: 1.2724344598172466
Energy: 1.3121814157236513
Energy: 1.2724344599263158
Energy: 1.3121814157217215
Energy: 1.2724344598740254
Energy: 1.3261786598296958
Energy: 1.277778783537685
Energy: 1.3261786598321645
Energy: 1.277778783545585
Energy: 1.3261786598375955
Energy: 1.2777787835465724
Energy: 1.28459938206766
Energy: 1.2901946733879568
Energy: 1.2845993820706225
Energy: 1.2901946733899317
Energy: 1.284599382066179
Energy: 1.2901946733899317

minimum gb energy = 1.1136919905863405 eV
minimum distance =  2.26530774505233 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.4199108306972605
Energy: 1.2620494706721437
Energy: 1.4199108306990798
Energy: 1.2620494706715375
Energy: 1.4199108306984736
Energy: 1.2620494706715375
Energy: 1.2697382790166842
Energy: 1.1779631300490985
Energy: 1.2697382790172906
Energy: 1.177963130048492
Energy: 1.2697382790166842
Energy: 1.1779631300490985
Energy: 1.326765787709203
Energy: 1.4013587149667943
Energy: 1.3267657877098096
Energy: 1.401358714967401
Energy: 1.326765787709203
Energy: 1.4013587149680073
Energy: 1.192808944597099
Energy: 1.2120451112679755
Energy: 1.1928089445964924
Energy: 1.2120451112679755
Energy: 1.1928089445995251
Energy: 1.2120451112673694
Energy: 1.271575802544996
Energy: 1.2652664417870898
Energy: 1.2715758025443895
Energy: 1.2652664417901223
Energy: 1.271575802544996
Energy: 1.265266441791335
Energy: 1.2427398357683335
Energy: 1.265910458524056
Energy: 1.242739835766514
Energy: 1.2659104585246626
Energy: 1.242739835766514
Energy: 1.265910458524056
Energy: 1.2865486088309592
Energy: 1.345066308779191
Energy: 1.2865486088315656
Energy: 1.345066308777978
Energy: 1.2865486088297464
Energy: 1.3450663087785844
Energy: 1.2277609776732517
Energy: 1.299284907432116
Energy: 1.2277609776732517
Energy: 1.2992849074327224
Energy: 1.2277609776726455
Energy: 1.2992849074327224
Energy: 1.3528212000042465
Energy: 1.1632825309086483
Energy: 1.3528212000054596
Energy: 1.1632825309086483
Energy: 1.3528212000054596
Energy: 1.1632825309086483
Energy: 1.2030851976842922
Energy: 1.260337443789542
Energy: 1.2030851976836856
Energy: 1.2603374437852968
Energy: 1.2030851976842922
Energy: 1.2603374437731678
Energy: 1.3785629070733434
Energy: 1.2410205911391747
Energy: 1.3785629070733434
Energy: 1.2410205911397814
Energy: 1.3785629070745564
Energy: 1.2410205911385683
Energy: 1.2275741669581033
Energy: 1.2917652275054943
Energy: 1.2275741669581033
Energy: 1.2917652267344115
Energy: 1.22757416695871
Energy: 1.291765225372915
Energy: 1.3042958432163299
Energy: 1.2656875710516686
Energy: 1.3042958432163299
Energy: 1.265687571051062
Energy: 1.3042958432163299
Energy: 1.2656875710516686
Energy: 1.1462243576785849
Energy: 1.355337171841811
Energy: 1.146224357679798
Energy: 1.3553371718424176
Energy: 1.146224357679798
Energy: 1.355337171841811
Energy: 1.2660314498960465
Energy: 1.265714785827937
Energy: 1.2660314498948335
Energy: 1.2657147858285434
Energy: 1.2660314498954401
Energy: 1.2657147858285434
Energy: 1.2398371332427116
Energy: 1.2848364420009695
Energy: 1.2398371332427116
Energy: 1.2848364420003628
Energy: 1.239837133242105
Energy: 1.2848364420009695
Energy: 1.3234168345866724
Energy: 1.1781933462847487
Energy: 1.3234168345878852
Energy: 1.1781933462841423
Energy: 1.3234168345884916
Energy: 1.1781933462841423
Energy: 1.3269786453500567
Energy: 1.2270757327645925
Energy: 1.3269786453482373
Energy: 1.2270757327645925
Energy: 1.326978645348844
Energy: 1.2270757327645925
Energy: 1.3269473698578453
Energy: 1.2337682483132641
Energy: 1.3269473698578453
Energy: 1.2337682483132641
Energy: 1.326947369857239
Energy: 1.2337682483132641
Energy: 1.320908349203621
Energy: 1.1799317760534442
Energy: 1.3209083492054405
Energy: 1.1799317760534442
Energy: 1.320908349201802
Energy: 1.1799317760534442
Energy: 1.2408021560384728
Energy: 1.3003230849301812
Energy: 1.2408021560366536
Energy: 1.3003230849332135
Energy: 1.2408021560372597
Energy: 1.300323084931394
Energy: 1.3510924968382614
Energy: 1.2569905248268907
Energy: 1.3510924968400808
Energy: 1.2569905248268907
Energy: 1.3510924968394744
Energy: 1.2569905248268907
Energy: 1.1463222084649296
Energy: 1.289465650121535
Energy: 1.1463222084661426
Energy: 1.289465650121535
Energy: 1.1463222084649296
Energy: 1.2894656501209285
Energy: 1.3020865153261545
Energy: 1.2658570652871102
Energy: 1.3020865153261545
Energy: 1.2658570652840777
Energy: 1.3020865153261545
Energy: 1.2658570652858974
Energy: 1.2278168389535178
Energy: 1.2458018976159204
Energy: 1.2278168389535178
Energy: 1.245801897616527
Energy: 1.2278168389535178
Energy: 1.2458018976159204
Energy: 1.3581163662545739
Energy: 1.2533253593540534
Energy: 1.3581163662539673
Energy: 1.2533253593540534
Energy: 1.3581163662545739
Energy: 1.25332535935466
Energy: 1.1994999616311424
Energy: 1.3375212395037817
Energy: 1.1994999616323554
Energy: 1.3375212395037817
Energy: 1.1994999616323554
Energy: 1.337521239503175
Energy: 1.3489891271692296
Energy: 1.2529491535777955
Energy: 1.3489891271649845
Energy: 1.2529491535784019
Energy: 1.3489891271637713
Energy: 1.2529491535777955
Energy: 1.2277018790825993
Energy: 1.2970507720515732
Energy: 1.227701879081993
Energy: 1.2970507720521796
Energy: 1.2277018790825993
Energy: 1.2970507720515732
Energy: 1.2720365830099594
Energy: 1.2852268890458878
Energy: 1.272036583009353
Energy: 1.2852268890452812
Energy: 1.2720365830075335
Energy: 1.2852268890464942
Energy: 1.2985818983320379
Energy: 1.265645996476388
Energy: 1.298581898332644
Energy: 1.2656459964769946
Energy: 1.2985818983332504
Energy: 1.2656459964769946

minimum gb energy = 1.1462243576785849 eV
minimum distance =  2.25389360450513 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.3145906751234955
Energy: 1.15533164030013
Energy: 1.3145906751219252
Energy: 1.15533164030013
Energy: 1.3145906751219252
Energy: 1.15533164030013
Energy: 1.2375283811595201
Energy: 1.1101036763740282
Energy: 1.2375283811587348
Energy: 1.1101036763740282
Energy: 1.2375283811587348
Energy: 1.1101036763740282
Energy: 1.2554517406978805
Energy: 1.3525282314832556
Energy: 1.2554517406970953
Energy: 1.3525282314832556
Energy: 1.2554517406978805
Energy: 1.3525282314832556
Energy: 1.2345177018151352
Energy: 1.2512186839019723
Energy: 1.2345177018151352
Energy: 1.2512186839019723
Energy: 1.2345177018159206
Energy: 1.2512186839027575
Energy: 1.3227484527354483
Energy: 1.2489799437317326
Energy: 1.3227484527338778
Energy: 1.2489799437317326
Energy: 1.3227484527330926
Energy: 1.2489799437340883
Energy: 1.2527682854740483
Energy: 1.1879099329465095
Energy: 1.2527682854756186
Energy: 1.1879099329457241
Energy: 1.252768285476404
Energy: 1.187909932944939
Energy: 1.2251096797899872
Energy: 1.3057221867865259
Energy: 1.225109679793128
Energy: 1.3057221867873112
Energy: 1.2251096797899872
Energy: 1.3057221867873112
Energy: 1.3244089304412339
Energy: 1.1569267300023243
Energy: 1.3244089304420188
Energy: 1.1569267300031096
Energy: 1.3244089304404487
Energy: 1.1569267300038948
Energy: 1.2414820158743378
Energy: 1.108293099940648
Energy: 1.241482015876658
Energy: 1.1082930999398626
Energy: 1.241482015879799
Energy: 1.1082930999390774
Energy: 1.0879679980292012
Energy: 1.2352107306523368
Energy: 1.087967998028416
Energy: 1.2352107306523368
Energy: 1.087967998028416
Energy: 1.2352107306515516
Energy: 1.2248206613111332
Energy: 1.25052169792962
Energy: 1.2248206613127035
Energy: 1.2505216979288347
Energy: 1.2248206613111332
Energy: 1.2505216979288347
Energy: 1.3576440126821792
Energy: 1.3041527921919205
Energy: 1.3576440126806089
Energy: 1.3041527921919205
Energy: 1.3576440126813942
Energy: 1.3041527921919205
Energy: 1.2367304975090447
Energy: 1.1087665812281253
Energy: 1.2367304975106155
Energy: 1.10876658122734
Energy: 1.2367304975090447
Energy: 1.1087665812281253
Energy: 1.3126523427829455
Energy: 1.115291082454975
Energy: 1.3126523427821604
Energy: 1.115291082454975
Energy: 1.3126523427829455
Energy: 1.115291082454975
Energy: 1.2052906356714588
Energy: 1.1146437797797355
Energy: 1.2052906356730293
Energy: 1.1146437797805209
Energy: 1.2052906356698883
Energy: 1.1146437797805209
Energy: 1.2416639228836426
Energy: 1.1943092051510082
Energy: 1.2416639228742201
Energy: 1.194309205150223
Energy: 1.2416639228773607
Energy: 1.194309205150223
Energy: 1.0840837316759762
Energy: 1.2204184506640545
Energy: 1.0840837316775467
Energy: 1.2204184506687659
Energy: 1.0840837316759762
Energy: 1.2204184506750477
Energy: 1.2270913013733458
Energy: 1.1851930252761653
Energy: 1.2270913013694198
Energy: 1.1851930252777358
Energy: 1.2270913013741311
Energy: 1.1851930252761653
Energy: 1.0841253133696787
Energy: 1.220538637480955
Energy: 1.0841253133673587
Energy: 1.2205386374856664
Energy: 1.0841253133688935
Energy: 1.2205386374856664
Energy: 1.2426454070683526
Energy: 1.1943457425216675
Energy: 1.2426454070714934
Energy: 1.1943457425224526
Energy: 1.2426454070699227
Energy: 1.1943457425224526
Energy: 1.2054688142260899
Energy: 1.112898087134648
Energy: 1.2054688142253045
Energy: 1.1128980871354335
Energy: 1.2054688142245191
Energy: 1.1128980871354335
Energy: 1.3127287162017656
Energy: 1.225845811670193
Energy: 1.3127287162033359
Energy: 1.2258458116694078
Energy: 1.3127287162025507
Energy: 1.225845811670193
Energy: 1.2368161137912599
Energy: 1.1087843872473113
Energy: 1.236816113792045
Energy: 1.1087843872449559
Energy: 1.236816113792045
Energy: 1.1087843872473113
Energy: 1.357769770789883
Energy: 1.3041199082889678
Energy: 1.357769770789883
Energy: 1.304119908286612
Energy: 1.357769770789883
Energy: 1.3041199082811157

minimum gb energy = 1.0840837316759762 eV
minimum distance =  2.27705275561765 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.212642667006857
Energy: 1.0938807093084695
Energy: 1.212642667006857
Energy: 1.0938807093084695
Energy: 1.2126426670079673
Energy: 1.0938807093084695
Energy: 1.0471125412106543
Energy: 1.0447671201057396
Energy: 1.0471125412106543
Energy: 1.0447671201057396
Energy: 1.0471125412106543
Energy: 1.0447671201057396
Energy: 1.1595920667618749
Energy: 1.2328711187954409
Energy: 1.1595920667629853
Energy: 1.2328711187954409
Energy: 1.159592066764096
Energy: 1.2328711187954409
Energy: 0.9785761575915123
Energy: 1.195663959039415
Energy: 0.9785761575926228
Energy: 1.195663959039415
Energy: 0.978576157590402
Energy: 1.195663959037194
Energy: 1.1794012939991647
Energy: 1.1401726688518101
Energy: 1.179401294000275
Energy: 1.1401726688518101
Energy: 1.179401294000275
Energy: 1.1401726688506995
Energy: 1.085727921129542
Energy: 1.1718980705255924
Energy: 1.085727921129542
Energy: 1.171898070524482
Energy: 1.0857279211284316
Energy: 1.171898070524482
Energy: 1.1616721870917515
Energy: 1.0369214380900795
Energy: 1.1616721870917515
Energy: 1.0369214380900795
Energy: 1.1616721870917515
Energy: 1.0369214380900795
Energy: 0.9784156174680801
Energy: 1.1830602306749451
Energy: 0.9784156174680801
Energy: 1.1830602306716138
Energy: 0.9784156174680801
Energy: 1.183060230678277
Energy: 1.1445000634513738
Energy: 1.0437837072192058
Energy: 1.1445000634513738
Energy: 1.0437837072192058
Energy: 1.1445000634502631
Energy: 1.0437837072192058
Energy: 1.117908611842142
Energy: 1.049095465770577
Energy: 1.117908611842142
Energy: 1.049095465770577
Energy: 1.117908611842142
Energy: 1.049095465770577
Energy: 1.1009144977202374
Energy: 1.1436392292347182
Energy: 1.1009144977202374
Energy: 1.1436392292347182
Energy: 1.100914497719127
Energy: 1.1436392292347182
Energy: 1.126844813785087
Energy: 1.0475192213850435
Energy: 1.1268448137861975
Energy: 1.0475192213850435
Energy: 1.126844813785087
Energy: 1.0475192213850435
Energy: 0.9785799218067124
Energy: 1.173729526087552
Energy: 0.9785799218067124
Energy: 1.173729526087552
Energy: 0.9785799218089335
Energy: 1.173729526087552
Energy: 1.1174687652788093
Energy: 1.1454198511786347
Energy: 1.1174687652788093
Energy: 1.1454198511786347
Energy: 1.1174687652788093
Energy: 1.1454198511786347
Energy: 1.0845330917578626
Energy: 1.240653152519948
Energy: 1.0845330917578626
Energy: 1.240653152519948
Energy: 1.084533091758973
Energy: 1.240653152519948
Energy: 1.08534119913566
Energy: 1.1689594700611485
Energy: 1.0853411991378306
Energy: 1.1689594700611485
Energy: 1.08534119913672
Energy: 1.1689594700611485
Energy: 1.1168704736651611
Energy: 1.1474722740023104
Energy: 1.1168704736651611
Energy: 1.1474722740023104
Energy: 1.1168704736662718
Energy: 1.1474722740012002

minimum gb energy = 0.9784156174680801 eV
minimum distance =  2.22051466164399 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.0968397925953333
Energy: 0.9801446299765577
Energy: 1.0968397925953333
Energy: 0.9801446299769866
Energy: 1.0968397925949043
Energy: 0.9801446299774154
Energy: 0.9874932460354834
Energy: 0.9552578485355362
Energy: 0.9874932460341969
Energy: 0.9552578485372514
Energy: 0.9874932460354834
Energy: 0.9552578485363938
Energy: 1.086104949118422
Energy: 1.057901779047256
Energy: 1.086104949118851
Energy: 1.057901779048542
Energy: 1.0861049491235681
Energy: 1.057901779046827
Energy: 0.9160608358550903
Energy: 1.0444864953229644
Energy: 0.9160608358379372
Energy: 1.0444864953221067
Energy: 0.9160608358516599
Energy: 1.044486495325537
Energy: 1.087880191595832
Energy: 0.9470165341895028
Energy: 1.0878801915954033
Energy: 0.9470165341903605
Energy: 1.0878801915949745
Energy: 0.9470165341890739
Energy: 1.0227475967691493
Energy: 1.0264913795916277
Energy: 1.022747596767434
Energy: 1.0264913795920567
Energy: 1.022747596767434
Energy: 1.0264913795907702
Energy: 0.989449478701537
Energy: 0.9680638756203401
Energy: 0.9894494787114001
Energy: 0.968063875620769
Energy: 0.9894494786694137
Energy: 0.9680638756216267
Energy: 0.9933686835904944
Energy: 1.1765296119466744
Energy: 0.9933686835904944
Energy: 1.1765296119458168
Energy: 0.9933686835913521
Energy: 1.1765296119462458
Energy: 1.004559090213493
Energy: 1.0469754284872674
Energy: 1.004559090213922
Energy: 1.0469754284872674
Energy: 1.0045590902160662
Energy: 1.0469754284855524
Energy: 0.9910426907381461
Energy: 0.8923141508440758
Energy: 0.9910426907385749
Energy: 0.892314150843647
Energy: 0.9910426907377173
Energy: 0.8923141508432184
Energy: 0.9162955704708872
Energy: 1.1401945064795438
Energy: 0.9162955704683143
Energy: 1.1401945064782573
Energy: 0.9162955704713159
Energy: 1.1401945064795438
Energy: 1.0793660636502462
Energy: 0.9734363247183538
Energy: 1.0793660636502462
Energy: 0.9734363247187826
Energy: 1.0793660636498175
Energy: 0.97343632471964
Energy: 1.0166298092868076
Energy: 0.9740539381314599
Energy: 1.0166298092850923
Energy: 0.9740539381245986
Energy: 1.0166298092863788
Energy: 0.9740539381301734
Energy: 1.000024550528578
Energy: 1.0607101289630188
Energy: 1.0000245505251475
Energy: 1.0607101289638763
Energy: 1.0000245505238612
Energy: 1.0607101289634477
Energy: 1.0456969042197277
Energy: 1.0788908043571963
Energy: 1.0456969042201567
Energy: 1.078890804355481
Energy: 1.0456969042171549
Energy: 1.078890804350764
Energy: 0.917308087477967
Energy: 1.119081725989997
Energy: 0.9173080874783958
Energy: 1.1190817259917125
Energy: 0.917308087477967
Energy: 1.1190817259908548
Energy: 1.0155486357101275
Energy: 1.012360489188806
Energy: 1.015548635710985
Energy: 1.012360489188377
Energy: 1.0155486357058392
Energy: 1.012360489188377
Energy: 1.0366694789880266
Energy: 1.1784691416208686
Energy: 1.0366694789893132
Energy: 1.1784691416200108
Energy: 1.0366694789888844
Energy: 1.1784691416208686
Energy: 0.9937786037769998
Energy: 1.1208938690448706
Energy: 0.9937786037769998
Energy: 1.1208938690452994
Energy: 0.9937786037757135
Energy: 1.1208938690461572
Energy: 1.0146353252309632
Energy: 0.9499403038582551
Energy: 1.0146353252331073
Energy: 0.9499403038582551
Energy: 1.0146353252335363
Energy: 1.0192493320431664
Energy: 0.9934868400708368
Energy: 1.1211420034043282
Energy: 0.9934868400712656
Energy: 1.121142003404757
Energy: 0.9934868400691215
Energy: 1.1211420034038995
Energy: 1.0367005571392978
Energy: 1.1784523412781267
Energy: 1.0367005571375825
Energy: 1.1784523412764114
Energy: 1.0367005571337229
Energy: 1.178452341277269
Energy: 1.0156008979040736
Energy: 1.0124493410241568
Energy: 1.0156008979049314
Energy: 1.012449341023299
Energy: 1.0156008979036448
Energy: 1.012449341023728
Energy: 0.9171734069465065
Energy: 1.0927572844814364
Energy: 0.9171734069533678
Energy: 1.092757284480579
Energy: 0.9171734069499372
Energy: 1.0927572844797213
Energy: 1.04550601936996
Energy: 1.0791486032094335
Energy: 1.0455060193665293
Energy: 1.0791486032055742
Energy: 1.04550601936996
Energy: 1.0791486032154372
Energy: 0.999936650129584
Energy: 1.0606362495749577
Energy: 0.99993665012744
Energy: 1.0606362495766732
Energy: 0.9999366501270113
Energy: 1.0606362495749577
Energy: 1.016904541410277
Energy: 0.9738879120200462
Energy: 1.016904541410706
Energy: 0.9738879120200462
Energy: 1.0169045414094195
Energy: 0.9738879120191888
Energy: 1.0793492823626436
Energy: 0.9735290448414922
Energy: 1.0793492823652164
Energy: 0.9735290448393481
Energy: 1.0793492823622148
Energy: 0.9735290448406347
Energy: 0.9160399398959286
Energy: 1.1403204416149904
Energy: 0.916039939894681
Energy: 1.1403204416162769
Energy: 0.9160399398933945
Energy: 1.1403204416158481
Energy: 0.9913368343932861
Energy: 0.8928978612323559
Energy: 0.9913368343941438
Energy: 0.8928978612323559
Energy: 0.9913368343950015
Energy: 0.8928978612319272
Energy: 1.006113000124898
Energy: 1.0468029248742894
Energy: 1.0061130001278609
Energy: 1.0468029248726132
Energy: 1.0061130001261844
Energy: 1.046802924873003
Energy: 0.9932607198420844
Energy: 1.1764772355820028
Energy: 0.9932607198005269
Energy: 1.1764772355828608
Energy: 0.9932607198094934
Energy: 1.1764772355828608
Energy: 0.9890533484030833
Energy: 0.9678899522012384
Energy: 0.9890533484094768
Energy: 0.9678899521999521
Energy: 0.9890533484034731
Energy: 0.9678899522020961
Energy: 1.0227787195195206
Energy: 0.9588776737723231
Energy: 1.0227787195195206
Energy: 0.9588776737731807
Energy: 1.022778719518663
Energy: 0.9588776737727519
Energy: 1.0879868295867758
Energy: 0.947084309512004
Energy: 1.087986829583774
Energy: 0.9470843095115751
Energy: 1.0879868295859183
Energy: 0.9470843095124328
Energy: 0.9158625540615113
Energy: 1.035374363824673
Energy: 0.915862554059367
Energy: 1.035374363825102
Energy: 0.9158625540585094
Energy: 1.0353743638242443
Energy: 1.0863408673114605
Energy: 1.058029845201398
Energy: 1.0863408673110315
Energy: 1.0580298452001118
Energy: 1.0863408673088872
Energy: 1.058029845201398
Energy: 0.989409607772006
Energy: 0.944475579832
Energy: 0.9894096077754367
Energy: 0.9444755798332864
Energy: 0.9894096077767233
Energy: 0.9444755798324288
Energy: 1.0968397925850413
Energy: 0.9801446299872784
Energy: 1.0968397925824682
Energy: 0.9801446299872784
Energy: 1.0968397925816105
Energy: 0.9801446299877071
Energy: 0.9874932460294797
Energy: 0.9552578485295324
Energy: 0.9874932460234761
Energy: 0.9552578485286749
Energy: 0.9874932460307663
Energy: 0.9552578485278173
Energy: 1.0861049491244257
Energy: 1.0579017790433964
Energy: 1.0861049491214239
Energy: 1.0579017790451115
Energy: 1.086104949126141
Energy: 1.0579017790433964
Energy: 0.9160608358469425
Energy: 1.028943425789415
Energy: 0.916060835840939
Energy: 1.0289434257885572
Energy: 0.916060835838366
Energy: 1.028943425789415
Energy: 1.0878801915919727
Energy: 0.9470165341834992
Energy: 1.0878801915941168
Energy: 0.9470165341843569
Energy: 1.0878801915928302
Energy: 0.9470165341839281

minimum gb energy = 0.8923141508432184 eV
minimum distance =  2.28406935128289 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.0086452784338737
Energy: 0.9072236224762712
Energy: 1.0086452784352702
Energy: 0.9072236224748746
Energy: 1.0086452784345719
Energy: 0.907223622475573
Energy: 1.0266089275144148
Energy: 0.8829148622218402
Energy: 1.0266089275109236
Energy: 0.8829148622232367
Energy: 1.02660892751232
Energy: 0.8829148622239349
Energy: 1.0495205442623525
Energy: 0.9923209425756374
Energy: 1.0495205442637492
Energy: 0.9923209425756374
Energy: 1.0495205442623525
Energy: 0.9923209425763355
Energy: 0.8640848388355851
Energy: 0.9715290565350206
Energy: 0.8640848388362834
Energy: 0.9715290565357189
Energy: 0.8640848388425674
Energy: 0.9715290565350206
Energy: 0.9976049395028087
Energy: 0.8377503351918872
Energy: 0.9976049395014123
Energy: 0.8377503351953784
Energy: 0.9976049395049035
Energy: 0.837750335193982
Energy: 0.962928927988293
Energy: 0.8928769330563665
Energy: 0.962928927988293
Energy: 0.8928769330556684
Energy: 0.9629289279848017
Energy: 0.8928769330549701
Energy: 0.8539188932110168
Energy: 0.9399279008960151
Energy: 0.8539188932989312
Energy: 0.9399279008953169
Energy: 0.8539188932054308
Energy: 0.9399279008960151
Energy: 1.1076346253854463
Energy: 1.0830862939291055
Energy: 1.1076346253847482
Energy: 1.0830862939291055
Energy: 1.1076346253854463
Energy: 1.0830862939312003
Energy: 0.8846704158181663
Energy: 0.8950610491051546
Energy: 0.8846704158167698
Energy: 0.8950610491058527
Energy: 0.8846704158160716
Energy: 0.8950610491058527
Energy: 0.9981532420255982
Energy: 0.9024512166931649
Energy: 0.9981532420262964
Energy: 0.9024512166931649
Energy: 0.9981532420276928
Energy: 0.9024512166938631
Energy: 1.0682042746615388
Energy: 1.0960633983419896
Energy: 1.068204274662237
Energy: 1.0960633983419896
Energy: 1.068204274662237
Energy: 1.0960633983419896
Energy: 0.9237398962624861
Energy: 0.8556879325451358
Energy: 0.9237398962624861
Energy: 0.8556879325611952
Energy: 0.9237398962603913
Energy: 0.855687932554213
Energy: 0.9105896832112818
Energy: 1.0012356714390553
Energy: 0.9105896832140746
Energy: 1.0012356714390553
Energy: 0.9105896832175657
Energy: 1.0012356714390553
Energy: 0.8626684540142542
Energy: 1.03583741046445
Energy: 0.8626684540184438
Energy: 1.0358374104630537
Energy: 0.8626684540142542
Energy: 1.0358374104609591
Energy: 0.9917376149876189
Energy: 0.9089246622196588
Energy: 0.9917376149897135
Energy: 0.9089246622182624
Energy: 0.9917376149876189
Energy: 0.9089246622189607
Energy: 0.9100171554062625
Energy: 0.9910653645340488
Energy: 0.9100171554041677
Energy: 0.9910653645340488
Energy: 0.910017155404866
Energy: 0.991065364534747
Energy: 0.9251497021571269
Energy: 0.9997155024885639
Energy: 0.9251497021557303
Energy: 0.9997155024892622
Energy: 0.9251497021585233
Energy: 0.9997155024878658
Energy: 1.0449459406049992
Energy: 1.0552493341604101
Energy: 1.0449459406063957
Energy: 1.0552493341604101
Energy: 1.0449459406063957
Energy: 1.0552493341604101
Energy: 0.8681463950765523
Energy: 1.0503259289112439
Energy: 0.8681463950751559
Energy: 1.0503259289105455
Energy: 0.8681463950744577
Energy: 1.0503259289105455
Energy: 0.8679904317644096
Energy: 0.9644112368481632
Energy: 0.867990431765806
Energy: 0.9644112368495596
Energy: 0.867990431765806
Energy: 0.9644112368488615
Energy: 0.9495141908835673
Energy: 1.0995147133491214
Energy: 0.9495141908856619
Energy: 1.0995147133491214
Energy: 0.9495141908814726
Energy: 1.0995147133491214
Energy: 0.8460872350683797
Energy: 1.0539694234192434
Energy: 0.8460872350683797
Energy: 1.0539694234199415
Energy: 0.8460872350669832
Energy: 1.0539694234199415
Energy: 0.9378337538372282
Energy: 0.9221665850243403
Energy: 0.9378337538351333
Energy: 0.9221665850243403
Energy: 0.9378337538365299
Energy: 0.9221665850243403
Energy: 0.9131015474688255
Energy: 1.0534796964286186
Energy: 0.9131015474744116
Energy: 1.0534796964230329
Energy: 0.9131015474737132
Energy: 1.053479696423731
Energy: 1.0317996194130175
Energy: 1.1019264868284167
Energy: 1.0317996194137156
Energy: 1.1019264868284167
Energy: 1.0317996194137156
Energy: 1.1019264868277185
Energy: 0.9079067170955651
Energy: 0.9211122467267725
Energy: 0.907906717094867
Energy: 0.9211122467274708
Energy: 0.9079067170941687
Energy: 0.9211122467274708
Energy: 0.8459381177322285
Energy: 1.0502747373449528
Energy: 0.8459381177343234
Energy: 1.0502747373470476
Energy: 0.8459381177336249
Energy: 1.0502747373463495

minimum gb energy = 0.8377503351918872 eV
minimum distance =  2.22205833862904 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.0729968959212195
Energy: 0.8267812271027603
Energy: 1.0729968959207108
Energy: 0.8267812271022515
Energy: 1.0729968959207108
Energy: 0.8267812271022515
Energy: 0.8815882524466148
Energy: 0.9180179988626355
Energy: 0.8815882524486498
Energy: 0.918017998863653
Energy: 0.8815882524471236
Energy: 0.9180179988631443
Energy: 0.8847616295091252
Energy: 0.9204813864902722
Energy: 0.8847616295086165
Energy: 0.9204813864892548
Energy: 0.8847616295075992
Energy: 0.9204813864892548
Energy: 1.0159196279204596
Energy: 0.8455365671068236
Energy: 1.0159196279209683
Energy: 0.8455365671068236
Energy: 1.015919627921477
Energy: 0.8455365671063149
Energy: 0.8747410659642006
Energy: 0.8716801249027213
Energy: 0.8747410659647094
Energy: 0.8716801249027213
Energy: 0.8747410659636919
Energy: 0.8716801249022126
Energy: 0.8304481311598898
Energy: 0.8816042680023233
Energy: 0.8304481311603987
Energy: 0.8816042680018144
Energy: 0.8304481311583637
Energy: 0.8816042680023233
Energy: 0.94908326873058
Energy: 0.8264282440191444
Energy: 0.9490832687310888
Energy: 0.8264282440186357
Energy: 0.9490832687310888
Energy: 0.8264282440186357
Energy: 0.8738132559475885
Energy: 0.921396621068443
Energy: 0.8738132559491146
Energy: 0.921396621068443
Energy: 0.873813255948606
Energy: 0.9213966210689517
Energy: 0.7933039802287554
Energy: 0.8688739021369679
Energy: 0.7933039802257028
Energy: 0.8688739021369679
Energy: 0.7933039802277377
Energy: 0.8688739021369679
Energy: 0.8857324998772856
Energy: 0.7887641677209121
Energy: 0.8857324998767769
Energy: 0.7887641677209121
Energy: 0.8857324998777946
Energy: 0.7887641677204033
Energy: 0.9428537706456628
Energy: 0.9314270527185321
Energy: 0.9428537706441364
Energy: 0.9314270527180234
Energy: 0.9428537706456628
Energy: 0.9314270527185321
Energy: 0.7606633563122187
Energy: 0.867861327241853
Energy: 0.7606633563127275
Energy: 0.8678613272408356
Energy: 0.7606633563132362
Energy: 0.8678613272428707
Energy: 0.8866461570382358
Energy: 0.7496143766480258
Energy: 0.8866461570387445
Energy: 0.7496143766485345
Energy: 0.8866461570387445
Energy: 0.7496143766480258
Energy: 0.9357313535550447
Energy: 0.936178456448316
Energy: 0.9357313535540273
Energy: 0.936178456448316
Energy: 0.9357313535555535
Energy: 0.936178456448316
Energy: 0.7834708013758066
Energy: 0.8676845433153151
Energy: 0.7834708013752979
Energy: 0.8676845433148064
Energy: 0.7834708013752979
Energy: 0.8676845433148064
Energy: 0.9117034085610138
Energy: 0.8245856444656338
Energy: 0.9117034085599963
Energy: 0.824585644465125
Energy: 0.9117034085610138
Energy: 0.8245856444656338
Energy: 0.9512588098083579
Energy: 0.9333652774728457
Energy: 0.9512588098093755
Energy: 0.9333652774718283
Energy: 0.9512588098093755
Energy: 0.9333652774718283
Energy: 0.8066099875928424
Energy: 0.9408257225803175
Energy: 0.8066099875902986
Energy: 0.9408257225798089
Energy: 0.8066099875913162
Energy: 0.9408257225808262
Energy: 0.8701356120914931
Energy: 0.8769081732475421
Energy: 0.8701356120914931
Energy: 0.8769081732475421
Energy: 0.8701356120925106
Energy: 0.8769081732475421
Energy: 0.9834424476601056
Energy: 0.8594897565757976
Energy: 0.983442447661123
Energy: 0.859489756571219
Energy: 0.9834424476595969
Energy: 0.8594897565747802
Energy: 0.8674331954059823
Energy: 0.8144852189268904
Energy: 0.867433195408526
Energy: 0.8144852189273992
Energy: 0.867433195406491
Energy: 0.8144852189268904
Energy: 0.9291381841813633
Energy: 0.8732480089414658
Energy: 0.9291381841813633
Energy: 0.8732480089404486
Energy: 0.929138184181872
Energy: 0.8732480089404486
Energy: 0.9261566300585832
Energy: 0.8723659258475172
Energy: 0.9261566300585832
Energy: 0.8723659258470084
Energy: 0.9261566300575658
Energy: 0.8723659258470084
Energy: 0.9060162214373516
Energy: 0.8157766414519088
Energy: 0.9060162214373516
Energy: 0.8157766414524176
Energy: 0.9060162214378603
Energy: 0.8157766414529263
Energy: 0.8712751602065261
Energy: 0.8562403347532964
Energy: 0.8712751602055088
Energy: 0.8562403347492265
Energy: 0.8712751602055088
Energy: 0.856240334750244
Energy: 0.8708180017843214
Energy: 0.842991234946504
Energy: 0.8708180017833039
Energy: 0.842991234946504
Energy: 0.8708180017848299
Energy: 0.842991234946504
Energy: 0.8280303888593231
Energy: 0.9713724374108337
Energy: 0.8280303888593231
Energy: 0.9713724374118512
Energy: 0.8280303888603406
Energy: 0.9713724374113424
Energy: 0.8369923840685768
Energy: 0.8487688310414597
Energy: 0.8369923840670506
Energy: 0.8487688310419684
Energy: 0.836992384068068
Energy: 0.8487688310419684
Energy: 0.7917493503720056
Energy: 0.7962196373850233
Energy: 0.7917493503720056
Energy: 0.7962196373850233
Energy: 0.7917493503720056
Energy: 0.7962196373845146
Energy: 0.7824463505304251
Energy: 0.9236053875924993
Energy: 0.782446350530934
Energy: 0.9236053875945344
Energy: 0.782446350530934
Energy: 0.9236053875996216
Energy: 0.8376044745936594
Energy: 0.8485515731524037
Energy: 0.8376044745941682
Energy: 0.8485515731559186
Energy: 0.8376044745931506
Energy: 0.8485515731529124
Energy: 0.7926879823003334
Energy: 0.7694991898958372
Energy: 0.7926879822988072
Energy: 0.7694991898963459
Energy: 0.7926879822988072
Energy: 0.7694991898963459
Energy: 0.7564267677936427
Energy: 0.8553963865217333
Energy: 0.7564267677941514
Energy: 0.8553963865227509
Energy: 0.7564267677941514
Energy: 0.8553963865227509
Energy: 0.941129737622881
Energy: 0.9488855055082839
Energy: 0.9411297376244072
Energy: 0.9488855055072665
Energy: 0.941129737622881
Energy: 0.9488855055082839
Energy: 0.8241550259395279
Energy: 0.7482662313898719
Energy: 0.8241550259390192
Energy: 0.7482662313888545
Energy: 0.824155025937493
Energy: 0.7482662313898719
Energy: 0.7098637468379035
Energy: 0.8541958211301638
Energy: 0.7098637468363772
Energy: 0.8541958211291464
Energy: 0.7098637468373948
Energy: 0.8541958211291464

minimum gb energy = 0.7098637468363772 eV
minimum distance =  2.2064523207536 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.44564786975170106
Energy: 0.48993908700571254
Energy: 0.11716290945962138
Energy: 0.48993908700571254
Energy: 0.44564786975170106
Energy: 0.4899390870019741
Energy: 0.9810420286720091
Energy: 0.11885813323322672
Energy: 0.9810420286738784
Energy: 0.11885813323322672
Energy: 0.9810420286738784
Energy: 0.11885813323509595
Energy: 0.4943299370528139
Energy: 0.11772441315660381
Energy: 0.4943299370528139
Energy: 0.11772441315660381
Energy: 0.4943299370528139
Energy: 0.11772441315286535
Energy: 0.11716290945962138
Energy: 0.48993908700571254
Energy: 0.11716290945962138
Energy: 0.48993908700571254
Energy: 0.11716290945962138
Energy: 0.4899390870019741
Energy: 0.9810420286757476
Energy: 0.11885813327991489
Energy: 0.9810420286757476
Energy: 0.11885813327804566
Energy: 0.9810420286757476
Energy: 0.11885813327617643
Energy: 0.4943299370509447
Energy: 0.11772441315660381
Energy: 0.4943299370509447
Energy: 0.11772441315660381
Energy: 0.4943299370528139
Energy: 0.11772441315473459
Energy: 0.4456478697535703
Energy: 0.4899390870075817
Energy: 0.11716290945962138
Energy: 0.4899390870075817
Energy: 0.4456478697535703
Energy: 0.48993908700571254
Energy: 0.9810420286776169
Energy: 0.11885813329299946
Energy: 0.9810420286757476
Energy: 0.11885813329299946
Energy: 0.9810420286776169
Energy: 0.11885813329113025
Energy: 0.4943299370528139
Energy: 0.11772441315847304
Energy: 0.4943299370546831
Energy: 0.11772441315847304
Energy: 0.4943299370528139
Energy: 0.11772441315660381
Energy: 0.11716290945962138
Energy: 0.48993908700571254
Energy: 0.11716290945962138
Energy: 0.48993908700571254
Energy: 0.11716290945962138
Energy: 0.4899390870001048

minimum gb energy = 0.11716290945962138 eV
minimum distance =  2.44293695921606 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.9462945078386271
Energy: 0.8286212613871686
Energy: 0.9462945078375083
Energy: 0.8286212613871686
Energy: 0.9462945078386271
Energy: 0.8286212613866093
Energy: 0.7996209871913993
Energy: 0.8222249760651325
Energy: 0.7996209871891616
Energy: 0.8222249760645731
Energy: 0.79962098719084
Energy: 0.8222249760651325
Energy: 0.8127961285003649
Energy: 0.8360705707952799
Energy: 0.8127961285003649
Energy: 0.8360705707952799
Energy: 0.8127961285014838
Energy: 0.8360705707947206
Energy: 0.8760141435426834
Energy: 0.8553835381718565
Energy: 0.8760141435426834
Energy: 0.8553835381724157
Energy: 0.8760141435426834
Energy: 0.8553835381718565
Energy: 0.7084114991025959
Energy: 0.8222373538180177
Energy: 0.7084114991037147
Energy: 0.8222373538174582
Energy: 0.7084114991042741
Energy: 0.8222373538180177
Energy: 0.8179509761161841
Energy: 0.8190376643975903
Energy: 0.8179509761161841
Energy: 0.8190376643959123
Energy: 0.8179509761161841
Energy: 0.8190376643970309
Energy: 0.8086852856942164
Energy: 0.8501418790861458
Energy: 0.8086852856964538
Energy: 0.8501418790861458
Energy: 0.8086852856964538
Energy: 0.850141879086705
Energy: 0.7086653230577072
Energy: 0.8217522286012633
Energy: 0.7086653230571478
Energy: 0.8217522286023821
Energy: 0.7086653230571478
Energy: 0.8217522286023821
Energy: 0.8241881227864162
Energy: 0.8203415148005739
Energy: 0.8241881227931288
Energy: 0.8203415147994552
Energy: 0.8241881227880945
Energy: 0.8203415148000146
Energy: 0.8103037747079815
Energy: 0.7425652810941408
Energy: 0.8103037747085409
Energy: 0.7425652810935813
Energy: 0.8103037747085409
Energy: 0.7425652810941408
Energy: 0.7450788862019266
Energy: 0.8269994569503593
Energy: 0.7450788862024861
Energy: 0.8269994569503593
Energy: 0.7450788862024861
Energy: 0.8269994569509186
Energy: 0.8427759052833076
Energy: 0.8575795117680756
Energy: 0.8427759052805108
Energy: 0.8575795117680756
Energy: 0.8427759052821889
Energy: 0.8575795117669568
Energy: 0.8334650373691561
Energy: 0.7070885085396088
Energy: 0.8334650373697154
Energy: 0.7070885085379306
Energy: 0.8334650373702747
Energy: 0.7070885085379306
Energy: 0.7694272321903375
Energy: 0.8378073630792031
Energy: 0.7694272321903375
Energy: 0.8378073630786438
Energy: 0.7694272321892186
Energy: 0.8378073630792031
Energy: 0.8094840118169323
Energy: 0.8372732251015963
Energy: 0.809484011816373
Energy: 0.8372732251015963
Energy: 0.8094840118169323
Energy: 0.837273225101037
Energy: 0.8330955647206314
Energy: 0.7018163606648699
Energy: 0.8330955647206314
Energy: 0.701816360666548
Energy: 0.8330955647211906
Energy: 0.7018163606654292
Energy: 0.821329867881029
Energy: 0.8679039554619814
Energy: 0.821329867881029
Energy: 0.8679039554619814
Energy: 0.821329867881029
Energy: 0.8679039554603032
Energy: 0.8259288240469589
Energy: 0.8193999043120225
Energy: 0.8259288240469589
Energy: 0.8193999043114631
Energy: 0.8259288240463996
Energy: 0.8193999043120225
Energy: 0.8324180796173898
Energy: 0.782574657742539
Energy: 0.8324180796173898
Energy: 0.7825746577408608
Energy: 0.8324180796179491
Energy: 0.782574657742539
Energy: 0.7984426527067103
Energy: 0.9256202886892649
Energy: 0.7984426527072697
Energy: 0.9256202886898244
Energy: 0.7984426527067103
Energy: 0.9256202886881462
Energy: 0.8637765676152678
Energy: 0.8056213289100235
Energy: 0.8637765676158271
Energy: 0.8056213289094641
Energy: 0.8637765676158271
Energy: 0.8056213289094641
Energy: 0.8756076801345813
Energy: 0.7997760963776986
Energy: 0.8756076801340219
Energy: 0.7997760963788175
Energy: 0.8756076801357
Energy: 0.7997760963793769
Energy: 0.8253711909414071
Energy: 0.8711168092301456
Energy: 0.8253711909419664
Energy: 0.8711168092301456
Energy: 0.8253711909408478
Energy: 0.8711168092301456
Energy: 0.8196709613465631
Energy: 0.7837776180902558
Energy: 0.8196709613454444
Energy: 0.7837776180902558
Energy: 0.8196709613465631
Energy: 0.7837776180902558
Energy: 0.8326600809476367
Energy: 0.8203125053032997
Energy: 0.8326600809465178
Energy: 0.8203125053032997
Energy: 0.8326600809465178
Energy: 0.820312505303859
Energy: 0.7900046519085963
Energy: 0.8354244135116393
Energy: 0.7900046519085963
Energy: 0.8354244135121986
Energy: 0.7900046519091556
Energy: 0.8354244135116393
Energy: 0.8364509512698287
Energy: 0.7219594776785152
Energy: 0.8364509512731341
Energy: 0.7219594776768371
Energy: 0.8364509512708966
Energy: 0.7219594776801932
Energy: 0.8090516999340327
Energy: 0.8247730223424743
Energy: 0.8090516999351514
Energy: 0.8247730223424743
Energy: 0.8090516999334731
Energy: 0.8247730223424743
Energy: 0.7604893105735575
Energy: 0.8356161377166706
Energy: 0.7604893105735575
Energy: 0.8356161377155519
Energy: 0.7604893105729982
Energy: 0.8356161377161113
Energy: 0.9112700639632397
Energy: 0.7598603652314674
Energy: 0.9112700639621208
Energy: 0.7598603652325862
Energy: 0.9112700639632397
Energy: 0.7598603652320268
Energy: 0.8456284593352431
Energy: 0.8225410648570188
Energy: 0.8456284593346838
Energy: 0.8225410648570188
Energy: 0.8456284593352431
Energy: 0.8225410648575783
Energy: 0.7343204455324753
Energy: 0.8197148681725067
Energy: 0.7343204455313566
Energy: 0.8197148681719473
Energy: 0.7343204455319159
Energy: 0.8197148681725067
Energy: 0.8208544512962529
Energy: 0.8142773461562962
Energy: 0.820854451297931
Energy: 0.8142773461562962
Energy: 0.8208544512973717
Energy: 0.8142773461557369

minimum gb energy = 0.7018163606648699 eV
minimum distance =  2.28105372166411 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.0532560561678401
Energy: 1.004352159091211
Energy: 1.053256056167043
Energy: 1.004352159091211
Energy: 1.053256056166246
Energy: 1.0043521590904139
Energy: 0.9439729168304325
Energy: 0.9836810800369138
Energy: 0.9439729168320264
Energy: 0.9836810800369138
Energy: 0.9439729168296354
Energy: 0.9836810800361168
Energy: 0.9809771752774193
Energy: 0.9834986944639175
Energy: 0.9809771752774193
Energy: 0.9834986944639175
Energy: 0.9809771752774193
Energy: 0.9834986944631203
Energy: 0.9986285402140868
Energy: 0.95484212568104
Energy: 0.9986285402124926
Energy: 0.9548421256778519
Energy: 0.9986285402164778
Energy: 0.9548421256802432
Energy: 0.8644884526518064
Energy: 0.9260357322291105
Energy: 0.8644884526534004
Energy: 0.9260357322299075
Energy: 0.8644884526541974
Energy: 0.9260357322283136
Energy: 0.9783948201535
Energy: 0.9606202353879496
Energy: 0.9783948201566882
Energy: 0.9606202353871527
Energy: 0.9783948201542971
Energy: 0.9606202353871527
Energy: 0.9387278017262648
Energy: 0.9286360001047382
Energy: 0.9387278017238735
Energy: 0.9286360001055354
Energy: 0.9387278017262648
Energy: 0.9286360001047382
Energy: 0.9334026752409593
Energy: 0.9157108765511222
Energy: 0.9334026752369741
Energy: 0.9157108765511222
Energy: 0.9334026752393652
Energy: 0.915710876550325
Energy: 0.9990295091051554
Energy: 1.0078534559721046
Energy: 0.9990295091059525
Energy: 1.0078534559721046
Energy: 0.9990295091035613
Energy: 1.0078534559721046
Energy: 0.9530930148513612
Energy: 0.8811950855588184
Energy: 0.9530930148513612
Energy: 0.8811950855612094
Energy: 0.9530930148513612
Energy: 0.8811950855612094
Energy: 0.9867882450981739
Energy: 0.9664586090523118
Energy: 0.9867882450973767
Energy: 0.9664586090507178
Energy: 0.9867882450981739
Energy: 0.9664586090515149
Energy: 0.9518505986249451
Energy: 0.9752160922593622
Energy: 0.9518505986265391
Energy: 0.9752160922593622
Energy: 0.9518505986249451
Energy: 0.9752160922601594
Energy: 0.9514534618776405
Energy: 0.9244728331354142
Energy: 0.9514534618784375
Energy: 0.9244728331354142
Energy: 0.9514534618784375
Energy: 0.9244728331354142
Energy: 0.9638944181160065
Energy: 1.0034865686259224
Energy: 0.9638944181176007
Energy: 1.0034865686251255
Energy: 0.9638944181160065
Energy: 1.0034865686251255
Energy: 0.9554131649801194
Energy: 0.9416021689918193
Energy: 0.9554131649801194
Energy: 0.9416021689918193
Energy: 0.9554131649809166
Energy: 0.9416021689910221
Energy: 0.988131083103051
Energy: 0.9520433756955351
Energy: 0.9881310831046451
Energy: 0.9520433756963321
Energy: 0.9881310831046451
Energy: 0.9520433756963321
Energy: 0.9889667164317341
Energy: 0.9893123555873774
Energy: 0.9889667164301401
Energy: 0.9893123555889713
Energy: 0.9889667164301401
Energy: 0.9893123555881742
Energy: 0.9744944594451976
Energy: 0.9233095546719146
Energy: 0.9744944594451976
Energy: 0.9233095546711175
Energy: 0.9744944594444006
Energy: 0.9233095546711175
Energy: 0.9713235947273972
Energy: 0.9869785533909566
Energy: 0.9713235947273972
Energy: 0.9869785533901596
Energy: 0.971323594728194
Energy: 0.9869785533901596
Energy: 0.9172820465694659
Energy: 0.9844600001378445
Energy: 0.9172820465670749
Energy: 0.9844600001378445
Energy: 0.9172820465670749
Energy: 0.9844600001378445
Energy: 1.0127686079283589
Energy: 0.9257360985943787
Energy: 1.0127686079291556
Energy: 0.9257360985935815
Energy: 1.0127686079275617
Energy: 0.9257360985935815
Energy: 0.9964374060299155
Energy: 1.0077247444989608
Energy: 0.9964374060299155
Energy: 1.0077247444989608
Energy: 0.9964374060299155
Energy: 1.0077247444989608
Energy: 0.9122052341034254
Energy: 0.9833917100656429
Energy: 0.9122052341042224
Energy: 0.9833917100656429
Energy: 0.9122052341042224
Energy: 0.9833917100640486

minimum gb energy = 0.8644884526518064 eV
minimum distance =  2.29796294495873 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.1454380156471053
Energy: 1.0803233819599534
Energy: 1.1454380156466
Energy: 1.0803233819594475
Energy: 1.1454380156466
Energy: 1.0803233819594475
Energy: 1.0516930428641003
Energy: 1.060058153432013
Energy: 1.0516930428626294
Energy: 1.060058153432013
Energy: 1.0516930428626294
Energy: 1.060058153432013
Energy: 1.0987520285496453
Energy: 1.0571963405677411
Energy: 1.0987520285496453
Energy: 1.0571963405677411
Energy: 1.0987520285496453
Energy: 1.0571963405677411
Energy: 1.0836093216874958
Energy: 1.0846016119277269
Energy: 1.0836093216874958
Energy: 1.0846016119277269
Energy: 1.0836093216880014
Energy: 1.0846016119277269
Energy: 1.0430125575823277
Energy: 1.0570117353185418
Energy: 1.0430125575823277
Energy: 1.0570117353180362
Energy: 1.0430125575813165
Energy: 1.0570117353175306
Energy: 1.138092502795799
Energy: 1.1148071740517
Energy: 1.1380925027978215
Energy: 1.1148071740517
Energy: 1.138092502795799
Energy: 1.1148071740521597
Energy: 1.0786802283102026
Energy: 1.0377040225983876
Energy: 1.0786802283102026
Energy: 1.0377040226004102
Energy: 1.0786802283086856
Energy: 1.0377040225999044
Energy: 1.1020714974609571
Energy: 1.0627742810637897
Energy: 1.102071497461463
Energy: 1.0627742810642953
Energy: 1.1020714974609571
Energy: 1.062774281063284
Energy: 1.0342716238652288
Energy: 1.0857136581009745
Energy: 1.0342716238657346
Energy: 1.0857136581009745
Energy: 1.03427162386624
Energy: 1.0857136581009745
Energy: 1.1274348767221098
Energy: 1.0399338540920808
Energy: 1.1274348767210984
Energy: 1.0399338540925864
Energy: 1.1274348767226154
Energy: 1.0399338540925864
Energy: 1.06701155085811
Energy: 1.0575020973401588
Energy: 1.0670115508596267
Energy: 1.0575020973401588
Energy: 1.06701155085811
Energy: 1.0575020973396534
Energy: 1.052875646394021
Energy: 1.0432683612053348
Energy: 1.052875646394021
Energy: 1.043268361204829
Energy: 1.0528756463930096
Energy: 1.0432683612043234
Energy: 1.13016782451993
Energy: 1.0597084697788623
Energy: 1.1301678245194704
Energy: 1.0597084697788623
Energy: 1.1301678245194704
Energy: 1.0597084697788623
Energy: 1.0383746021731817
Energy: 1.0611950818669513
Energy: 1.0383746021736875
Energy: 1.061195081867457
Energy: 1.0383746021736875
Energy: 1.0611950818669513
Energy: 1.083976375758683
Energy: 1.0743538545890194
Energy: 1.083976375759189
Energy: 1.0743538545890194
Energy: 1.083976375758683
Energy: 1.0743538545895248
Energy: 1.0835333230395299
Energy: 1.0897739905549322
Energy: 1.0835333230385187
Energy: 1.0897739905544264
Energy: 1.0835333230400355
Energy: 1.0897739905544264
Energy: 1.0213656406106222
Energy: 1.0576080417443052
Energy: 1.0213656406116336
Energy: 1.0576080417437994
Energy: 1.021365640611128
Energy: 1.0576080417443052
Energy: 1.1238602272254559
Energy: 1.1210581800349098
Energy: 1.1238602272244447
Energy: 1.121058180034404
Energy: 1.1238602272249505
Energy: 1.1210581800349098
Energy: 1.0433822390677072
Energy: 1.1316932375983613
Energy: 1.0433822390672014
Energy: 1.1316932375983613
Energy: 1.0433822390661902
Energy: 1.1316932375983613
Energy: 1.054619079908076
Energy: 1.0606773818881716
Energy: 1.0546190799070647
Energy: 1.0606773818871604
Energy: 1.054619079908076
Energy: 1.0606773818881716
Energy: 1.0791973663682564
Energy: 1.0896880740965782
Energy: 1.0791973663677505
Energy: 1.0896880740960726
Energy: 1.0791973663682564
Energy: 1.0896880740960726
Energy: 1.0800328804829773
Energy: 1.0242897815981848
Energy: 1.0800328804824715
Energy: 1.024289781599196
Energy: 1.0800328804839885
Energy: 1.0242897815981848
Energy: 1.0874330847774853
Energy: 1.057760109167458
Energy: 1.087433084774957
Energy: 1.057760109167458
Energy: 1.0874330847734401
Energy: 1.057760109167458
Energy: 1.127288158018731
Energy: 1.0389550170804527
Energy: 1.1272881580192367
Energy: 1.0389550170804527
Energy: 1.1272881580182255
Energy: 1.0389550170804527
Energy: 1.0506965671908333
Energy: 1.0382434777578058
Energy: 1.0506965671913389
Energy: 1.0382434777573
Energy: 1.0506965671938668
Energy: 1.0382434777578058
Energy: 1.0856878027137062
Energy: 1.0807527268159571
Energy: 1.0856878027132004
Energy: 1.0807527268159571
Energy: 1.0856878027132004
Energy: 1.0807527268159571
Energy: 1.0515093709016303
Energy: 1.0247234829814493
Energy: 1.0515093709026417
Energy: 1.0247234829814493
Energy: 1.0515093709026417
Energy: 1.0247234829814493
Energy: 1.0754027323928042
Energy: 1.1223115783098323
Energy: 1.0754027323917925
Energy: 1.1223115783098323
Energy: 1.0754027323928042
Energy: 1.1223115783098323
Energy: 1.0526491470399637
Energy: 1.0569990875521589
Energy: 1.052649147039458
Energy: 1.0569990875526645
Energy: 1.0526491470404693
Energy: 1.0569990875536757
Energy: 1.0428543964025596
Energy: 1.035462640636987
Energy: 1.042854396402054
Energy: 1.0354626406364813
Energy: 1.0428543964025596
Energy: 1.035462640636987
Energy: 1.1414726178442043
Energy: 1.1179575366825787
Energy: 1.1414726178452157
Energy: 1.1179575366825787
Energy: 1.1414726178431929
Energy: 1.1179575366830843
Energy: 1.0414423940873818
Energy: 1.0605806200695038
Energy: 1.0414423940863704
Energy: 1.0605806200700092
Energy: 1.0414423940873818
Energy: 1.0605806200695038
Energy: 1.0813426841743048
Energy: 1.0890555958900556
Energy: 1.0813426841743048
Energy: 1.0890555958900556
Energy: 1.0813426841758218
Energy: 1.0890555958905612
Energy: 1.0811699610988221
Energy: 1.0596898535534776
Energy: 1.081169961097811
Energy: 1.0596898535539834
Energy: 1.0811699610973053
Energy: 1.0596898535534776
Energy: 1.03955223044433
Energy: 1.0575441236115335
Energy: 1.0395522304453413
Energy: 1.0575441236110277
Energy: 1.03955223044433
Energy: 1.0575441236105223
Energy: 1.1483748670124412
Energy: 1.0646672308300504
Energy: 1.1483748670139584
Energy: 1.0646672308300504
Energy: 1.1483748670124412
Energy: 1.064667230830556
Energy: 1.0514359775514805
Energy: 1.0820473604725402
Energy: 1.051435977554009
Energy: 1.0820473604725402
Energy: 1.0514359775529978
Energy: 1.0820473604720346

minimum gb energy = 1.0213656406106222 eV
minimum distance =  2.26816252471916 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.2437450431766703
Energy: 1.2315115793948075
Energy: 1.2437450431752897
Energy: 1.2315115793948075
Energy: 1.2437450431766703
Energy: 1.231511579393427
Energy: 1.2044183612549826
Energy: 1.178412953126884
Energy: 1.2044183612549826
Energy: 1.178412953126884
Energy: 1.2044183612549826
Energy: 1.1784129531255036
Energy: 1.3029089201680866
Energy: 1.1726871221577906
Energy: 1.3029089201680866
Energy: 1.17268712215641
Energy: 1.3029089201680866
Energy: 1.17268712215641
Energy: 1.2262330941939616
Energy: 1.274104726447286
Energy: 1.2262330941953423
Energy: 1.274104726447286
Energy: 1.2262330941939616
Energy: 1.274104726447286
Energy: 1.2941879030790708
Energy: 1.1973082350354236
Energy: 1.2941879030776902
Energy: 1.197308235034043
Energy: 1.2941879030790708
Energy: 1.197308235034043
Energy: 1.3150226233694424
Energy: 1.2829392505369859
Energy: 1.3150226233694424
Energy: 1.2829392505369859
Energy: 1.3150226233694424
Energy: 1.2829392505383663
Energy: 1.22447726256388
Energy: 1.156363802719927
Energy: 1.22447726256388
Energy: 1.156363802719927
Energy: 1.22447726256388
Energy: 1.156363802719927
Energy: 1.2591337680699024
Energy: 1.1789851461123446
Energy: 1.259133768068522
Energy: 1.1789851461109642
Energy: 1.2591337680699024
Energy: 1.1789851461109642
Energy: 1.205927462725684
Energy: 1.205819810747588
Energy: 1.2059274627270644
Energy: 1.205819810747588
Energy: 1.205927462725684
Energy: 1.205819810747588
Energy: 1.2255775307516805
Energy: 1.1995102293787039
Energy: 1.2255775307544414
Energy: 1.1995102293787039
Energy: 1.2255775307544414
Energy: 1.1995102293787039
Energy: 1.2030633362180077
Energy: 1.1730404340938352
Energy: 1.2030633362193883
Energy: 1.1730404340924547
Energy: 1.2030633362193883
Energy: 1.1730404340938352
Energy: 1.249460195195219
Energy: 1.1774178590440716
Energy: 1.249460195195219
Energy: 1.1774178590440716
Energy: 1.2494601951965993
Energy: 1.177417859045452
Energy: 1.24489546970266
Energy: 1.2734769617237112
Energy: 1.24489546970266
Energy: 1.2734769617237112
Energy: 1.24489546970266
Energy: 1.2734769617223305
Energy: 1.2913218058568376
Energy: 1.1795944030777754
Energy: 1.2913218058568376
Energy: 1.1795944030777754
Energy: 1.2913218058582183
Energy: 1.179594403079156

minimum gb energy = 1.156363802719927 eV
minimum distance =  2.27079940296581 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.4329379545334353
Energy: 1.4300924580653647
Energy: 1.4329379545340417
Energy: 1.4300924580647585
Energy: 1.4329379545322223
Energy: 1.4300924580653647
Energy: 1.3673807727272538
Energy: 1.3490473141047128
Energy: 1.367380772726041
Energy: 1.3490473141047128
Energy: 1.3673807727272538
Energy: 1.349047314105319
Energy: 1.4151522111322292
Energy: 1.3395310518824926
Energy: 1.415152211131623
Energy: 1.3395310518818861
Energy: 1.4151522111322292
Energy: 1.3395310518824926
Energy: 1.3651271584229843
Energy: 1.3529172504288967
Energy: 1.3651271584223776
Energy: 1.3529172504288967
Energy: 1.3651271584211648
Energy: 1.3529172504288967
Energy: 1.4368877578040546
Energy: 1.3423790473576582
Energy: 1.4368877578040546
Energy: 1.3423790473576582
Energy: 1.4368877578034482
Energy: 1.3423790473576582
Energy: 1.3631837548180208
Energy: 1.4164701368717285
Energy: 1.3631837548192338
Energy: 1.4164701368723347
Energy: 1.3631837548174146
Energy: 1.4164701368717285
Energy: 1.372366869512699
Energy: 1.3905196695206095
Energy: 1.3723668695120923
Energy: 1.390519669521216
Energy: 1.3723668695114861
Energy: 1.390519669521216
Energy: 1.3667389442243967
Energy: 1.3718476417313945
Energy: 1.3667389442250033
Energy: 1.3718476417313945
Energy: 1.3667389442250033
Energy: 1.3718476417313945
Energy: 1.3999988880253278
Energy: 1.370528793411372
Energy: 1.3999988880253278
Energy: 1.3705287934101589
Energy: 1.3999988880247214
Energy: 1.3705287934101589
Energy: 1.3459676768890803
Energy: 1.4172779179710067
Energy: 1.3459676768890803
Energy: 1.4172779179704003
Energy: 1.3459676768890803
Energy: 1.4172779179704003
Energy: 1.357425305713368
Energy: 1.3558275031028617
Energy: 1.357425305713368
Energy: 1.3558275031028617
Energy: 1.357425305713368
Energy: 1.3558275031028617
Energy: 1.399938078848688
Energy: 1.4006787913416656
Energy: 1.3999380788480813
Energy: 1.4006787913416656
Energy: 1.3999380788492943
Energy: 1.4006787913416656
Energy: 1.3658696779979744
Energy: 1.366539996226186
Energy: 1.3658696779973682
Energy: 1.366539996226186
Energy: 1.3658696779979744
Energy: 1.3665399962255795
Energy: 1.4229379345931772
Energy: 1.3728853387594926
Energy: 1.4229379345937836
Energy: 1.3728853387594926
Energy: 1.4229379345937836
Energy: 1.3728853387594926
Energy: 1.36734659065047
Energy: 1.408322352370743
Energy: 1.3673465906510764
Energy: 1.408322352370743
Energy: 1.36734659065047
Energy: 1.408322352370743
Energy: 1.3706665269296523
Energy: 1.3902431954979415
Energy: 1.3706665269302587
Energy: 1.3902431954973349
Energy: 1.3706665269296523
Energy: 1.3902431954973349
Energy: 1.337904652594182
Energy: 1.3481247525808204
Energy: 1.3379046525935754
Energy: 1.3481247525808204
Energy: 1.337904652594182
Energy: 1.3481247525802138
Energy: 1.3949642298598717
Energy: 1.383850145003031
Energy: 1.394964229860478
Energy: 1.383850145003031
Energy: 1.394964229861691
Energy: 1.383850145003031
Energy: 1.347403760860556
Energy: 1.3260673386635173
Energy: 1.3474037608611622
Energy: 1.326067338664124
Energy: 1.3474037608611622
Energy: 1.326067338662911
Energy: 1.4085360671392886
Energy: 1.3476153544263494
Energy: 1.4085360671380758
Energy: 1.3476153544263494
Energy: 1.4085360671398952
Energy: 1.3476153544263494
Energy: 1.3851807888900842
Energy: 1.3670824884184105
Energy: 1.3851807888894778
Energy: 1.3670824884184105
Energy: 1.3851807888900842
Energy: 1.3670824884190171
Energy: 1.4164609993276842
Energy: 1.4016172899863555
Energy: 1.4164609993282906
Energy: 1.4016172899863555
Energy: 1.4164609993276842
Energy: 1.4016172899869621
Energy: 1.377072801649409
Energy: 1.3400115837035858
Energy: 1.3770728016500156
Energy: 1.3400115837035858
Energy: 1.3770728016500156
Energy: 1.3400115837035858
Energy: 1.4198207183252702
Energy: 1.3400271014162768
Energy: 1.4198207183246638
Energy: 1.3400271014162768
Energy: 1.4198207183258769
Energy: 1.3400271014168832
Energy: 1.3607675013135896
Energy: 1.3917749667436605
Energy: 1.3607675013141962
Energy: 1.3917749667436605
Energy: 1.3607675013141962
Energy: 1.3917749667436605
Energy: 1.3849469769325522
Energy: 1.348075630045322
Energy: 1.3849469769319458
Energy: 1.3480756300465349
Energy: 1.3849469769319458
Energy: 1.3480756300471415
Energy: 1.3531572471712134
Energy: 1.4181405732774661
Energy: 1.353157247170607
Energy: 1.4181405732774661
Energy: 1.3531572471700004
Energy: 1.4181405732780727
Energy: 1.3668649548634844
Energy: 1.366290129913807
Energy: 1.366864954862878
Energy: 1.366290129913807
Energy: 1.3668649548634844
Energy: 1.3662901299144137
Energy: 1.4032273318673918
Energy: 1.3731090789540468
Energy: 1.4032273318673918
Energy: 1.3731090789540468
Energy: 1.4032273318673918
Energy: 1.3731090789540468
Energy: 1.3822753279177582
Energy: 1.359979305597438
Energy: 1.3822753279177582
Energy: 1.359979305597438
Energy: 1.3822753279183646
Energy: 1.359979305597438
Energy: 1.341736578612277
Energy: 1.4358174190906636
Energy: 1.3417365786128836
Energy: 1.4358174190906636
Energy: 1.3417365786134898
Energy: 1.4358174190906636

minimum gb energy = 1.326067338662911 eV
minimum distance =  2.20209641035584 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.3441288617300051
Energy: 1.4438167491254295
Energy: 1.3441288617300051
Energy: 1.4438167491254295
Energy: 1.3441288617300051
Energy: 1.4438167491254295
Energy: 1.3838341001475325
Energy: 1.408573340446267
Energy: 1.3838341001475325
Energy: 1.408573340446267
Energy: 1.3838341001475325
Energy: 1.4085733404473462
Energy: 1.4191941414712752
Energy: 1.3533436316241987
Energy: 1.4191941414723543
Energy: 1.3533436316241987
Energy: 1.4191941414712752
Energy: 1.3533436316241987
Energy: 1.3359012596797504
Energy: 1.3797142133104683
Energy: 1.3359012596797504
Energy: 1.3797142133093891
Energy: 1.3359012596808297
Energy: 1.4148075072812278
Energy: 1.4191746988350131
Energy: 1.353361564087854
Energy: 1.419174698836092
Energy: 1.353361564087854
Energy: 1.419174698836092
Energy: 1.353361564087854
Energy: 1.384064667665876
Energy: 1.375715619478592
Energy: 1.3840646676647967
Energy: 1.3757156194775126
Energy: 1.384064667665876
Energy: 1.3757156194775126
Energy: 1.3441288617332425
Energy: 1.4438167491254295
Energy: 1.3441288617332425
Energy: 1.4438167491254295
Energy: 1.3441288617332425
Energy: 1.4438167491254295
Energy: 1.3838341001572452
Energy: 1.4085733404505838
Energy: 1.383834100156166
Energy: 1.4085733404495044
Energy: 1.383834100156166
Energy: 1.4085733404495044
Energy: 1.4191941414723543
Energy: 1.3533436316220402
Energy: 1.4191941414734335
Energy: 1.3533436316220402
Energy: 1.4191941414723543
Energy: 1.3533436316220402
Energy: 1.3359012596840674
Energy: 1.3816862542704984
Energy: 1.3359012596840674
Energy: 1.3816862542704984
Energy: 1.3359012596840674
Energy: 1.475549342955565
Energy: 1.4191746988306961
Energy: 1.353361564088933
Energy: 1.4191746988306961
Energy: 1.353361564088933
Energy: 1.4191746988317753
Energy: 1.353361564088933
Energy: 1.3840646676669555
Energy: 1.3757156194829085
Energy: 1.3840646676669555
Energy: 1.3757156194829085
Energy: 1.384064667665876
Energy: 1.3757156194829085
Energy: 1.3441288617300051
Energy: 1.4438167491254295
Energy: 1.3441288617300051
Energy: 1.4438167491254295
Energy: 1.3441288617300051
Energy: 1.4438167491254295
Energy: 1.3838341001475325
Energy: 1.408573340446267
Energy: 1.3838341001475325
Energy: 1.408573340445188
Energy: 1.3838341001475325
Energy: 1.408573340446267
Energy: 1.4191941414723543
Energy: 1.3533436316241987
Energy: 1.4191941414723543
Energy: 1.353343631623119
Energy: 1.4191941414723543
Energy: 1.3533436316241987
Energy: 1.3359012596797504
Energy: 1.4176335318121884
Energy: 1.3359012596797504
Energy: 1.3816862542715775
Energy: 1.3359012596797504
Energy: 1.3797142133093891
Energy: 1.4191746988350131
Energy: 1.353361564087854
Energy: 1.4191746988350131
Energy: 1.353361564087854
Energy: 1.4191746988350131
Energy: 1.353361564087854

minimum gb energy = 1.3359012596797504 eV
minimum distance =  2.25173245253099 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.459339266112448
Energy: 1.5161817537899502
Energy: 1.4593392661115667
Energy: 1.5161817537908315
Energy: 1.4593392661115667
Energy: 1.5161817537917124
Energy: 1.4925881716012321
Energy: 1.4649398064895836
Energy: 1.4925881716012321
Energy: 1.4649398064895836
Energy: 1.4925881716021132
Energy: 1.4649398064895836
Energy: 1.4814913791159539
Energy: 1.4296993334933445
Energy: 1.4814913791159539
Energy: 1.4296993334942254
Energy: 1.4814913791203195
Energy: 1.4296993334942254
Energy: 1.397142555679096
Energy: 1.550450720880058
Energy: 1.3971425556808583
Energy: 1.550450720879177
Energy: 1.397142555679096
Energy: 1.550450720880058
Energy: 1.4547985387396059
Energy: 1.423527034040367
Energy: 1.4547985387396059
Energy: 1.423527034040367
Energy: 1.4547985387396059
Energy: 1.423527034040367
Energy: 1.4714278310815485
Energy: 1.4263546638814115
Energy: 1.4714278310815485
Energy: 1.4263546638814115
Energy: 1.4714278310806674
Energy: 1.4263546638814115
Energy: 1.394882692322217
Energy: 1.507132418025792
Energy: 1.3948826923204545
Energy: 1.5071324180249108
Energy: 1.3948826923213358
Energy: 1.5071324180249108
Energy: 1.3997155255881972
Energy: 1.488017027071875
Energy: 1.399715525587316
Energy: 1.488017027070994
Energy: 1.3997155255899594
Energy: 1.488017027070994
Energy: 1.562611632277602
Energy: 1.4273128980753802
Energy: 1.5626116322767207
Energy: 1.4273128980753802
Energy: 1.562611632278483
Energy: 1.4273128980753802
Energy: 1.394273768339216
Energy: 1.4816016304276425
Energy: 1.394273768339216
Energy: 1.4816016304276425
Energy: 1.3942737683400972
Energy: 1.4816016304276425
Energy: 1.4675800634154723
Energy: 1.4910658816671725
Energy: 1.4675800634137102
Energy: 1.4910658816671725
Energy: 1.4675800634145912
Energy: 1.4910658816671725
Energy: 1.5257808751306077
Energy: 1.4270745847995936
Energy: 1.5257808751332511
Energy: 1.427074584800475
Energy: 1.5257808751306077
Energy: 1.427074584800475
Energy: 1.4039523531496245
Energy: 1.5067939662130525
Energy: 1.4039523531505058
Energy: 1.5067939662130525
Energy: 1.4039523531496245
Energy: 1.5067939662130525
Energy: 1.4575988522700436
Energy: 1.4714895516426167
Energy: 1.457598852270925
Energy: 1.4714895516434978
Energy: 1.4575988522700436
Energy: 1.4714895516434978
Energy: 1.4810193367426778
Energy: 1.4218393964938016
Energy: 1.4810193367409157
Energy: 1.4218393964938016
Energy: 1.4810193367417968
Energy: 1.4218393964946827
Energy: 1.4532329589477608
Energy: 1.5279296237790907
Energy: 1.4532329589477608
Energy: 1.5279296237790907
Energy: 1.4532329589468795
Energy: 1.5279296237790907
Energy: 1.451301145069515
Energy: 1.4927442853829298
Energy: 1.451301145069515
Energy: 1.4927442853838109
Energy: 1.4513011450712772
Energy: 1.4927442853838109
Energy: 1.6077427472056625
Energy: 1.4291183085864596
Energy: 1.6077427472047814
Energy: 1.4291183085873405
Energy: 1.6077427472065435
Energy: 1.4291183085864596
Energy: 1.4104887826319317
Energy: 1.4820325042689348
Energy: 1.4104887826310506
Energy: 1.4820325042689348
Energy: 1.4104887826292882
Energy: 1.482032504269816
Energy: 1.4602391545678794
Energy: 1.4663391111567134
Energy: 1.4602391545678794
Energy: 1.4663391111558322
Energy: 1.460239154566117
Energy: 1.4663391111575947
Energy: 1.5575607882848774
Energy: 1.4228773896674185
Energy: 1.5575607882857587
Energy: 1.422877389665656
Energy: 1.5575607882866398
Energy: 1.4228773896665372

minimum gb energy = 1.394273768339216 eV
minimum distance =  2.21550657470562 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.4285829560583487
Energy: 1.4333504468291212
Energy: 1.3705381079400658
Energy: 1.433350446829864
Energy: 1.4285829560583487
Energy: 1.4333504468320923
Energy: 1.4282714071955687
Energy: 1.4061458834644929
Energy: 1.4282714071977969
Energy: 1.4061458834644929
Energy: 1.4282714071955687
Energy: 1.4061458834711777
Energy: 1.4628082096420172
Energy: 1.3730633126617813
Energy: 1.4628082096464738
Energy: 1.3730633126625242
Energy: 1.4628082096420172
Energy: 1.373063312671437
Energy: 1.3696671138355856
Energy: 1.5022273594903859
Energy: 1.369667113837071
Energy: 1.502227359493357
Energy: 1.3696671138333574
Energy: 1.5022273594881577
Energy: 1.4103440924972115
Energy: 1.365431309196271
Energy: 1.410344092496469
Energy: 1.3654313091977566
Energy: 1.4103440924972115
Energy: 1.3654313091999848
Energy: 1.4331782039544263
Energy: 1.373736586989148
Energy: 1.4331782039551693
Energy: 1.3737365869884055
Energy: 1.4331782039544263
Energy: 1.3737365869943474
Energy: 1.369905394553971
Energy: 1.45957067880147
Energy: 1.3699053945517428
Energy: 1.459570678802213
Energy: 1.369905394553971
Energy: 1.4595706787999845
Energy: 1.5298269240911768
Energy: 1.4631448915823189
Energy: 1.5298269240986042
Energy: 1.4631448915823189
Energy: 1.5298269240911768
Energy: 1.4631448915956886
Energy: 1.3917956237412634
Energy: 1.3739978738476384
Energy: 1.391795623742749
Energy: 1.373997873848381
Energy: 1.3917956237412634
Energy: 1.3739978738468954
Energy: 1.3699966223410394
Energy: 1.3897702214839247
Energy: 1.3699966223106204
Energy: 1.3897702214846672
Energy: 1.3699966223529236
Energy: 1.3897702214846672
Energy: 1.3702185964371565
Energy: 1.4360081236008342
Energy: 1.3702185964341853
Energy: 1.4360081236008342
Energy: 1.3702185964364137
Energy: 1.4360081235986057
Energy: 1.4653509781795868
Energy: 1.379646754277661
Energy: 1.4653509781766156
Energy: 1.379646754277661
Energy: 1.465350978178844
Energy: 1.3796467542784034
Energy: 1.46193481726531
Energy: 1.540420382496928
Energy: 1.4619348172601105
Energy: 1.5404203824976708
Energy: 1.46193481726531
Energy: 1.5404203825036127
Energy: 1.3702225410490192
Energy: 1.3435693117383347
Energy: 1.3702225410512139
Energy: 1.343569311737592
Energy: 1.3702225410490192
Energy: 1.3435693117442766
Energy: 1.4379923894864013
Energy: 1.3736779715645944
Energy: 1.4379923894849158
Energy: 1.3736779715653369
Energy: 1.4379923894856586
Energy: 1.3736779715586522
Energy: 1.409687640101935
Energy: 1.3652383885320598
Energy: 1.4096876401026777
Energy: 1.3652383885328025
Energy: 1.4096876401011922
Energy: 1.365238388531317
Energy: 1.37718358843297
Energy: 1.4773205841289228
Energy: 1.3771835884299988
Energy: 1.4773205841296657
Energy: 1.37718358843297
Energy: 1.4773205841214954
Energy: 1.542707048260495
Energy: 1.374499861254945
Energy: 1.542707048260495
Energy: 1.374499861254202
Energy: 1.5427070482597522
Energy: 1.3744998612527166
Energy: 1.3939555138021575
Energy: 1.4065594058251532
Energy: 1.347020346340113
Energy: 1.4065594058244104
Energy: 1.3939555138014146
Energy: 1.4065594058266389
Energy: 1.4285829560583487
Energy: 1.433350446829864
Energy: 1.3705381079393228
Energy: 1.4333504468306066
Energy: 1.4285829560583487
Energy: 1.4333504468306066
Energy: 1.4282714071918547
Energy: 1.4061458834644929
Energy: 1.428271407200025
Energy: 1.4061458834644929
Energy: 1.4282714071925975
Energy: 1.406145883469692
Energy: 1.4628082096405315
Energy: 1.3730633126610388
Energy: 1.4628082096442454
Energy: 1.3730633126610388
Energy: 1.4628082096405315
Energy: 1.3730633126706946
Energy: 1.369667113837814
Energy: 1.502227359493357
Energy: 1.3696671138333574
Energy: 1.5022273594940998
Energy: 1.369667113837814
Energy: 1.5022273594881577
Energy: 1.410344092496469
Energy: 1.365431309196271
Energy: 1.4103440924979544
Energy: 1.365431309195528
Energy: 1.4103440924979544
Energy: 1.365431309199242
Energy: 1.4331782039499699
Energy: 1.37373658698692
Energy: 1.433178203946999
Energy: 1.373736586986177
Energy: 1.4331782039507126
Energy: 1.373736586993605

minimum gb energy = 1.343569311737592 eV
minimum distance =  2.25641077260046 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.373909479721289
Energy: 1.4546621928097045
Energy: 1.37390947972193
Energy: 1.4546621928090633
Energy: 1.37390947972193
Energy: 1.4546621928103456
Energy: 1.413695655260766
Energy: 1.3263996014047468
Energy: 1.413695655260125
Energy: 1.3263996014047468
Energy: 1.413695655260125
Energy: 1.3263996014047468
Energy: 1.4278273012858818
Energy: 1.2901110571473131
Energy: 1.4278273012858818
Energy: 1.2901110571473131
Energy: 1.4278273012865226
Energy: 1.290111057147954
Energy: 1.3052263516418516
Energy: 1.4097852589213735
Energy: 1.305226351642493
Energy: 1.4097852589207323
Energy: 1.3052263516405693
Energy: 1.4097852589207323
Energy: 1.3140385641507757
Energy: 1.3654174769005798
Energy: 1.3140385641526993
Energy: 1.3654174769012208
Energy: 1.31403856415334
Energy: 1.3654174768999385
Energy: 1.436666702744158
Energy: 1.3289602492834318
Energy: 1.4366667027428757
Energy: 1.3289602492834318
Energy: 1.436666702744158
Energy: 1.3289602492834318
Energy: 1.2924342464006278
Energy: 1.3571090107338843
Energy: 1.292434246399987
Energy: 1.3571090107345254
Energy: 1.292434246399987
Energy: 1.35710901073709
Energy: 1.3298462912212283
Energy: 1.4166009062377989
Energy: 1.329846291220587
Energy: 1.4166009062371578
Energy: 1.3298462912225104
Energy: 1.4166009062371578
Energy: 1.4954081653321172
Energy: 1.2898610190630062
Energy: 1.4954081653321172
Energy: 1.2898610190630062
Energy: 1.4954081653308349
Energy: 1.2898610190636473
Energy: 1.3316100252460614
Energy: 1.3777048101308516
Energy: 1.3316100252467025
Energy: 1.3777048101302105
Energy: 1.3316100252441383
Energy: 1.3777048101302105
Energy: 1.3051649349021477
Energy: 1.4442531055263703
Energy: 1.3051649349021477
Energy: 1.4442531055263703
Energy: 1.3051649349027887
Energy: 1.4442531055263703
Energy: 1.4338246252212021
Energy: 1.306018529639036
Energy: 1.4338246252250488
Energy: 1.3060185296396771
Energy: 1.4338246252224842
Energy: 1.306018529639036
Energy: 1.3245244550289403
Energy: 1.344536384432978
Energy: 1.3245244550282993
Energy: 1.3445363844342604
Energy: 1.3245244550289403
Energy: 1.3445363844323368
Energy: 1.3212141048218844
Energy: 1.4163800954364971
Energy: 1.3212141048225254
Energy: 1.4163800954364971
Energy: 1.3212141048218844
Energy: 1.4163800954377794
Energy: 1.4415197923530125
Energy: 1.2891596999484078
Energy: 1.4415197923536538
Energy: 1.289159699949049
Energy: 1.4415197923530125
Energy: 1.289159699949049
Energy: 1.4248999279794237
Energy: 1.288607642060869
Energy: 1.4248999279794237
Energy: 1.2886076420602277
Energy: 1.4248999279794237
Energy: 1.2886076420595867
Energy: 1.3170704334890437
Energy: 1.414932595101288
Energy: 1.317070433490326
Energy: 1.4149325951006468
Energy: 1.3170704334896848
Energy: 1.414932595101288
Energy: 1.3987003219426148
Energy: 1.3824945697032596
Energy: 1.3987003219419736
Energy: 1.3824945697026185
Energy: 1.3987003219432559
Energy: 1.3824945697026185
Energy: 1.4336117035648397
Energy: 1.326759057539977
Energy: 1.4336117035648397
Energy: 1.326759057539977
Energy: 1.433611703565481
Energy: 1.326759057539336
Energy: 1.3130414593357849
Energy: 1.4401933851437563
Energy: 1.3130414593357849
Energy: 1.4401933851443975
Energy: 1.3130414593357849
Energy: 1.4401933851443975
Energy: 1.2764858836569821
Energy: 1.4295406547675675
Energy: 1.2764858836576234
Energy: 1.4295406547675675
Energy: 1.276485883656341
Energy: 1.4295406547688498
Energy: 1.4921215816183144
Energy: 1.304337633490068
Energy: 1.4921215816189555
Energy: 1.304337633490709
Energy: 1.4921215816183144
Energy: 1.304337633490709
Energy: 1.3693709529802056
Energy: 1.3694743158019702
Energy: 1.3693709529808467
Energy: 1.3694743158026115
Energy: 1.3693709529795643
Energy: 1.3694743158019702
Energy: 1.3676626129094682
Energy: 1.4553992719746733
Energy: 1.3676626129094682
Energy: 1.4553992719753144
Energy: 1.367662612908827
Energy: 1.4553992719746733
Energy: 1.4363981305084255
Energy: 1.3042713942103894
Energy: 1.4363981305084255
Energy: 1.3042713942103894
Energy: 1.4363981305077842
Energy: 1.304271394209107
Energy: 1.3465943123512802
Energy: 1.3290112449634255
Energy: 1.3465943123519215
Energy: 1.3290112449634255
Energy: 1.346594312350639
Energy: 1.3290112449634255
Energy: 1.2919441574163972
Energy: 1.420855663463225
Energy: 1.2919441574176795
Energy: 1.420855663462584
Energy: 1.2919441574176795
Energy: 1.420855663463225
Energy: 1.4167805464041898
Energy: 1.3264234703947786
Energy: 1.4167805464041898
Energy: 1.3264234703954196
Energy: 1.4167805464041898
Energy: 1.3264234703947786
Energy: 1.4280360951516156
Energy: 1.3261743850308438
Energy: 1.4280360951522568
Energy: 1.3261743850308438
Energy: 1.4280360951503333
Energy: 1.3261743850308438

minimum gb energy = 1.276485883656341 eV
minimum distance =  2.20557434431982 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.283334981946916
Energy: 1.4194381960188682
Energy: 1.283334981946916
Energy: 1.4194381960194316
Energy: 1.2833349819474795
Energy: 1.4194381960194316
Energy: 1.3632273865711624
Energy: 1.2540514814161996
Energy: 1.3632273865717262
Energy: 1.2540514814161996
Energy: 1.3632273865722897
Energy: 1.2540514814156363
Energy: 1.3732655823214728
Energy: 1.2491387003292107
Energy: 1.3732655823231639
Energy: 1.2491387003292107
Energy: 1.3732655823226
Energy: 1.2491387003280838
Energy: 1.2095210185481349
Energy: 1.375042934134427
Energy: 1.2095210185486982
Energy: 1.3750429341349906
Energy: 1.2095210185481349
Energy: 1.3750429341355543
Energy: 1.2398777216952426
Energy: 1.295531076138646
Energy: 1.2398777216952426
Energy: 1.295531076138646
Energy: 1.2398777216946788
Energy: 1.295531076138646
Energy: 1.38486274508972
Energy: 1.2364667322781515
Energy: 1.3848627450891564
Energy: 1.2364667322781515
Energy: 1.3848627450891564
Energy: 1.2364667322787153
Energy: 1.2464246336406914
Energy: 1.3330033130779149
Energy: 1.2464246336406914
Energy: 1.3330033130784784
Energy: 1.246424633641255
Energy: 1.3330033130796055
Energy: 1.2085937076522584
Energy: 1.3711790177388172
Energy: 1.2085937076516948
Energy: 1.371179017743326
Energy: 1.2085937076522584
Energy: 1.3711790177450167
Energy: 1.3619208913479313
Energy: 1.2374039410865034
Energy: 1.3619208913513128
Energy: 1.237403941085376
Energy: 1.3619208913490586
Energy: 1.2374039410859399
Energy: 1.296375283143594
Energy: 1.3023193726176747
Energy: 1.2963752831441577
Energy: 1.3023193726182383
Energy: 1.2963752831430304
Energy: 1.302319372618802
Energy: 1.2078607282624936
Energy: 1.5230939041123963
Energy: 1.2078607282613663
Energy: 1.523093904111833
Energy: 1.2078607282619298
Energy: 1.523093904111833
Energy: 1.3464399063437127
Energy: 1.255238825411751
Energy: 1.3464399063448396
Energy: 1.2552388254111873
Energy: 1.3464399063442762
Energy: 1.2552388254111873
Energy: 1.3736795680067415
Energy: 1.2493124586243065
Energy: 1.3736795680084322
Energy: 1.249312458623743
Energy: 1.3736795680078684
Energy: 1.249312458623743
Energy: 1.2863648568649841
Energy: 1.4046189265928362
Energy: 1.2863648568644206
Energy: 1.4046189265894546
Energy: 1.2863648568644206
Energy: 1.4046189265928362
Energy: 1.2850520859428216
Energy: 1.3072514727640772
Energy: 1.2850520859416945
Energy: 1.3072514727646405
Energy: 1.2850520859416945
Energy: 1.3072514727640772
Energy: 1.3727492728706037
Energy: 1.2519119764082494
Energy: 1.3727492728700401
Energy: 1.251911976408813
Energy: 1.3727492728717308
Energy: 1.2519119764082494
Energy: 1.2077290565111922
Energy: 1.3249781973289636
Energy: 1.2077290565083743
Energy: 1.3249781973289636
Energy: 1.207729056510065
Energy: 1.3249781973317816
Energy: 1.2042104275840675
Energy: 1.355136649209776
Energy: 1.204210427586322
Energy: 1.3551366492092125
Energy: 1.204210427584631
Energy: 1.3551366492092125
Energy: 1.3604144887491716
Energy: 1.2373876772717232
Energy: 1.3604144887497354
Energy: 1.2373876772717232
Energy: 1.3604144887491716
Energy: 1.2373876772722867
Energy: 1.254078582549711
Energy: 1.2912778089609087
Energy: 1.2540785825485838
Energy: 1.2912778089625994
Energy: 1.254078582549711
Energy: 1.2912778089614723
Energy: 1.2234549625809705
Energy: 1.5077610490711788
Energy: 1.2234549625809705
Energy: 1.5077610490711788
Energy: 1.2234549625809705
Energy: 1.5077610490700517
Energy: 1.390720525027852
Energy: 1.2353349719366578
Energy: 1.390720525027852
Energy: 1.2353349719355307
Energy: 1.3907205250284156
Energy: 1.2353349719377849
Energy: 1.3971013712686378
Energy: 1.2353725473454729
Energy: 1.3971013712692013
Energy: 1.2353725473443458
Energy: 1.3971013712692013
Energy: 1.2353725473443458
Energy: 1.209768868237775
Energy: 1.4181552468743752
Energy: 1.2097688682400294
Energy: 1.4181552468749388
Energy: 1.209768868237775
Energy: 1.4181552468749388
Energy: 1.3463483769871227
Energy: 1.2930264701348024
Energy: 1.346348376987686
Energy: 1.2930264701342387
Energy: 1.3463483769882498
Energy: 1.2930264701342387
Energy: 1.3726304519163866
Energy: 1.2519415547156216
Energy: 1.3726304519169503
Energy: 1.2519415547150579
Energy: 1.3726304519163866
Energy: 1.2519415547150579
Energy: 1.2827211678765016
Energy: 1.3878070402538647
Energy: 1.2827211678736836
Energy: 1.3878070402533011
Energy: 1.2827211678781412
Energy: 1.3878070402538647
Energy: 1.2833259420849645
Energy: 1.3079164445784182
Energy: 1.283325942085528
Energy: 1.3079164445784182
Energy: 1.283325942085528
Energy: 1.3079164445784182
Energy: 1.4177485823697278
Energy: 1.2493701179470575
Energy: 1.417748582368601
Energy: 1.2493701179476209
Energy: 1.4177485823697278
Energy: 1.2493701179470575
Energy: 1.2042850416249782
Energy: 1.3176070925687173
Energy: 1.2042850416255417
Energy: 1.3176070925687173
Energy: 1.2042850416249782
Energy: 1.317607092570408
Energy: 1.2075161005844899
Energy: 1.3823288481463973
Energy: 1.2075161005844899
Energy: 1.3823288481463973
Energy: 1.2075161005844899
Energy: 1.3823288481463973
Energy: 1.4245509507538812
Energy: 1.2353184112666638
Energy: 1.4245509507572627
Energy: 1.2353184112666638
Energy: 1.4245509507550083
Energy: 1.2353184112666638
Energy: 1.3950851178120283
Energy: 1.235554086557456
Energy: 1.395085117812592
Energy: 1.2355540865563288
Energy: 1.3950851178131554
Energy: 1.2355540865557653

minimum gb energy = 1.2042104275840675 eV
minimum distance =  2.23345533199638 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.020254209855511397
Energy: 0.8979446717798439
Energy: 0.020254209855511397
Energy: 0.8979446717798439
Energy: 0.020254209855979668
Energy: 0.8979446717798439
Energy: 0.02102691836441849
Energy: 0.4362759480651162
Energy: 0.02102691836441849
Energy: 0.4362759480655844
Energy: 0.02102691836441849
Energy: 0.4362759480651162
Energy: 0.8979201722869038
Energy: 0.4376728485358419
Energy: 0.897920937390444
Energy: 0.43767284853995225
Energy: 0.897920237003021
Energy: 0.43767284853495736
Energy: 0.021026918363065705
Energy: 0.4362759480651162
Energy: 0.021026918363065705
Energy: 0.4362759480655844
Energy: 0.021026918363065705
Energy: 0.4362759480651162

minimum gb energy = 0.020254209855511397 eV
minimum distance =  2.48313060946229 Angstroms
sigma value = 1