Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_Ni__MO_593762436933_000
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=3.519618335366251
cohesive_energy=4.4503470714016675
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: 0.01832362381976908
Energy: 1.031117108108104
Energy: 0.018323623820099916
Energy: 1.0311171081077735
Energy: 0.018323623819475002
Energy: 1.031117108108104
Energy: 1.0311171081074426
Energy: 0.5300505316098705
Energy: 1.0311171081074426
Energy: 0.5300505316105322
Energy: 1.0311171081077735
Energy: 0.5300505316102013
Energy: 0.018323623820099916
Energy: 1.0311171081074426
Energy: 0.018323623820430752
Energy: 1.0311171081077735
Energy: 0.018323623820099916
Energy: 1.0311171081077735
Energy: 1.031117108108104
Energy: 0.5300505316102013
Energy: 1.0311171081077735
Energy: 0.5300505316102013
Energy: 1.0311171081083983
Energy: 1.0555010368137565
Energy: 0.01832362381976908
Energy: 1.0311171081074426
Energy: 0.018323623820099916
Energy: 1.0311171081077735
Energy: 0.018323623820761588
Energy: 1.0311171081071118
Energy: 1.0311171081077735
Energy: 0.5300505316105322
Energy: 1.0311171081074426
Energy: 1.0555010368108158
Energy: 1.0311171081077735
Energy: 1.0915649700108123

minimum gb energy = 0.018323623819475002 eV
minimum distance =  2.29250848227673 Angstroms
sigma value = 1


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

Energy: 1.282869901550031
Energy: 1.225216643443616
Energy: 1.282869901550031
Energy: 1.2252166434412268
Energy: 1.2828699015492346
Energy: 1.2252166434444125
Energy: 1.379188236713449
Energy: 1.1424237855443682
Energy: 1.3791882367062815
Energy: 1.1424237855443682
Energy: 1.3791882367078743
Energy: 1.1424237855451644
Energy: 1.252968968099247
Energy: 1.2750292686611056
Energy: 1.2529689681000435
Energy: 1.2750292686626983
Energy: 1.252968968099247
Energy: 1.2750292686619018
Energy: 1.3722095247766326
Energy: 1.1903740298549519
Energy: 1.3722095247758361
Energy: 1.1903740298549519
Energy: 1.3722095247758361
Energy: 1.1903740298549519
Energy: 1.2269483635698641
Energy: 1.3303097146563192
Energy: 1.226948363569068
Energy: 1.330309714657912
Energy: 1.2269483635698641
Energy: 1.3303097146539302
Energy: 1.2925244802621692
Energy: 1.1527407337538012
Energy: 1.2925244802621692
Energy: 1.1527407337522086
Energy: 1.2925244802621692
Energy: 1.1527407337530047
Energy: 1.2143692397931924
Energy: 1.25710451236615
Energy: 1.2143692397931924
Energy: 1.2571045123653535
Energy: 1.2143692397939887
Energy: 1.2571045123669462
Energy: 1.1842584450494202
Energy: 1.353207342636559
Energy: 1.1842584450502167
Energy: 1.353207342636559
Energy: 1.1842584450502167
Energy: 1.353207342636559
Energy: 1.320102180865374
Energy: 1.2670110248178084
Energy: 1.320102180865374
Energy: 1.2670110248178084
Energy: 1.3201021808661704
Energy: 1.2670110248178084
Energy: 1.1242877359822119
Energy: 1.3350409358210278
Energy: 1.1242877359830081
Energy: 1.3350409358130644
Energy: 1.1242877359830081
Energy: 1.3350409358178423
Energy: 1.3421875997473627
Energy: 1.152547029508676
Energy: 1.342187599748159
Energy: 1.152547029508676
Energy: 1.342187599748159
Energy: 1.152547029508676
Energy: 1.108039789413805
Energy: 1.2630560154186763
Energy: 1.1080397894146012
Energy: 1.2630560154146941
Energy: 1.1080397894130085
Energy: 1.2630560154107124
Energy: 1.3939760590533081
Energy: 1.1053624501941177
Energy: 1.3939760590541046
Energy: 1.1053624501941177
Energy: 1.3939760590525117
Energy: 1.1053624501941177
Energy: 1.173563084856577
Energy: 1.20993080355898
Energy: 1.173563084856577
Energy: 1.20993080355898
Energy: 1.173563084855781
Energy: 1.20993080355898
Energy: 1.417758789438175
Energy: 1.1350574498861636
Energy: 1.4177587894397676
Energy: 1.1350574498861636
Energy: 1.4177587894413604
Energy: 1.13505744988696
Energy: 1.417539686064404
Energy: 1.2804952724438978
Energy: 1.4175396860659966
Energy: 1.2804952724431018
Energy: 1.4175396860659966
Energy: 1.2804952724470835
Energy: 1.2440902440281276
Energy: 1.2448889415119648
Energy: 1.2440902440313129
Energy: 1.2448889415111684
Energy: 1.2440902440297203
Energy: 1.2448889415095756
Energy: 1.244023724295293
Energy: 1.202274500401551
Energy: 1.244023724294497
Energy: 1.2022745004023472
Energy: 1.244023724294497
Energy: 1.2022745004023472
Energy: 1.1469663124319824
Energy: 1.1899190684595067
Energy: 1.1469663124295932
Energy: 1.1899190684587104
Energy: 1.1469663124295932
Energy: 1.1899190684587104
Energy: 1.2889881158728287
Energy: 1.1527852653235795
Energy: 1.288988115871236
Energy: 1.152785265322783
Energy: 1.288988115871236
Energy: 1.1527852653243758
Energy: 1.153065693355907
Energy: 1.3666388151044333
Energy: 1.1530656933567032
Energy: 1.366638815094877
Energy: 1.153065693355907
Energy: 1.3666388150980624
Energy: 1.294246494083767
Energy: 1.2595647638876135
Energy: 1.294246494083767
Energy: 1.2595647638876135
Energy: 1.2942464940829708
Energy: 1.2595647638876135
Energy: 1.1036802580132108
Energy: 1.372438596247942
Energy: 1.1036802580148033
Energy: 1.3724385962471455
Energy: 1.1036802580132108
Energy: 1.3724385962463492

minimum gb energy = 1.1036802580132108 eV
minimum distance =  2.22758350501187 Angstroms
sigma value = 33


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

Energy: 1.3818060588443997
Energy: 1.3610030396472323
Energy: 1.274919156944416
Energy: 1.361003039638626
Energy: 1.3818060588480232
Energy: 1.3610030396372672
Energy: 1.392150640019889
Energy: 1.1955161095709788
Energy: 1.3921506400144534
Energy: 1.1955161095813556
Energy: 1.3921506400176242
Energy: 1.1955161095781848
Energy: 1.1747562418056314
Energy: 1.099920926257186
Energy: 1.1747562418060844
Energy: 1.0999209262458618
Energy: 1.1747562417992898
Energy: 1.0999209262391088
Energy: 1.2371717890847596
Energy: 1.0813425349754644
Energy: 1.2371717895859484
Energy: 1.0813425349754644
Energy: 1.237171789899279
Energy: 1.0813425349745585
Energy: 1.288447200519871
Energy: 1.0886569720102734
Energy: 1.288447200524401
Energy: 1.0886569546629412
Energy: 1.288447200519418
Energy: 1.088656964215881
Energy: 1.1932423991886503
Energy: 1.1747521693748928
Energy: 1.1932423991900092
Energy: 1.1747774772295996
Energy: 1.193242399191368
Energy: 1.1747521693690042
Energy: 1.185763305324296
Energy: 1.2752767961608786
Energy: 1.1857633024437875
Energy: 1.2861391030099807
Energy: 1.1857633018212441
Energy: 1.2752767961604259
Energy: 1.0917516535621679
Energy: 1.1946077956342445
Energy: 1.091751653561715
Energy: 1.1946077954381915
Energy: 1.091751653561715
Energy: 1.1946077952022773
Energy: 1.172838105663804
Energy: 1.179041170080071
Energy: 1.1728381056651629
Energy: 1.179041170080524
Energy: 1.1728381056592743
Energy: 1.1790411700850536
Energy: 1.155807511730552
Energy: 1.1975625286949718
Energy: 1.1558115432039258
Energy: 1.1975620897166699
Energy: 1.1558075117187747
Energy: 1.1975616357413652
Energy: 1.1849065951397344
Energy: 1.1602365088485282
Energy: 1.1849066042851673
Energy: 1.1602365088439985
Energy: 1.1849066040035443
Energy: 1.1602365088458106
Energy: 1.1751716695892616
Energy: 1.2745687028166375
Energy: 1.175171720410138
Energy: 1.274568702824338
Energy: 1.17517166959515
Energy: 1.274568702825244
Energy: 1.1092948156674716
Energy: 1.1815451576297926
Energy: 1.109294815982573
Energy: 1.1815451576325104
Energy: 1.1092948164240524
Energy: 1.1815451576279807
Energy: 1.2870271557108484
Energy: 1.1846541380814248
Energy: 1.2870271557131132
Energy: 1.1846541381357398
Energy: 1.287027155714925
Energy: 1.1846541381819427
Energy: 1.2925231326426527
Energy: 1.1826153870944995
Energy: 1.292523132638123
Energy: 1.1826153870922347
Energy: 1.2925231326458235
Energy: 1.1826153870967644
Energy: 1.1751764534102678
Energy: 1.112571687027955
Energy: 1.175176453409362
Energy: 1.1125716870310844
Energy: 1.1751764534134388
Energy: 1.112571687037879
Energy: 1.1950554453353421
Energy: 1.3021084864242212
Energy: 1.1950554452878217
Energy: 1.3021084864332806
Energy: 1.1950554450179762
Energy: 1.3021084864310155
Energy: 1.2883410888746007
Energy: 1.174933811279324
Energy: 1.2883410888727889
Energy: 1.1748426707983337
Energy: 1.2883410888755067
Energy: 1.174933811277512
Energy: 1.1941407266412873
Energy: 1.193159409073445
Energy: 1.1941407266453643
Energy: 1.2111117910810365
Energy: 1.1941407266322281
Energy: 1.1931594090757096
Energy: 1.3629511286649898
Energy: 1.3316524979216138
Energy: 1.3629511286663487
Energy: 1.2782858643305526
Energy: 1.3629511286636307
Energy: 1.3316524979261435
Energy: 1.089105892536479
Energy: 1.1756934952377587
Energy: 1.0891058925441792
Energy: 1.17569349478862
Energy: 1.0891058925446324
Energy: 1.1756934945133386
Energy: 1.0226533478911461
Energy: 1.179129096393383
Energy: 1.0226533477163828
Energy: 1.179129096390665
Energy: 1.0226533475225947
Energy: 1.179129096391118
Energy: 1.156042641309574
Energy: 1.2173336626090718
Energy: 1.1560409890556398
Energy: 1.2173336807876836
Energy: 1.1560426413104798
Energy: 1.2173337005093114
Energy: 1.1890427547054367
Energy: 1.2881002870191895
Energy: 1.1890427550024605
Energy: 1.2881002870228135
Energy: 1.1890427552537342
Energy: 1.2881002870182836
Energy: 1.1746044144679122
Energy: 1.1911032749634358
Energy: 1.1747094345907307
Energy: 1.1911032749652477
Energy: 1.1746044144615704
Energy: 1.1911032749584531
Energy: 1.3432323899671963
Energy: 1.1879281520021931
Energy: 1.2362134225823163
Energy: 1.187928151924777
Energy: 1.3432323899296
Energy: 1.1879281518514369
Energy: 1.1905087415665612
Energy: 1.102514216571102
Energy: 1.1098668209569902
Energy: 1.102514216247353
Energy: 1.1905087416095932
Energy: 1.1025142157977614
Energy: 1.1748198252526731
Energy: 1.1697563975929302
Energy: 1.1748198252540318
Energy: 1.1697563975902123
Energy: 1.1748198252635442
Energy: 1.1697563975911185
Energy: 1.2187329431013973
Energy: 1.1950660368976846
Energy: 1.2187329563058802
Energy: 1.1950660368899844
Energy: 1.2187329629760464
Energy: 1.1950660368872665
Energy: 1.156061124365498
Energy: 1.196943783441294
Energy: 1.156061124360062
Energy: 1.1969437834467296
Energy: 1.156061124360515
Energy: 1.1969437834494474
Energy: 1.2879841513469747
Energy: 1.179446352640491
Energy: 1.287984151346069
Energy: 1.1791321006087903
Energy: 1.2879841513410861
Energy: 1.179446352636414
Energy: 1.1796244725322749
Energy: 1.1433421256975556
Energy: 1.179624472528651
Energy: 1.189938025070255
Energy: 1.1796244725214036
Energy: 1.1433421257129568
Energy: 1.3620702539794158
Energy: 1.2782652960252814
Energy: 1.3620702539889282
Energy: 1.331640021055711
Energy: 1.3620702539843985
Energy: 1.2782652960216578
Energy: 1.196706601015652
Energy: 1.2917919908751052
Energy: 1.1967066010124812
Energy: 1.2917919908782762
Energy: 1.196706601014293
Energy: 1.2917919908778233
Energy: 1.0302852140553036
Energy: 1.1749897670705927
Energy: 1.030285213923531
Energy: 1.1749897670746694
Energy: 1.030285213837961
Energy: 1.1749897670719514
Energy: 1.309011244399492
Energy: 1.1954271471922646
Energy: 1.3090112444022097
Energy: 1.1954271471483677
Energy: 1.3090112444090043
Energy: 1.1954271471048827
Energy: 1.1752043286314022
Energy: 1.2881483598962638
Energy: 1.1752049752325235
Energy: 1.2881483598967167
Energy: 1.1752043286314022
Energy: 1.28814835989264
Energy: 1.2130855079042566
Energy: 1.1939715633440935
Energy: 1.2130855079074274
Energy: 1.193971563336393
Energy: 1.2130855079092393
Energy: 1.1939715633386578
Energy: 1.2870171724614814
Energy: 1.368314748719319
Energy: 1.287017172456499
Energy: 1.3683147487161484
Energy: 1.287017172453781
Energy: 1.3683147487152423
Energy: 1.1957364536441415
Energy: 1.0905009971547754
Energy: 1.1957364539456945
Energy: 1.0905009971570403
Energy: 1.1957364541041513
Energy: 1.0905009971565873
Energy: 1.1750844795281725
Energy: 1.169907387729016
Energy: 1.17508447953402
Energy: 1.169907387719051
Energy: 1.1750844795277195
Energy: 1.1699073877253923

minimum gb energy = 1.0226533475225947 eV
minimum distance =  2.34015079210314 Angstroms
sigma value = 51


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

Energy: 1.2611015434188428
Energy: 1.2801562795829664
Energy: 1.2611015434188428
Energy: 1.2801562795829664
Energy: 1.2611015434188428
Energy: 1.2801562795829664
Energy: 1.3603614804361976
Energy: 1.2028875100409075
Energy: 1.3603614804372473
Energy: 1.2028875100409075
Energy: 1.3603614804340987
Energy: 1.2028875100409075
Energy: 1.203929152855914
Energy: 1.2635685430336476
Energy: 1.203929152855914
Energy: 1.2635685430315489
Energy: 1.2039291528548643
Energy: 1.2635685430304993
Energy: 1.251182378612771
Energy: 1.1124548715922733
Energy: 1.2511823786117215
Energy: 1.1124548715922733
Energy: 1.2511823786117215
Energy: 1.1124548715912237
Energy: 1.2764055663005542
Energy: 1.2177815414569233
Energy: 1.2764055662995046
Energy: 1.2177815414558737
Energy: 1.276405566298455
Energy: 1.2177815414569233
Energy: 1.2741298964799699
Energy: 1.2178786356899116
Energy: 1.2741298964789203
Energy: 1.2178786356888622
Energy: 1.2741298964810195
Energy: 1.2178786356899116
Energy: 1.251310472350277
Energy: 1.2179521348781481
Energy: 1.2513104723481783
Energy: 1.2179521348781481
Energy: 1.251310472350277
Energy: 1.2179521348760491
Energy: 1.169523043152509
Energy: 1.2187581613107217
Energy: 1.1695230431535586
Energy: 1.2187581613096723
Energy: 1.1695230431514594
Energy: 1.2187581613107217
Energy: 1.4289182179744753
Energy: 1.1082569438867527
Energy: 1.4289182179744753
Energy: 1.1082569438867527
Energy: 1.4289182179776239
Energy: 1.1082569438857033
Energy: 1.134085652667396
Energy: 1.43315844074376
Energy: 1.1340856526684455
Energy: 1.43315844074376
Energy: 1.1340856526684455
Energy: 1.43315844074376
Energy: 1.3484920395595745
Energy: 1.1213732276879818
Energy: 1.3484920395595745
Energy: 1.1213732276869322
Energy: 1.3484920395595745
Energy: 1.1213732276879818
Energy: 1.2586349987810794
Energy: 1.2830960610524889
Energy: 1.2586349987810794
Energy: 1.2830960610514393
Energy: 1.2586349987810794
Energy: 1.2830960610514393
Energy: 1.3576209706960831
Energy: 1.2010247740590971
Energy: 1.3576209706971325
Energy: 1.2010247740590971
Energy: 1.3576209706992315
Energy: 1.2010247740590971
Energy: 1.2039643311021486
Energy: 1.1904519267639522
Energy: 1.2039643311010988
Energy: 1.1904519267639522
Energy: 1.2039643311010988
Energy: 1.1904519267629026
Energy: 1.2678455127875357
Energy: 1.2627751803619929
Energy: 1.2678455127864863
Energy: 1.2627751803619929
Energy: 1.2678455127875357
Energy: 1.2627751803630425
Energy: 1.27428777951291
Energy: 1.2176776429224365
Energy: 1.2742877795150092
Energy: 1.2176776429224365
Energy: 1.27428777951291
Energy: 1.2176776429224365
Energy: 1.2762849138592913
Energy: 1.3178394039604686
Energy: 1.2762849138613905
Energy: 1.3178394039562704
Energy: 1.2762849138592913
Energy: 1.3178394039562704
Energy: 1.252419462927359
Energy: 1.2226183853037627
Energy: 1.2524194629263097
Energy: 1.2226183853037627
Energy: 1.2524194629263097
Energy: 1.2226183853037627

minimum gb energy = 1.1082569438857033 eV
minimum distance =  2.22259475905737 Angstroms
sigma value = 19


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

Energy: 1.0533729191513468
Energy: 1.0821997930135836
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.2191617131230466
Energy: 1.260577767093466
Energy: 1.2191617131199337
Energy: 1.2605777670928433
Energy: 1.2191617131174435
Energy: 1.260577767093466
Energy: 1.016719579593507
Energy: 1.2596763074515334
Energy: 1.0167195795928843
Energy: 1.2596763074509107
Energy: 1.0167195795928843
Energy: 1.259676307452156
Energy: 1.1125443265312696
Energy: 1.0167636790515577
Energy: 1.1125443265300243
Energy: 1.0167636790515577
Energy: 1.1125443265337598
Energy: 1.0167636790515577
Energy: 1.0404743672374765
Energy: 1.0514481716270994
Energy: 1.0404743672349863
Energy: 1.0514481716270994
Energy: 1.0404743672368544
Energy: 1.0514481716264767
Energy: 1.0404460605566943
Energy: 1.0516023190656025
Energy: 1.040446060556072
Energy: 1.0516023190656025
Energy: 1.040446060556072
Energy: 1.051602319066225
Energy: 1.1125652837867785
Energy: 1.0167408177680923
Energy: 1.1125652837880233
Energy: 1.0167408177687147
Energy: 1.1125652837874012
Energy: 1.0167408177680923
Energy: 1.0167103095618315
Energy: 1.2596169194620537
Energy: 1.0167103095618315
Energy: 1.2596169194620537
Energy: 1.0167103095618315
Energy: 1.259616919462676
Energy: 1.2159664738384486
Energy: 1.260594133935231
Energy: 1.215966473835336
Energy: 1.260594133935231
Energy: 1.2159664738334968
Energy: 1.2605941339346083
Energy: 1.0533729191513468
Energy: 1.0821997930135836
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.219161713118066
Energy: 1.260577767093466
Energy: 1.219161713116821
Energy: 1.260577767093466
Energy: 1.2191617131186885
Energy: 1.2605777670928433
Energy: 1.0167195795922617
Energy: 1.2596763074515334
Energy: 1.0167195795928843
Energy: 1.2596763074509107
Energy: 1.0167195795928843
Energy: 1.259676307452156
Energy: 1.1125443265312696
Energy: 1.0167636790515577
Energy: 1.112544326535005
Energy: 1.0167636790515577
Energy: 1.1125443265331374
Energy: 1.0167636790515577
Energy: 1.0404743672374765
Energy: 1.0514481716270994
Energy: 1.040474367235609
Energy: 1.0514481716270994
Energy: 1.040474367235609
Energy: 1.0514481716270994
Energy: 1.040446060556072
Energy: 1.0516023190656025
Energy: 1.0404460605554495
Energy: 1.051602319066225
Energy: 1.040446060556072
Energy: 1.0516023190656025
Energy: 1.1125652837867785
Energy: 1.0167408177680923
Energy: 1.1125652837880233
Energy: 1.0167408177680923
Energy: 1.1125652837867785
Energy: 1.0167408177680923
Energy: 1.0167103095618315
Energy: 1.259616919462676
Energy: 1.0167103095612091
Energy: 1.259616919462676
Energy: 1.0167103095624541
Energy: 1.259616919462676
Energy: 1.2159664738390712
Energy: 1.260594133935231
Energy: 1.2159664738328742
Energy: 1.260594133935231
Energy: 1.2159664738322515
Energy: 1.260594133935231
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.053372919152592
Energy: 1.0821997930135836
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.2191617131199337
Energy: 1.2605777670940885
Energy: 1.2191617131193113
Energy: 1.2605777670928433
Energy: 1.219161713121179
Energy: 1.260577767093466
Energy: 1.0167195795928843
Energy: 1.2596763074509107
Energy: 1.0167195795928843
Energy: 1.2596763074509107
Energy: 1.0167195795922617
Energy: 1.2596763074527784
Energy: 1.1125443265325148
Energy: 1.0167636790515577
Energy: 1.1125443265318922
Energy: 1.0167636790515577
Energy: 1.1125443265337598
Energy: 1.0167636790515577
Energy: 1.040474367234364
Energy: 1.0514481716270994
Energy: 1.0404743672349863
Energy: 1.0514481716270994
Energy: 1.0404743672362318
Energy: 1.0514481716270994
Energy: 1.040446060556072
Energy: 1.051602319066225
Energy: 1.040446060556072
Energy: 1.051602319066225
Energy: 1.040446060556072
Energy: 1.051602319066225
Energy: 1.112565283786156
Energy: 1.0167408177680923
Energy: 1.1125652837867785
Energy: 1.0167408177680923
Energy: 1.1125652837874012
Energy: 1.0167408177680923
Energy: 1.0167103095612091
Energy: 1.259616919462676
Energy: 1.0167103095612091
Energy: 1.2596169194620537
Energy: 1.0167103095618315
Energy: 1.259616919462676
Energy: 1.2159664738384486
Energy: 1.260594133935231
Energy: 1.2159664738328742
Energy: 1.260594133935231
Energy: 1.215966473834742
Energy: 1.260594133935231
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.0533729191519694
Energy: 1.0821997930135836
Energy: 1.053372919152592
Energy: 1.0821997930135836
Energy: 1.2191617131199337
Energy: 1.260577767093466
Energy: 1.2191617131161985
Energy: 1.2605777670928433
Energy: 1.2191617131193113
Energy: 1.2605777670928433
Energy: 1.0167195795928843
Energy: 1.2596763074515334
Energy: 1.0167195795928843
Energy: 1.2596763074509107
Energy: 1.0167195795928843
Energy: 1.2596763074515334

minimum gb energy = 1.0167103095612091 eV
minimum distance =  2.24279778187367 Angstroms
sigma value = 27


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

Energy: 1.0420375314282548
Energy: 1.00937877248665
Energy: 1.0420375314282548
Energy: 1.00937877248665
Energy: 1.0420375314282548
Energy: 1.00937877248665
Energy: 1.1878995592181913
Energy: 1.0493928388622873
Energy: 1.1878995592197161
Energy: 1.0493928388622873
Energy: 1.1878995592227661
Energy: 1.0493928388638123
Energy: 0.9758914411752015
Energy: 1.1829899541081113
Energy: 0.9758914411752015
Energy: 1.1829899541065865
Energy: 0.9758914411752015
Energy: 1.1829899541081113
Energy: 1.163287764114537
Energy: 0.9763231787697161
Energy: 1.163287764114537
Energy: 0.9763231787681912
Energy: 1.163287764114537
Energy: 0.9763231787697161
Energy: 1.163017210746182
Energy: 0.976437454064701
Energy: 1.163017210744657
Energy: 0.9764374540662261
Energy: 1.163017210746182
Energy: 0.9764374540662261
Energy: 1.1852686137214146
Energy: 1.238259612277545
Energy: 1.1852686137214146
Energy: 1.238259612277545
Energy: 1.1852686137229393
Energy: 1.2382596122760199
Energy: 1.0545116500214398
Energy: 1.0526284206600853
Energy: 1.0545116500214398
Energy: 1.0526284206600853
Energy: 1.0545116500214398
Energy: 1.0526284206600853
Energy: 1.037673039422222
Energy: 1.0156857952417702
Energy: 1.0376730394237468
Energy: 1.0156857952417702
Energy: 1.0376730394237468
Energy: 1.0156857952417702
Energy: 1.1915494028649019
Energy: 1.057071663146071
Energy: 1.191549402863377
Energy: 1.0570716652540981
Energy: 1.191549402863377
Energy: 1.057071664517909
Energy: 1.153069808614272
Energy: 1.1852840058013463
Energy: 1.1530698086127473
Energy: 1.1852840057998213
Energy: 1.153069808614272
Energy: 1.185284005804396
Energy: 1.0537786467317138
Energy: 0.9768839675246849
Energy: 1.0537786467301888
Energy: 0.9768839675246849
Energy: 1.0537786467301888
Energy: 0.9768839675246849
Energy: 1.2308634641523462
Energy: 1.1147616111131087
Energy: 1.2308634641523462
Energy: 1.1147616111161585
Energy: 1.2308634641523462
Energy: 1.1147616111146337

minimum gb energy = 0.9758914411752015 eV
minimum distance =  2.21673158358858 Angstroms
sigma value = 9


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

Energy: 1.0360525422344764
Energy: 0.9954428778937889
Energy: 1.0360525422327627
Energy: 0.9954428778937889
Energy: 1.0360525422353333
Energy: 0.9954428778933605
Energy: 0.9970149911291989
Energy: 0.923375697093778
Energy: 0.997014991134769
Energy: 0.9233756970950635
Energy: 0.9970149911326266
Energy: 0.9233756970946351
Energy: 0.9253371281027417
Energy: 1.0318613860604775
Energy: 0.9253371281035988
Energy: 1.0318613860596206
Energy: 0.9253371281035988
Energy: 1.031861386060049
Energy: 0.9471121636150143
Energy: 0.9091937250478301
Energy: 0.9471121636141573
Energy: 0.9091937250478301
Energy: 0.9471121636154427
Energy: 0.9091937250482586
Energy: 1.018371877912398
Energy: 0.9830566310836576
Energy: 1.018371877914112
Energy: 0.983056631083229
Energy: 1.018371877914112
Energy: 0.9830566310828007
Energy: 1.0263110728548739
Energy: 0.9982934012370708
Energy: 1.0263110728561593
Energy: 0.9982934012366422
Energy: 1.0263110728561593
Energy: 0.9982934012383562
Energy: 0.9568375964872246
Energy: 1.0657678584287709
Energy: 0.956837596489367
Energy: 1.0657678584283423
Energy: 0.9568375964910809
Energy: 1.0657678584287709
Energy: 0.8858194150583909
Energy: 1.016826549645005
Energy: 0.8858194150596763
Energy: 1.0168265496445767
Energy: 0.8858194150583909
Energy: 1.016826549645005
Energy: 1.041359731077721
Energy: 0.9827881509290302
Energy: 1.041359731077721
Energy: 0.982788150929887
Energy: 1.0413597310790064
Energy: 0.9827881509294586
Energy: 1.0167159473068648
Energy: 1.0982824258320223
Energy: 1.0167159473034373
Energy: 1.0982824258268808
Energy: 1.016715947304294
Energy: 1.0982824258285946
Energy: 0.9444572775193085
Energy: 0.9155678692547687
Energy: 0.9444572775197371
Energy: 0.9155678692547687
Energy: 0.9444572775175948
Energy: 0.9155678692547687
Energy: 0.9732200798941882
Energy: 1.0010282172035858
Energy: 0.9732200798929027
Energy: 1.001028217200158
Energy: 0.9732200798946167
Energy: 1.001028217200158
Energy: 0.9919216321316073
Energy: 0.9932297845133146
Energy: 0.9919216321333212
Energy: 0.9932297845146
Energy: 0.9919216321341783
Energy: 0.9932297845175991
Energy: 1.0324732658722076
Energy: 0.9647934887706128
Energy: 1.0324732658674947
Energy: 0.9647934887740406
Energy: 1.03247326587435
Energy: 0.9647934887646142
Energy: 0.923195194504555
Energy: 1.0095086326381435
Energy: 0.9231951945024125
Energy: 1.009508632637715
Energy: 0.9231951945041265
Energy: 1.0095086326381435
Energy: 0.9386032867505832
Energy: 0.9861455833614622
Energy: 0.9386032867505832
Energy: 0.9861455833610338
Energy: 0.9386032867497265
Energy: 0.9861455833636046
Energy: 1.1193528862662208
Energy: 0.9100619601549953
Energy: 1.119352886268363
Energy: 0.9100619601545668
Energy: 1.1193528862743614
Energy: 0.9100619601537098
Energy: 0.9370767233601351
Energy: 0.9801322814196154
Energy: 0.9370767233588498
Energy: 0.980132281419187
Energy: 0.9370767233605638
Energy: 0.980132281419187
Energy: 0.881586492557785
Energy: 1.2294400708365376
Energy: 0.8815864925586421
Energy: 1.2294400708369662
Energy: 0.8815864925582134
Energy: 1.229440070837823
Energy: 1.0882211478957757
Energy: 0.9521397025237802
Energy: 1.088221147897918
Energy: 0.9521397025237802
Energy: 1.0882211478974897
Energy: 0.9521397025233518
Energy: 0.8815959358369595
Energy: 1.229737449470899
Energy: 0.8815959358348171
Energy: 1.2297374494721844
Energy: 0.8815959358356741
Energy: 1.2297374494696136
Energy: 0.9370392666936916
Energy: 0.9800997091796773
Energy: 0.9370392666936916
Energy: 0.9800997091792488
Energy: 0.9370392666924062
Energy: 0.9800997091796773
Energy: 1.1591142716460168
Energy: 0.9101106899557551
Energy: 1.159114271644303
Energy: 0.9101106899544695
Energy: 1.15911427164516
Energy: 0.9101106899548981
Energy: 0.93856843029553
Energy: 1.0111989115144457
Energy: 0.9385684302946732
Energy: 1.0111989115195872
Energy: 0.9385684302951016
Energy: 1.0111989115170166
Energy: 0.923166984247398
Energy: 1.009915083630384
Energy: 0.9231669842461125
Energy: 1.0099150836308124
Energy: 0.9231669842469694
Energy: 1.009915083630384
Energy: 1.0323468589488762
Energy: 1.0111177966179419
Energy: 1.0323468589497333
Energy: 1.0111177966179419
Energy: 1.0323468589497333
Energy: 1.0111177966179419
Energy: 0.9920358490733521
Energy: 0.9931629406420305
Energy: 0.9920358490699244
Energy: 0.9931629406445622
Energy: 0.9920358490754944
Energy: 0.9931629406428876
Energy: 0.9730002505393918
Energy: 0.9764894978294981
Energy: 0.9730002505398203
Energy: 0.9764894978282127
Energy: 0.9730002505398203
Energy: 0.9764894978290696
Energy: 0.9444815229185302
Energy: 0.9159227969611972
Energy: 0.9444815229172449
Energy: 0.9159227969616256
Energy: 0.9444815229176733
Energy: 0.9159227969611972
Energy: 1.0169708883934656
Energy: 0.9477919509746524
Energy: 1.0169708883938942
Energy: 0.94779195097251
Energy: 1.0169708883938942
Energy: 0.947791950974224
Energy: 1.0410847800605385
Energy: 0.9829352417696452
Energy: 1.0410847800502554
Energy: 0.9829352417692168
Energy: 1.041084780052826
Energy: 0.9829352417687883
Energy: 0.8858493442144332
Energy: 1.0169075520507627
Energy: 0.8858493442131478
Energy: 1.0169075520511912
Energy: 0.8858493442144332
Energy: 1.0169075520507627
Energy: 0.9570272863511032
Energy: 1.0653679125623605
Energy: 0.9570272863502464
Energy: 1.0653679125615036
Energy: 0.9570272863498179
Energy: 1.0653679125615036
Energy: 1.0261372376482711
Energy: 0.9984057467651545
Energy: 1.0261372376478426
Energy: 0.9984057467621552
Energy: 1.026137237644415
Energy: 0.9984057467621552
Energy: 1.0185724680775066
Energy: 0.9827893557912633
Energy: 1.0185724680783634
Energy: 0.9827893557908348
Energy: 1.0185724680766495
Energy: 0.9827893557904065
Energy: 0.9471375037965408
Energy: 0.9091642295215219
Energy: 0.9471375037961124
Energy: 0.9091642295219503
Energy: 0.9471375037982547
Energy: 0.9091642295219503
Energy: 0.9251438586352994
Energy: 1.031992851028289
Energy: 0.9251438586365848
Energy: 1.031992851028289
Energy: 0.9251438586352994
Energy: 1.0319928510278602
Energy: 0.9971015709931328
Energy: 0.9234012552784228
Energy: 0.9971015709978069
Energy: 0.9234012552779942
Energy: 0.9971015709939897
Energy: 0.9234012552779942
Energy: 1.0360525422319056
Energy: 0.9954428778980738
Energy: 1.0360525422301918
Energy: 0.9954428778972169
Energy: 1.0360525422323341
Energy: 0.9954428778967883
Energy: 0.9970149911364828
Energy: 0.9806688045191141
Energy: 0.9970149911343404
Energy: 0.9806688045191141
Energy: 0.9970149911364828
Energy: 0.9806688045191141
Energy: 0.9253371281018848
Energy: 1.0318613860587635
Energy: 0.9253371281018848
Energy: 1.0318613860596206
Energy: 0.9253371281014564
Energy: 1.0318613860583352
Energy: 0.9471121636107296
Energy: 0.9091937250469732
Energy: 0.9471121636111581
Energy: 0.9091937250478301
Energy: 0.9471121636120151
Energy: 0.9091937250474017
Energy: 1.0183718779089703
Energy: 0.9830566310900846
Energy: 1.0183718779098272
Energy: 0.9830566310892276
Energy: 1.0183718779089703
Energy: 0.983056631089656

minimum gb energy = 0.881586492557785 eV
minimum distance =  2.27013429596091 Angstroms
sigma value = 57


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

Energy: 0.46048158115312826
Energy: 0.4734330120388431
Energy: 0.46048158115312826
Energy: 0.4734330120368924
Energy: 0.46048158115215293
Energy: 0.47343301203786775
Energy: 0.6086500166661657
Energy: 0.4617276126171733
Energy: 0.6086500166651904
Energy: 0.46172761261912404
Energy: 0.6086500166651904
Energy: 0.4617276126181487
Energy: 0.5254021023082255
Energy: 0.5883452842528567
Energy: 0.5254021023092008
Energy: 0.5883452842518813
Energy: 0.5254021023072502
Energy: 0.5883452842518813
Energy: 0.47512739418435707
Energy: 0.4605133085645416
Energy: 0.47512739418435707
Energy: 0.4605133085645416
Energy: 0.47512739418435707
Energy: 0.4605133085635663
Energy: 0.6088747351766677
Energy: 0.6146402291356575
Energy: 0.6088747351766677
Energy: 0.6146402291356575
Energy: 0.6088747351786185
Energy: 0.6146402291356575
Energy: 0.46069162482903353
Energy: 0.525313400408309
Energy: 0.46069162482903353
Energy: 0.525313400408309
Energy: 0.46069162482903353
Energy: 0.5253134004073337
Energy: 0.4606811115489912
Energy: 0.5253117962773687
Energy: 0.4606811115489912
Energy: 0.525311796278344
Energy: 0.46068111154996655
Energy: 0.5253117962773687
Energy: 0.6088558484256268
Energy: 0.6146199724296597
Energy: 0.6088558484246515
Energy: 0.6146199724296597
Energy: 0.6088558484246515
Energy: 0.614619972430635
Energy: 0.47513441539012274
Energy: 0.4603876692655018
Energy: 0.47513441538914747
Energy: 0.4603876692655018
Energy: 0.47513441539012274
Energy: 0.4603876692625758
Energy: 0.5253963786490861
Energy: 0.588660846459134
Energy: 0.5253963786490861
Energy: 0.5886608464581586
Energy: 0.5253963786481107
Energy: 0.588660846459134
Energy: 0.6086483239346304
Energy: 0.46184648652748467
Energy: 0.6086483239346304
Energy: 0.46184648652650934
Energy: 0.6086483239346304
Energy: 0.46184648652650934
Energy: 0.46048158115312826
Energy: 0.47343301203786775
Energy: 0.46048158115215293
Energy: 0.47343301203786775
Energy: 0.46048158115312826
Energy: 0.4734330120368924
Energy: 0.6086500166661657
Energy: 0.4617276126181487
Energy: 0.6086500166651904
Energy: 0.4617276126181487
Energy: 0.6086500166651904
Energy: 0.4617276126181487
Energy: 0.5254021023072502
Energy: 0.5883452842518813
Energy: 0.5254021023082255
Energy: 0.5883452842518813
Energy: 0.5254021023072502
Energy: 0.5883452842518813
Energy: 0.47512739418435707
Energy: 0.4605133085655169
Energy: 0.4751273941853324
Energy: 0.4605133085655169
Energy: 0.4751273941853324
Energy: 0.4605133085655169
Energy: 0.608874735174717
Energy: 0.6146402291356575
Energy: 0.6088747351737417
Energy: 0.6146402291356575
Energy: 0.6088747351766677
Energy: 0.6146402291356575
Energy: 0.4606916248300089
Energy: 0.525313400408309
Energy: 0.46069162482903353
Energy: 0.5253134004073337
Energy: 0.46069162482903353
Energy: 0.5253134004073337
Energy: 0.4606811115489912
Energy: 0.5253117962773687
Energy: 0.4606811115489912
Energy: 0.5253117962773687
Energy: 0.46068111154996655
Energy: 0.525311796278344
Energy: 0.608855848423676
Energy: 0.6146199724296597
Energy: 0.6088558484246515
Energy: 0.6146199724296597
Energy: 0.608855848423676
Energy: 0.6146199724296597

minimum gb energy = 0.4603876692625758 eV
minimum distance =  2.40413257738996 Angstroms
sigma value = 11


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

Energy: 0.9031102786012472
Energy: 1.0022182633797287
Energy: 0.9031102786012472
Energy: 1.0022182633811578
Energy: 0.9031102786012472
Energy: 1.0022182633811578
Energy: 1.0379152689563322
Energy: 0.8896578160001756
Energy: 1.037915268960619
Energy: 0.8896578160001756
Energy: 1.03791526895919
Energy: 0.8896578160001756
Energy: 0.9117271538250584
Energy: 1.1683184771261337
Energy: 0.9117271538272017
Energy: 1.1683184771268482
Energy: 0.9117271538272017
Energy: 1.1683184771254194
Energy: 0.9616711711942507
Energy: 0.8231471156082293
Energy: 0.9616711711999664
Energy: 0.8231471156089438
Energy: 0.961671171197823
Energy: 0.8231471156089438
Energy: 0.8109952922643007
Energy: 0.7861448728939484
Energy: 0.8109952922635861
Energy: 0.786144872894663
Energy: 0.8109952922635861
Energy: 0.786144872894663
Energy: 0.9776032698640542
Energy: 0.8112397377098877
Energy: 0.9776032698661975
Energy: 0.8112397377091732
Energy: 0.9776032698640542
Energy: 0.8112397377091732
Energy: 0.8002548088452713
Energy: 0.8734765256911597
Energy: 0.8002548088467003
Energy: 0.8734765256911597
Energy: 0.8002548088481292
Energy: 0.8734765256868731
Energy: 1.0337766818575551
Energy: 0.7603412932510656
Energy: 1.033776681858984
Energy: 0.7603412932510656
Energy: 1.033776681858984
Energy: 0.760341293253209
Energy: 1.0291040325568974
Energy: 0.7634670895312688
Energy: 1.0291040325568974
Energy: 0.7634670895312688
Energy: 1.0291040325554686
Energy: 0.7634670895305544
Energy: 0.7819150011432292
Energy: 1.0888471749097688
Energy: 0.7819150011446581
Energy: 1.0888471749111976
Energy: 0.7819150011453725
Energy: 1.088847174910483
Energy: 1.0183848515471836
Energy: 0.9972844231652124
Energy: 1.018384851546469
Energy: 0.9972844231644978
Energy: 1.018384851546469
Energy: 0.9972844231644978
Energy: 0.8122975265171591
Energy: 0.7893354021798202
Energy: 0.8122975265150157
Energy: 0.7893354021798202
Energy: 0.8122975265093001
Energy: 0.7893354021798202
Energy: 0.9215580748788674
Energy: 0.8269832860375531
Energy: 0.9215580748781528
Energy: 0.8269832860382677
Energy: 0.9215580748781528
Energy: 0.8269832860375531
Energy: 0.9847677865271589
Energy: 1.1349303105101007
Energy: 0.9847677865307312
Energy: 1.1349303105108153
Energy: 0.9847677865293022
Energy: 1.1349303105108153
Energy: 1.0601498149092106
Energy: 0.8917347270578926
Energy: 1.0601498149092106
Energy: 0.8917347270578926
Energy: 1.0601498149077815
Energy: 0.8917347270578926
Energy: 0.8653151223305833
Energy: 0.849953327145294
Energy: 0.8653151223298688
Energy: 0.8499533271517241
Energy: 0.8653151223305833
Energy: 0.8499533271517241
Energy: 0.8374315492433767
Energy: 0.8868452993164351
Energy: 0.8374315492419478
Energy: 0.8868452993164351
Energy: 0.8374315492412332
Energy: 0.8868452993164351
Energy: 1.1094043533598068
Energy: 0.9226330780121448
Energy: 1.1094043533640936
Energy: 0.9226330780178605
Energy: 1.1094043533640936
Energy: 0.922633078009287
Energy: 0.9571992578355687
Energy: 0.8203138417725235
Energy: 0.9571992578377121
Energy: 0.8203138417718091
Energy: 0.9571992578441422
Energy: 0.8203138417718091
Energy: 0.8117227894113622
Energy: 0.9341554080060405
Energy: 0.8117227894049321
Energy: 0.934155408005326
Energy: 0.8117227894049321
Energy: 0.934155408006755
Energy: 0.7803885712935632
Energy: 0.812480468141672
Energy: 0.7803885712942777
Energy: 0.812480468141672
Energy: 0.7803885712935632
Energy: 0.8124804681409574
Energy: 0.8407280208450101
Energy: 0.871518939094618
Energy: 0.8407280208435812
Energy: 0.8715189390981904
Energy: 0.8407280208442958
Energy: 0.871518939113194
Energy: 0.9144161956128718
Energy: 0.9186507428923523
Energy: 0.9144161956193019
Energy: 0.9186507428923523
Energy: 0.9144161956150151
Energy: 0.918650742891638
Energy: 0.8354619517003643
Energy: 0.8005142968461125
Energy: 0.835461951701079
Energy: 0.8005142968461125
Energy: 0.8354619516967922
Energy: 0.800514296846827
Energy: 0.781065444262386
Energy: 1.0892495339775286
Energy: 0.7810654442631004
Energy: 1.0892495339789572
Energy: 0.7810654442616716
Energy: 1.0892495339789572
Energy: 1.378875394918277
Energy: 0.9994297472244569
Energy: 1.378875394916848
Energy: 0.9994297472266002
Energy: 1.378875394916848
Energy: 0.9994297472244569

minimum gb energy = 0.7603412932510656 eV
minimum distance =  2.28299416266957 Angstroms
sigma value = 41


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

Energy: 0.9982246454523376
Energy: 0.8706487991900895
Energy: 0.9982246454534637
Energy: 0.8706487991895265
Energy: 0.9982246454523376
Energy: 0.8706487991895265
Energy: 0.9503200181987284
Energy: 0.9223859651666305
Energy: 0.9503200182026701
Energy: 0.9223859651671937
Energy: 0.9503200181998547
Energy: 0.9223859651621257
Energy: 0.9911920346604364
Energy: 1.0336222760470999
Energy: 0.9911920346609996
Energy: 1.0336222760465366
Energy: 0.9911920346609996
Energy: 1.033622276047663
Energy: 0.9338031185453507
Energy: 0.8656682528847521
Energy: 0.9338031185459138
Energy: 0.8656682528847521
Energy: 0.9338031185459138
Energy: 0.8656682528853152
Energy: 0.837511280365088
Energy: 0.9046385157438188
Energy: 0.8375112803656513
Energy: 0.9046385157438188
Energy: 0.837511280365088
Energy: 0.9046385157438188
Energy: 1.120496952040773
Energy: 0.9317414281139668
Energy: 1.1204969520418993
Energy: 0.9317414281195979
Energy: 1.1204969520413361
Energy: 0.9317414281156562
Energy: 0.8656050552627159
Energy: 1.1906854245902854
Energy: 0.8656050552615897
Energy: 1.1906854245902854
Energy: 0.8656050552627159
Energy: 1.1906854245902854
Energy: 0.8497425761706904
Energy: 0.8656026385627809
Energy: 0.8497425761701274
Energy: 0.8656026385622179
Energy: 0.8497425761701274
Energy: 0.8656026385622179
Energy: 0.8438962359137613
Energy: 0.8880569129872672
Energy: 0.8438962359131981
Energy: 0.8880569129872672
Energy: 0.8438962359137613
Energy: 0.8880569129872672
Energy: 0.9252561383029336
Energy: 0.9563356340355216
Energy: 0.9252561383029336
Energy: 0.9563356340349585
Energy: 0.9252561383034968
Energy: 0.9563356340355216
Energy: 0.9232202329156934
Energy: 0.9557131264211105
Energy: 0.9232202329156934
Energy: 0.9557131264205472
Energy: 0.9232202329162567
Energy: 0.9557131264211105
Energy: 0.8333734286169224
Energy: 0.9220985691296713
Energy: 0.833373428618612
Energy: 0.9220985691296713
Energy: 0.8333734286180488
Energy: 0.922098569129108
Energy: 0.8602682523221349
Energy: 0.8647839978463484
Energy: 0.8602682523232612
Energy: 0.8647839978469114
Energy: 0.8602682523232612
Energy: 0.8647839978463484
Energy: 0.812908264513727
Energy: 0.9541696295306294
Energy: 0.812908264513727
Energy: 0.9541696295311926
Energy: 0.812908264513727
Energy: 0.9541696295300662
Energy: 0.9235328099548613
Energy: 0.9021909628098224
Energy: 0.9235328099542981
Energy: 0.902190962808696
Energy: 0.9235328099526088
Energy: 0.9021909627861716
Energy: 0.8135405209541364
Energy: 1.0830951263053739
Energy: 0.8135405209558257
Energy: 1.0830951263053739
Energy: 0.8135405209518839
Energy: 1.0830951263053739
Energy: 0.8666643149846923
Energy: 0.8647710465046745
Energy: 0.8666643149852555
Energy: 0.8647710465029852
Energy: 0.8666643149846923
Energy: 0.8647710465046745
Energy: 0.8837308819766602
Energy: 1.0350376831159378
Energy: 0.8837308819760972
Energy: 1.0350376831165011
Energy: 0.8837308819766602
Energy: 1.0350376831165011
Energy: 0.9473935230607559
Energy: 0.9234726902984076
Energy: 0.9473935230607559
Energy: 0.9234726902978446
Energy: 0.9473935230607559
Energy: 0.9234726903051651
Energy: 0.9234945335380939
Energy: 0.9482085035037586
Energy: 0.923494533538657
Energy: 0.9482085035054479
Energy: 0.9234945335369678
Energy: 0.9482085035054479
Energy: 0.846838082084341
Energy: 0.9244294309890424
Energy: 0.846838082084341
Energy: 0.9244294309805956
Energy: 0.8468380820854672
Energy: 0.9244294309901685
Energy: 0.8963479217267721
Energy: 1.031299305671737
Energy: 0.8963479217250828
Energy: 1.0312993056953879
Energy: 0.896347921726209
Energy: 1.0312993056751159
Energy: 0.9295982177464405
Energy: 0.8631638080434593
Energy: 0.9295982177458774
Energy: 0.8631638080434593
Energy: 0.9295982177464405
Energy: 0.8631638080434593
Energy: 0.8138906419251359
Energy: 0.9966033752103386
Energy: 0.813890641926262
Energy: 0.9966033752092123
Energy: 0.8138906419251359
Energy: 0.9966033752092123
Energy: 0.8161980022813237
Energy: 0.9200049977149061
Energy: 0.8161980022818869
Energy: 0.9200050021035067
Energy: 0.8161980022813237
Energy: 0.9200050011669463
Energy: 0.8651975290225198
Energy: 0.8784429923465038
Energy: 0.8651975290236459
Energy: 1.0768924287286843
Energy: 0.8651975290219566
Energy: 0.9516251751583665
Energy: 0.8446575620264938
Energy: 0.8630262688779367
Energy: 0.8446575620248042
Energy: 0.8630262688773737
Energy: 0.8446575620253675
Energy: 0.8630262688785
Energy: 0.8437477410603778
Energy: 0.921627268814745
Energy: 0.8437477410615041
Energy: 0.921627268814745
Energy: 0.8437477410609411
Energy: 0.921627268814745
Energy: 0.9239508509298582
Energy: 0.9499076949352923
Energy: 0.9239508509321107
Energy: 0.949907694934166
Energy: 0.9239508509298582
Energy: 0.9499076949352923
Energy: 1.0180575253689779
Energy: 0.8402063461456637
Energy: 1.0180575253667257
Energy: 0.939201066987677
Energy: 1.0180575253684148
Energy: 0.8733908753595031
Energy: 0.8265311667065887
Energy: 0.89951434946822
Energy: 0.8265311667060254
Energy: 0.89951434946822
Energy: 0.8265311667060254
Energy: 0.899514349468783
Energy: 0.8578044212097298
Energy: 0.8842591239898021
Energy: 0.8578044212086036
Energy: 0.8842591239892389
Energy: 0.8578044212097298
Energy: 0.8842591239892389
Energy: 0.8156821483310015
Energy: 0.8925609204285897
Energy: 0.8156821483326907
Energy: 0.8925609204280265
Energy: 0.8156821483310015
Energy: 0.8925609204285897

minimum gb energy = 0.812908264513727 eV
minimum distance =  2.29233060501032 Angstroms
sigma value = 33


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

Energy: 0.9883354513552756
Energy: 0.9012548315093064
Energy: 0.9883354513541258
Energy: 0.9012548315100968
Energy: 0.9883354513557066
Energy: 0.9012548315096657
Energy: 1.0109784796435042
Energy: 0.8750559250158729
Energy: 1.0109784796458756
Energy: 0.8750559250163041
Energy: 1.0109784796438634
Energy: 0.8750559250155135
Energy: 0.9383199457684867
Energy: 1.047691255265722
Energy: 0.9383199457665465
Energy: 1.0476912552660813
Energy: 0.9383199457689179
Energy: 1.047691255265722
Energy: 0.9902163808685337
Energy: 0.8878113398069027
Energy: 0.9902163808689646
Energy: 0.8878113398069027
Energy: 0.9902163808673841
Energy: 0.8878113398073338
Energy: 0.9095619238833842
Energy: 0.9967173760149952
Energy: 0.9095619238822346
Energy: 0.9967173760169352
Energy: 0.9095619238818035
Energy: 0.9967173760153543
Energy: 1.2732259772435213
Energy: 0.9062145801960286
Energy: 1.273225977245461
Energy: 0.9062145801960286
Energy: 1.2732259772438805
Energy: 0.9062145801956694
Energy: 0.9135419129868728
Energy: 1.0019254498212473
Energy: 0.9135419129884536
Energy: 1.0019254498200978
Energy: 0.9135419129880225
Energy: 1.0019254498208878
Energy: 0.9668793599340515
Energy: 0.9875345577189024
Energy: 0.9668793599324708
Energy: 0.9875345577196927
Energy: 0.9668793599321117
Energy: 0.9875345577181119
Energy: 1.0425846662102238
Energy: 0.9214545505417086
Energy: 1.0425846662125953
Energy: 0.9214545505412777
Energy: 1.0425846662110143
Energy: 0.9214545505417086
Energy: 1.3368244803625693
Energy: 0.8972882715908617
Energy: 1.3368244803633595
Energy: 0.8972882715900714
Energy: 1.3368244803625693
Energy: 0.8972882715908617
Energy: 0.9608777637326039
Energy: 0.9621314267306396
Energy: 0.9608777637321728
Energy: 0.9621314267310707
Energy: 0.9608777637313825
Energy: 0.9621314267306396
Energy: 0.9982286092430306
Energy: 0.8875137286264757
Energy: 0.9982286092454018
Energy: 0.8875137286264757
Energy: 0.9982286092331867
Energy: 0.8875137286269068
Energy: 0.9243591737036095
Energy: 1.0446966471558885
Energy: 0.9243591737031784
Energy: 1.0446966471538768
Energy: 0.9243591737031784
Energy: 1.0446966471550982
Energy: 0.9800669898798001
Energy: 0.9623341888499186
Energy: 0.9800669898790096
Energy: 0.9623341888495596
Energy: 0.9800669898794407
Energy: 0.9623341888499186
Energy: 0.9715364912274357
Energy: 0.9141573396864562
Energy: 0.9715364912254237
Energy: 0.9141573396864562
Energy: 0.9715364912266454
Energy: 0.9141573396868874
Energy: 0.9107834566268105
Energy: 1.036376952639737
Energy: 0.9107834566283913
Energy: 1.0363769526401683
Energy: 0.9107834566272418
Energy: 1.0363769526417492
Energy: 0.9979143573377519
Energy: 0.9041296303215415
Energy: 0.9979143573389015
Energy: 0.9041296303215415
Energy: 0.9979143573377519
Energy: 0.9041296303215415
Energy: 0.8840240113741711
Energy: 0.9365185091577388
Energy: 0.8840240113733807
Energy: 0.9365185091569483
Energy: 0.8840240113730214
Energy: 0.9365185091573796
Energy: 1.04839211720597
Energy: 0.9385001056248519
Energy: 1.0483921172075508
Energy: 0.9385001056252831
Energy: 1.04839211720597
Energy: 0.9385001056248519
Energy: 1.0481841426139875
Energy: 0.9466472906622806
Energy: 1.048184142616718
Energy: 0.9466472906618496
Energy: 1.0481841426143468
Energy: 0.9466472906610591
Energy: 0.9027450422001193
Energy: 0.9817640113337137
Energy: 0.9027450422020595
Energy: 0.9817640113341448
Energy: 0.9027450422036403
Energy: 0.9817640113341448
Energy: 0.869462822470001
Energy: 1.0183295090950304
Energy: 0.8694628224703601
Energy: 1.0183295090950304
Energy: 0.869462822470001
Energy: 1.0183295090954618
Energy: 0.9711983494205374
Energy: 0.8704101024931029
Energy: 0.9711983494165854
Energy: 0.8704101024915221
Energy: 0.9711983494205374
Energy: 0.8704101024918814
Energy: 0.8937736584975251
Energy: 0.9834441053257035
Energy: 0.8937736584978845
Energy: 0.9834441053407211
Energy: 0.8937736584963036
Energy: 0.9834441053324579
Energy: 0.9963841156408637
Energy: 0.9036248257450883
Energy: 0.9963841156384925
Energy: 0.9036248257447289
Energy: 0.9963841156432348
Energy: 0.9036248257455194
Energy: 0.9048433233945568
Energy: 0.975023338392567
Energy: 0.9048433233973592
Energy: 0.975023338392567
Energy: 0.9048433233969281
Energy: 0.975023338392208
Energy: 1.014682736007912
Energy: 0.9148806488074256
Energy: 1.0146827360066908
Energy: 0.9148806488066351
Energy: 1.0146827360059003
Energy: 0.9148806488070662
Energy: 0.973077312079612
Energy: 0.8943279130030564
Energy: 0.9730773120780313
Energy: 0.8943279130026253
Energy: 0.9730773120768815
Energy: 0.8943279130030564
Energy: 0.9232787716888227
Energy: 1.0446138378918284
Energy: 0.9232787716884632
Energy: 1.0446138378921876
Energy: 0.9232787716892538
Energy: 1.0446138378921876
Energy: 0.8937971637283584
Energy: 1.0518378833878201
Energy: 0.8937971637275679
Energy: 1.05183788338588
Energy: 0.8937971637287896
Energy: 1.0518378833862394
Energy: 0.9323464104066085
Energy: 0.8834810879946448
Energy: 0.9323464104081891
Energy: 0.8834810879946448
Energy: 0.9323464104066085
Energy: 0.8834810879942135
Energy: 0.8929378126277829
Energy: 0.9979555832878612
Energy: 0.8929378126285735
Energy: 0.9979555832862802
Energy: 0.8929378126281423
Energy: 0.997955583299717
Energy: 1.0478597569921317
Energy: 0.9178548252750471
Energy: 1.0478597569956527
Energy: 0.9178548252750471
Energy: 1.0478597569992454
Energy: 0.9178548252750471
Energy: 0.9598508119290882
Energy: 0.974937884092039
Energy: 0.959850811924346
Energy: 0.9749378840932604
Energy: 0.9598508119255674
Energy: 0.9749378840928293
Energy: 0.9598181033855919
Energy: 0.9751038531619358
Energy: 0.9598181033843705
Energy: 0.9751038531611456
Energy: 0.9598181033859512
Energy: 0.9751038531615046
Energy: 1.0479210895424127
Energy: 0.9178587327871937
Energy: 1.0479210895416222
Energy: 0.9178587327871937
Energy: 1.0479210895432032
Energy: 0.9178587327871937
Energy: 0.8929190119633751
Energy: 0.9984871194489471
Energy: 0.8929190119648841
Energy: 0.9984871194457855
Energy: 0.8929190119672552
Energy: 0.9984871194500967
Energy: 0.9324146592422501
Energy: 0.8834950617683924
Energy: 0.9324146592422501
Energy: 0.8834950617676018
Energy: 0.9324146592422501
Energy: 0.8834950617687515
Energy: 0.8938061123989789
Energy: 1.0514903999849614
Energy: 0.8938061123977574
Energy: 1.051490399974327
Energy: 0.8938061123993382
Energy: 1.0514903999841712
Energy: 0.9232891242878417
Energy: 1.042131684034002
Energy: 0.9232891242870512
Energy: 1.0421316840347925
Energy: 0.9232891242890632
Energy: 1.0421316840355828
Energy: 0.9726675757694462
Energy: 0.894075427814622
Energy: 0.9726675757706679
Energy: 0.8940754278141907
Energy: 0.9726675757698774
Energy: 0.8940754278141907
Energy: 1.0144077060850076
Energy: 0.9147782350166965
Energy: 1.0144077060873788
Energy: 0.9147782350163371
Energy: 1.0144077060873788
Energy: 0.9147782350171277
Energy: 0.9047347346027924
Energy: 0.9751091724744821
Energy: 0.904734734603942
Energy: 0.9751091724744821
Energy: 0.904734734601571
Energy: 0.9751091724744821
Energy: 0.9965975323343099
Energy: 0.9039781909583856
Energy: 0.9965975323402738
Energy: 0.9039781909583856
Energy: 0.9965975323371121
Energy: 0.903978190957236
Energy: 0.89375531263222
Energy: 0.9833659131107887
Energy: 0.8937553126314294
Energy: 0.9833659131099985
Energy: 0.8937553126294175
Energy: 0.9833659131107887
Energy: 0.9716407695062278
Energy: 0.8704509541846929
Energy: 0.9716407695062278
Energy: 0.8704509541846929
Energy: 0.971640769504647
Energy: 0.8704509541842617
Energy: 0.8699460717897854
Energy: 1.0185549870950137
Energy: 0.8699460717889951
Energy: 1.0185549870978161
Energy: 0.8699460717882046
Energy: 1.0185549870950137

minimum gb energy = 0.869462822470001 eV
minimum distance =  2.31133579281867 Angstroms
sigma value = 67


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

Energy: 1.0067232557501464
Energy: 0.9535197973924621
Energy: 1.0067232557501464
Energy: 0.9535197973924621
Energy: 1.0067232557501464
Energy: 0.9535197973924621
Energy: 0.9820028490909954
Energy: 0.911374092215671
Energy: 0.9820028490909954
Energy: 0.911374092215671
Energy: 0.9820028490909954
Energy: 0.911374092215671
Energy: 1.2103908675984125
Energy: 1.1305740578197716
Energy: 1.210390867601054
Energy: 1.1305740578197716
Energy: 1.210390867601054
Energy: 1.1305740578197716
Energy: 0.9820028047775188
Energy: 0.9113915450460516
Energy: 0.9820028047775188
Energy: 0.9113915450460516
Energy: 0.9820028047775188
Energy: 0.9113915450460516
Energy: 1.0067232557527876
Energy: 0.9535197973924621
Energy: 1.0067232557527876
Energy: 0.9535197973924621
Energy: 1.0067232557527876
Energy: 0.9535197973924621
Energy: 0.9820028490936368
Energy: 0.911374092215671
Energy: 0.9820028490936368
Energy: 0.911374092215671
Energy: 0.9820028490936368
Energy: 0.911374092215671
Energy: 1.2103908675984125
Energy: 1.1305740578224128
Energy: 1.2103908675984125
Energy: 1.1305740578197716
Energy: 1.2103908675984125
Energy: 1.1305740578224128

minimum gb energy = 0.911374092215671 eV
minimum distance =  2.32045895445899 Angstroms
sigma value = 3


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

Energy: 1.3596421687056917
Energy: 1.1096152427071078
Energy: 1.3596421687056917
Energy: 1.1096152427071078
Energy: 1.3596421687056917
Energy: 1.1096152427071078
Energy: 1.1354053421812105
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Energy: 1.206449150490971
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Energy: 1.206449150494565
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Energy: 1.206449150494565
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Energy: 1.0739767479921198
Energy: 1.070299417870943
Energy: 1.0739767479921198
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Energy: 1.0739767479921198
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Energy: 1.0817545476301345
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Energy: 1.08175454762654
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Energy: 1.08175454762654
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Energy: 1.0941314359936507
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Energy: 1.0993693879684914
Energy: 1.0941314359900565
Energy: 1.1530227454139228
Energy: 1.0807474730585889
Energy: 1.1530227454103286
Energy: 1.0807474730549946
Energy: 1.1530227454103286
Energy: 1.0807474730514004
Energy: 1.1316145293538127
Energy: 1.1191343386036199
Energy: 1.1316145293538127
Energy: 1.0976248363323606
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Energy: 1.1528331531816605
Energy: 1.04616530281009
Energy: 1.1528331531816605
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Energy: 1.1528331531816605
Energy: 1.04616530281009
Energy: 1.1034779733811269
Energy: 1.1193034236407553
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Energy: 1.1193034236263781
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Energy: 1.119303423651538
Energy: 1.134660836461703
Energy: 1.139293414477592
Energy: 1.1346608364545798
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Energy: 1.1346608364581086
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Energy: 1.0699969344145048
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Energy: 1.1302451704479546
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Energy: 1.1302451704479546
Energy: 1.1523430358976787
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Energy: 1.0522895882315868
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Energy: 1.161989282913472
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Energy: 1.106547792896635
Energy: 1.0671754819583916
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Energy: 1.0983932121221418
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Energy: 1.083190554919746
Energy: 1.1405761298208654
Energy: 1.0831905549161516
Energy: 1.1405761298208654
Energy: 1.08319055492334
Energy: 1.1405761298244597
Energy: 1.1400721701270482
Energy: 1.1015358055438174
Energy: 1.1400721701234537
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Energy: 1.1400721701234537
Energy: 1.1015358055438174
Energy: 1.0707529518918468
Energy: 1.030936016613881
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Energy: 1.0640455265393833
Energy: 1.070752951895441
Energy: 1.0640455265393833
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Energy: 1.046471691943731
Energy: 1.0971207340957347
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Energy: 1.097120734099329
Energy: 1.046471691943731
Energy: 1.168236687031571
Energy: 1.0819663384665126
Energy: 1.1682366870351655
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Energy: 1.1832988589806241
Energy: 1.055872620409375
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Energy: 1.055872620409375
Energy: 1.1832988589842184
Energy: 1.055872620409375
Energy: 1.0993930866787451
Energy: 1.0450242851890106
Energy: 1.0993930866787451
Energy: 1.0450242851890106
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Energy: 1.0984770310677603
Energy: 1.057729322603993
Energy: 1.0984770310677603
Energy: 1.0577293226003985
Energy: 1.0984770310641663
Energy: 1.0577293226003985
Energy: 1.1315364085167272
Energy: 1.1300556836607487
Energy: 1.1315364085167272
Energy: 1.1300556836607487
Energy: 1.1315364085167272
Energy: 1.1300556836607487
Energy: 1.1144724010509193
Energy: 1.1018764157398107
Energy: 1.1144724010509193
Energy: 1.1018764157398107
Energy: 1.114472401047325
Energy: 1.1018764157398107
Energy: 1.1410776378754208
Energy: 1.1290206029617917
Energy: 1.1410776378718266
Energy: 1.1290206029617917
Energy: 1.1410776378754208
Energy: 1.1290206029617917
Energy: 1.0418809509872826
Energy: 1.1568001970556172
Energy: 1.0418809509872826
Energy: 1.1568001970592114
Energy: 1.0418809509836884
Energy: 1.1568001970592114
Energy: 1.15308015380949
Energy: 1.0931656095177111
Energy: 1.1530801538202726
Energy: 1.0931656095177111
Energy: 1.1530801537987072
Energy: 1.0931656095177111
Energy: 1.0399349451410187
Energy: 1.1703668610380076
Energy: 1.0399349451410187
Energy: 1.1703668610416018
Energy: 1.0399349451410187
Energy: 1.1703668610451958
Energy: 1.2102183378501046
Energy: 1.1291174562031472
Energy: 1.2102183378501046
Energy: 1.1291174562031472
Energy: 1.2102183378501046
Energy: 1.1291174562031472
Energy: 1.0723344423204857
Energy: 1.181510872491859
Energy: 1.0723344423168912
Energy: 1.1815108724954533
Energy: 1.0723344423168912
Energy: 1.181510872491859
Energy: 1.2185884692829576
Energy: 1.0408760005523083
Energy: 1.218588469290146
Energy: 1.0408760005523083
Energy: 1.2185884692865518
Energy: 1.0408760005523083
Energy: 1.0500242727502254
Energy: 1.111467320664435
Energy: 1.0500242727502254
Energy: 1.111467320664435
Energy: 1.0500242727466311
Energy: 1.111467320664435
Energy: 1.1644672697432232
Energy: 1.0451845477646606
Energy: 1.164467269739629
Energy: 1.0451845477646606
Energy: 1.1644672697432232
Energy: 1.0451845477646606
Energy: 1.1333188074046405
Energy: 1.1835187057936645
Energy: 1.133318807411829
Energy: 1.1835187057936645
Energy: 1.1333188074082345
Energy: 1.1835187057936645
Energy: 1.210622876345782
Energy: 1.0525561789146471
Energy: 1.2106228763421878
Energy: 1.0525561789146471
Energy: 1.2106228763421878
Energy: 1.0525561789110527
Energy: 1.0883643319442367
Energy: 1.0937586737502392
Energy: 1.0883643319442367
Energy: 1.0937586737502392
Energy: 1.0883643319442367
Energy: 1.0937586737502392
Energy: 1.1384721686063228
Energy: 1.0538059333076255
Energy: 1.1384721686063228
Energy: 1.0538059333112197
Energy: 1.1384721686063228
Energy: 1.0538059333076255
Energy: 1.072203264647575
Energy: 1.1407050231004687
Energy: 1.0722032646439807
Energy: 1.1407050230968745
Energy: 1.0722032646439807
Energy: 1.1407050231004687
Energy: 1.1381639995829307
Energy: 1.1076170028543795
Energy: 1.1381639995829307
Energy: 1.1076170028579735
Energy: 1.1381639995829307
Energy: 1.1076170028435965
Energy: 1.091194840267752
Energy: 1.1272268033196033
Energy: 1.0911948402641578
Energy: 1.1272268033196033
Energy: 1.091194840267752
Energy: 1.1272268033196033

minimum gb energy = 1.030936016613881 eV
minimum distance =  2.24934097634076 Angstroms
sigma value = 81


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

Energy: 1.255733407802489
Energy: 1.1024227979205061
Energy: 1.255733407802489
Energy: 1.1024227979205061
Energy: 1.2557334078029823
Energy: 1.1024227979209995
Energy: 1.079037931314019
Energy: 1.0392693550844845
Energy: 1.0790379313130325
Energy: 1.0392693550844845
Energy: 1.079037931314019
Energy: 1.039269355083991
Energy: 1.1631090114963976
Energy: 1.0083233564411755
Energy: 1.1631090114959042
Energy: 1.0083233564411755
Energy: 1.1631090114978773
Energy: 1.008323356441669
Energy: 1.0783429472481367
Energy: 1.1112665031804645
Energy: 1.0783429472466568
Energy: 1.1112665031804645
Energy: 1.0783429472476433
Energy: 1.1112665031809577
Energy: 1.1026892624614884
Energy: 1.04136154163764
Energy: 1.1026892624614884
Energy: 1.04136154163764
Energy: 1.1026892624619815
Energy: 1.0413615416371467
Energy: 1.0420070191821724
Energy: 1.002254314503993
Energy: 1.0420070191826656
Energy: 1.002254314503993
Energy: 1.0420070191816793
Energy: 1.002254314503993
Energy: 0.9987041830201426
Energy: 1.008367289174662
Energy: 0.9987041830196492
Energy: 1.008367289174662
Energy: 0.9987041830211291
Energy: 1.0083672891751554
Energy: 1.0396956106902695
Energy: 1.0476155673801466
Energy: 1.0396956106922426
Energy: 1.047615567379653
Energy: 1.0396956106902695
Energy: 1.0476155673801466
Energy: 1.2044421138507981
Energy: 1.14448253777217
Energy: 1.204442113852278
Energy: 1.1444825377706902
Energy: 1.2044421138527717
Energy: 1.14448253777217
Energy: 1.1379035558579231
Energy: 1.177470563158128
Energy: 1.1379035558564432
Energy: 1.1774705631571412
Energy: 1.1379035558569366
Energy: 1.177470563158128
Energy: 1.082069294835968
Energy: 1.033815831903221
Energy: 1.0820692948354746
Energy: 1.0338158319037143
Energy: 1.0820692948349813
Energy: 1.033815831903221
Energy: 1.0030312255150755
Energy: 1.0407094061978668
Energy: 1.0030312255140887
Energy: 1.0407094061968802
Energy: 1.0030312255160623
Energy: 1.0407094061968802
Energy: 1.0754631400551982
Energy: 1.0395430803843837
Energy: 1.075463140053718
Energy: 1.0395430803843837
Energy: 1.0754631400556913
Energy: 1.0395430803843837
Energy: 1.1568190258524473
Energy: 1.0030687342156093
Energy: 1.156819025850474
Energy: 1.0030687342146227
Energy: 1.1568190258514608
Energy: 1.0030687342170892
Energy: 1.1664425087709784
Energy: 0.9933747531443454
Energy: 1.1664425087714718
Energy: 0.9933747531438523
Energy: 1.1664425087709784
Energy: 0.9933747531443454
Energy: 1.039426697179259
Energy: 1.005777900594107
Energy: 1.0394266971787658
Energy: 1.0057779005936138
Energy: 1.039426697180739
Energy: 1.005777900594107
Energy: 1.1425688356183417
Energy: 1.0032214917486006
Energy: 1.1425688356134087
Energy: 1.0032214917481075
Energy: 1.1425688356193282
Energy: 1.0032214917481075
Energy: 1.0199418215623657
Energy: 1.1513795630884578
Energy: 1.019941821560886
Energy: 1.1513795630879644
Energy: 1.0199418215623657
Energy: 1.1513795630879644
Energy: 1.0047885762840822
Energy: 1.1425199214111719
Energy: 1.0047885762835889
Energy: 1.142519921413145
Energy: 1.0047885762840822
Energy: 1.1425199214136383
Energy: 1.1106475641966251
Energy: 1.2167000387692766
Energy: 1.1106475641966251
Energy: 1.2167000387692766
Energy: 1.1106475641961318
Energy: 1.2167000387692766
Energy: 1.0403364995324098
Energy: 1.0403089096848868
Energy: 1.04033649953389
Energy: 1.0403089096843934
Energy: 1.0403364995353697
Energy: 1.04030890968538
Energy: 1.0647350482085371
Energy: 1.0367790183773806
Energy: 1.0647350482080438
Energy: 1.0367790183773806
Energy: 1.0647350482095237
Energy: 1.0367790183773806
Energy: 1.0637879511545125
Energy: 0.9795442081903213
Energy: 1.0637879511545125
Energy: 0.9795442081903213
Energy: 1.0637879511540191
Energy: 0.979544208189828
Energy: 1.1176820927483555
Energy: 1.104054052478393
Energy: 1.1176820927473687
Energy: 1.1040540524778997
Energy: 1.1176820927488489
Energy: 1.104054052478393
Energy: 1.1437473756406324
Energy: 1.1894652643212378
Energy: 1.1437473756376724
Energy: 1.1894652643227175
Energy: 1.1437473756426058
Energy: 1.1894652643217312
Energy: 1.1707243453860023
Energy: 1.231122986875565
Energy: 1.1707243453845224
Energy: 1.2311229868726052
Energy: 1.1707243453874823
Energy: 1.2311229868721119
Energy: 1.0193597646980863
Energy: 1.081107547810866
Energy: 1.0193597646980863
Energy: 1.0811075478103727
Energy: 1.0193597646985797
Energy: 1.081107547810866
Energy: 1.044075859419521
Energy: 1.003040051630676
Energy: 1.044075859418041
Energy: 1.003040051630676
Energy: 1.0440758594185344
Energy: 1.0030400516311693
Energy: 1.0395983373437756
Energy: 1.0761079886920437
Energy: 1.0395983373447173
Energy: 1.0761079886920437
Energy: 1.0395983373437756
Energy: 1.0761079886920437
Energy: 1.0030267018158852
Energy: 0.9926893137285029
Energy: 1.0030267018153918
Energy: 0.9926893137285029
Energy: 1.003026701814405
Energy: 0.9926893137289962
Energy: 1.1132757268075246
Energy: 1.1664926585536395
Energy: 1.113275726806538
Energy: 1.1664926585570927
Energy: 1.113275726806538
Energy: 1.1664926585546262
Energy: 1.0059613551413318
Energy: 1.104013358844391
Energy: 1.0059613551398519
Energy: 1.104013358844391
Energy: 1.0059613551408386
Energy: 1.1040133588453778
Energy: 1.0030302333164967
Energy: 1.0525040033837247
Energy: 1.0030302333145233
Energy: 1.0525040027289247
Energy: 1.0030302333160033
Energy: 1.0525042260073627
Energy: 1.0034822953248286
Energy: 0.9968823341060871
Energy: 1.0034822953228553
Energy: 0.9968823341065803
Energy: 1.0034822953243352
Energy: 0.9968823341065803
Energy: 1.0674826502624817
Energy: 1.3217817582962312
Energy: 1.0674826502624817
Energy: 1.3217817582957379
Energy: 1.067482650262975
Energy: 1.3217817582952447
Energy: 1.2195419045973654
Energy: 1.11118202159003
Energy: 1.2195419045909526
Energy: 1.1111820215870702
Energy: 1.219541904596872
Energy: 1.1111820215895367
Energy: 1.0400556444489455
Energy: 1.0433803847113308
Energy: 1.0400556444469724
Energy: 1.0433803847108374
Energy: 1.0400556444469724
Energy: 1.0433803847103442
Energy: 1.03473192263772
Energy: 1.0084412995444778
Energy: 1.0347319226362401
Energy: 1.0084412995434913
Energy: 1.0347319226362401
Energy: 1.0084412995444778

minimum gb energy = 0.979544208189828 eV
minimum distance =  2.33797385496701 Angstroms
sigma value = 43


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

Energy: 1.35746205867639
Energy: 1.0630975826167202
Energy: 1.357462058676996
Energy: 1.063097582616114
Energy: 1.35746205867639
Energy: 1.0630975826167202
Energy: 1.119899937320639
Energy: 1.0263365696565954
Energy: 1.119899937321245
Energy: 1.0263365696559894
Energy: 1.1198999373218508
Energy: 1.0263365696559894
Energy: 1.1139835313962123
Energy: 1.2241658337933303
Energy: 1.1139835313968183
Energy: 1.2241658337927244
Energy: 1.1139835313962123
Energy: 1.224165833794542
Energy: 1.0307321902576045
Energy: 1.0609871847084702
Energy: 1.0307321902569988
Energy: 1.0609871847084702
Energy: 1.0307321902576045
Energy: 1.0609871847084702
Energy: 1.1286852933439828
Energy: 1.1077502208013197
Energy: 1.1286852933433769
Energy: 1.1077502208043493
Energy: 1.1286852933433769
Energy: 1.1077502208019254
Energy: 1.0607061152063924
Energy: 1.1032275749220148
Energy: 1.060706115206998
Energy: 1.1032275749220148
Energy: 1.0607061152063924
Energy: 1.1032275749220148
Energy: 1.1010995233742005
Energy: 1.166287406220162
Energy: 1.1010995233748062
Energy: 1.166287406220162
Energy: 1.1010995233742005
Energy: 1.166287406220162
Energy: 1.0679135129753943
Energy: 1.1057739152543702
Energy: 1.0679135129766062
Energy: 1.1057739152549761
Energy: 1.0679135129760002
Energy: 1.105773915255582
Energy: 1.2049326276772905
Energy: 1.0083211695275551
Energy: 1.2049326276772905
Energy: 1.0083211695275551
Energy: 1.2049326276785024
Energy: 1.0083211695275551
Energy: 1.0563380099976383
Energy: 1.1051601786311733
Energy: 1.0563380099982442
Energy: 1.1051601786311733
Energy: 1.0563380099976383
Energy: 1.1051601786317793
Energy: 1.1070722932464905
Energy: 1.0338424951537115
Energy: 1.1070722932446726
Energy: 1.0338424951561354
Energy: 1.1070722932440666
Energy: 1.0338424951537115
Energy: 1.0677864572755646
Energy: 1.083909929884763
Energy: 1.0677864572749587
Energy: 1.083909929884763
Energy: 1.0677864572755646
Energy: 1.083909929884763
Energy: 1.161462808176905
Energy: 1.1029236315536808
Energy: 1.161462808121792
Energy: 1.1029236315548927
Energy: 1.1614628080018705
Energy: 1.1029236315542867
Energy: 1.0024489974586765
Energy: 1.212632667430812
Energy: 1.0024489974574649
Energy: 1.212632667430812
Energy: 1.0024489974574649
Energy: 1.212632667430812
Energy: 1.1213058830888918
Energy: 1.1115879697327118
Energy: 1.1213058830882858
Energy: 1.1115879697327118
Energy: 1.1213058830888918
Energy: 1.111587969732106
Energy: 1.0812324943421041
Energy: 1.1482194048613146
Energy: 1.0812324943421041
Energy: 1.1482194048613146
Energy: 1.08123249434271
Energy: 1.1482194048619205
Energy: 1.1281646175833793
Energy: 1.0260798561783595
Energy: 1.1281646175827733
Energy: 1.0260798561777533
Energy: 1.1281646175839852
Energy: 1.0260798561777533
Energy: 1.1829165450949957
Energy: 1.0764606276135509
Energy: 1.182916545092572
Energy: 1.0764606276129447
Energy: 1.1829165450931778
Energy: 1.0764606276129447
Energy: 1.182613028353175
Energy: 1.051894136840534
Energy: 1.182613028353781
Energy: 1.051894136839928
Energy: 1.182613028353781
Energy: 1.051894136839928
Energy: 1.127781192656743
Energy: 1.0267432042096403
Energy: 1.1277811926579548
Energy: 1.0267432042114581
Energy: 1.1277811926585606
Energy: 1.0267432042090343
Energy: 1.0813462289105016
Energy: 1.09051430461136
Energy: 1.0813462289105016
Energy: 1.0905143046119656
Energy: 1.0813462289111075
Energy: 1.0905143046119656
Energy: 1.1669173158018513
Energy: 1.1234261591506545
Energy: 1.1669173158018513
Energy: 1.1234261591506545
Energy: 1.1669173158030357
Energy: 1.1234261591506545
Energy: 1.0026092677142784
Energy: 1.1394594182501316
Energy: 1.0026092677142784
Energy: 1.1394594182501316
Energy: 1.0026092677142784
Energy: 1.1394594182501316
Energy: 1.162989017485732
Energy: 1.10315239458219
Energy: 1.162989017486338
Energy: 1.1031523945797939
Energy: 1.1629890174869437
Energy: 1.1031523945870374
Energy: 1.0684612596010752
Energy: 1.0553732333245616
Energy: 1.068461259601681
Energy: 1.0553732333257735
Energy: 1.0684612596010752
Energy: 1.0553732333251675
Energy: 1.168364397615125
Energy: 1.1042448272085166
Energy: 1.1683643976145193
Energy: 1.1042448272085166
Energy: 1.1683643976139133
Energy: 1.1042448272079106
Energy: 1.0559965323983838
Energy: 1.0257403134060408
Energy: 1.0559965323983838
Energy: 1.0257403134060408
Energy: 1.0559965323977778
Energy: 1.025740313407253
Energy: 1.1293270669521362
Energy: 1.008020493688223
Energy: 1.1293270669509246
Energy: 1.008020493688223
Energy: 1.1293270669515305
Energy: 1.008020493688223
Energy: 1.0683416283691005
Energy: 1.105742151814414
Energy: 1.0683416283691005
Energy: 1.105742151813808
Energy: 1.0683416283691005
Energy: 1.105742151813808
Energy: 1.1178627770333323
Energy: 1.1415882298277207
Energy: 1.1178627770333323
Energy: 1.1415882298277207
Energy: 1.1178627770333323
Energy: 1.1415882298277207
Energy: 1.0601857954236429
Energy: 1.1032999716286878
Energy: 1.0601857954236429
Energy: 1.1032999716286878
Energy: 1.0601857954236429
Energy: 1.1032999716286878

minimum gb energy = 1.0024489974574649 eV
minimum distance =  2.2908218818689 Angstroms
sigma value = 57


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

Energy: 1.1655267475426516
Energy: 1.0177304674189376
Energy: 1.1655267475434359
Energy: 1.0177304674189376
Energy: 1.1655267475426516
Energy: 1.0177304674189376
Energy: 1.0732230159982992
Energy: 0.9624699483821969
Energy: 1.0732230159990834
Energy: 0.9624699483821969
Energy: 1.0732230159990834
Energy: 0.9624699483821969
Energy: 1.097749100271274
Energy: 1.1936297171992827
Energy: 1.0977491002704893
Energy: 1.193629717198498
Energy: 1.097749100264213
Energy: 1.193629717198498
Energy: 1.0679851818272397
Energy: 1.1013465045100357
Energy: 1.067985181824886
Energy: 1.1013465045100357
Energy: 1.0679851818264554
Energy: 1.1013465045100357
Energy: 1.0782138514652992
Energy: 1.098615334931928
Energy: 1.0782138514652992
Energy: 1.098615334931928
Energy: 1.0782138514652992
Energy: 1.0986153349327128
Energy: 1.0977538036429313
Energy: 1.04577479206721
Energy: 1.0977538036421468
Energy: 1.04577479206721
Energy: 1.097753803643716
Energy: 1.04577479206721
Energy: 1.0930168387328387
Energy: 1.172464192415316
Energy: 1.0930168387344077
Energy: 1.172464192416885
Energy: 1.0930168387344077
Energy: 1.172464192415316
Energy: 1.0677295866224712
Energy: 1.0180671708387257
Energy: 1.0677295866224712
Energy: 1.0180671708395101
Energy: 1.067729586623256
Energy: 1.0180671708379412
Energy: 1.0666744401492565
Energy: 0.9629558366421497
Energy: 1.0666744401508257
Energy: 0.9629558366421497
Energy: 1.0666744401500412
Energy: 0.9629558366429342
Energy: 0.9574306376691164
Energy: 1.0463768994806955
Energy: 0.9574306376683321
Energy: 1.0463768994806955
Energy: 0.9574306376691164
Energy: 1.046376899479911
Energy: 1.0928134520839496
Energy: 1.100365605566659
Energy: 1.0928134520831652
Energy: 1.100365605566659
Energy: 1.0928134520847343
Energy: 1.100365605566659
Energy: 1.065367652363479
Energy: 1.1656477473290998
Energy: 1.0653676523650484
Energy: 1.165647747328315
Energy: 1.0653676523642637
Energy: 1.1656477473275306
Energy: 1.1035228393767005
Energy: 0.9626949073999481
Energy: 1.1035228393774852
Energy: 0.9626949074007328
Energy: 1.1035228393767005
Energy: 0.9626949073999481
Energy: 1.0614915948282475
Energy: 1.0035344363014438
Energy: 1.0614915948266783
Energy: 1.0035344363022285
Energy: 1.0614915948251091
Energy: 1.0035344363022285
Energy: 1.0596530792119683
Energy: 0.9686646704389084
Energy: 1.0596530792119683
Energy: 0.9686646704389084
Energy: 1.0596530792135375
Energy: 0.968664670438124
Energy: 1.069832824541175
Energy: 1.0630810706300533
Energy: 1.0698328245403903
Energy: 1.0630810706300533
Energy: 1.0698328245403903
Energy: 1.0630810706300533
Energy: 0.9574441598008961
Energy: 1.0728314205844276
Energy: 0.9574441598016807
Energy: 1.072831420585212
Energy: 0.9574441598008961
Energy: 1.072831420585212
Energy: 1.0916454586007203
Energy: 1.103172407842185
Energy: 1.0916454586015047
Energy: 1.103172407842185
Energy: 1.0916454586015047
Energy: 1.1031724078429697
Energy: 0.9573235843014629
Energy: 1.073209145324057
Energy: 0.9573235843022474
Energy: 1.0732091453248414
Energy: 0.9573235843014629
Energy: 1.0732091453248414
Energy: 1.0699101114118206
Energy: 1.0627884168595176
Energy: 1.0699101114110359
Energy: 1.0627884168610866
Energy: 1.0699101114118206
Energy: 1.0627884168603021
Energy: 1.0597364219242407
Energy: 0.9683913640163785
Energy: 1.0597364219250252
Energy: 0.9683913640148449
Energy: 1.0597364219250252
Energy: 0.9683913640155938
Energy: 1.0595748805513767
Energy: 1.013387166289645
Energy: 1.0595748805560843
Energy: 1.0133871662904297
Energy: 1.0595748805631453
Energy: 1.013387166289645
Energy: 1.1039445454705392
Energy: 0.962768953340292
Energy: 1.1039445454713237
Energy: 0.962768953340292
Energy: 1.1039445454713237
Energy: 0.9627689533395074
Energy: 1.0653416393173207
Energy: 1.1654723852569242
Energy: 1.0653416393165365
Energy: 1.1654723852514322
Energy: 1.0653416393165365
Energy: 1.1654723852530013

minimum gb energy = 0.9573235843014629 eV
minimum distance =  2.31747646738798 Angstroms
sigma value = 17


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

Energy: 1.102552671947579
Energy: 0.9765578502858139
Energy: 1.102552671947579
Energy: 0.9765578502858139
Energy: 1.102552671947579
Energy: 0.9765578502858139
Energy: 0.935887700974832
Energy: 0.9243947729593419
Energy: 0.935887700974832
Energy: 0.9243947729593419
Energy: 0.935887700974832
Energy: 0.9243947729593419
Energy: 1.0540591871393343
Energy: 1.0978532969095804
Energy: 1.0540591871393343
Energy: 1.0978532969095804
Energy: 1.0540591871393343
Energy: 1.0978532969095804
Energy: 0.8756595619122081
Energy: 1.0638890981079592
Energy: 0.8756595619122081
Energy: 1.0638890981079592
Energy: 0.8756595619122081
Energy: 1.0638890981079592
Energy: 1.0760489179064971
Energy: 1.0211403811156203
Energy: 1.0760489179076067
Energy: 1.0211403811156203
Energy: 1.0760489179064971
Energy: 1.0211403811156203
Energy: 0.9808076853971588
Energy: 1.059943013885501
Energy: 0.9808076853960493
Energy: 1.059943013885501
Energy: 0.9808076853960493
Energy: 1.059943013885501
Energy: 1.0166574271015383
Energy: 0.9338660741556032
Energy: 1.0166574271093052
Energy: 0.9338660741544939
Energy: 1.016657427102648
Energy: 0.9338660741544939
Energy: 0.8756047224002174
Energy: 1.0539231822326613
Energy: 0.8756047224002174
Energy: 1.0539231822326613
Energy: 0.8756047224002174
Energy: 1.0539231822326613
Energy: 1.025624249639664
Energy: 0.9245793182229411
Energy: 1.0256242496385544
Energy: 0.9245793182240506
Energy: 1.0256242496385544
Energy: 0.9245793182240506
Energy: 0.9980211984131993
Energy: 0.9382830443865265
Energy: 0.9980211984143088
Energy: 0.9382830443876362
Energy: 0.9980211984131993
Energy: 0.9382830443865265
Energy: 0.9813390101970232
Energy: 1.0600432190016653
Energy: 0.9813390101970232
Energy: 1.0600432190016653
Energy: 0.9813390101970232
Energy: 1.0600432190016653
Energy: 1.006980534673252
Energy: 0.9241150209617994
Energy: 1.006980534673252
Energy: 0.9241150209617994
Energy: 1.0069805346743619
Energy: 0.92411502096069
Energy: 0.875320720712408
Energy: 1.059709537636855
Energy: 0.8753207207112984
Energy: 1.059709537636855
Energy: 0.875320720712408
Energy: 1.059709537636855
Energy: 0.99815664301733
Energy: 1.0430991987865808
Energy: 0.9981566430195492
Energy: 1.0430991987854714
Energy: 0.99815664301733
Energy: 1.0430991987865808
Energy: 0.9801977739502469
Energy: 1.1762246496785103
Energy: 0.9801977739513563
Energy: 1.1762246496774007
Energy: 0.9801977739513563
Energy: 1.1762246496774007
Energy: 0.9800809495491333
Energy: 1.0585605948844514
Energy: 0.9800809495491333
Energy: 1.0585605948844514
Energy: 0.9800809495502428
Energy: 1.0585605948844514
Energy: 0.9960876394305548
Energy: 1.0422208709379475
Energy: 0.9960876394316642
Energy: 1.0422208709379475
Energy: 0.9960876394316642
Energy: 1.0422208709379475

minimum gb energy = 0.8753207207112984 eV
minimum distance =  2.2789706935521 Angstroms
sigma value = 17


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

Energy: 1.00154131474629
Energy: 0.8916325177998132
Energy: 1.00154131474629
Energy: 0.8916325177985279
Energy: 1.00154131474629
Energy: 0.8916325177989564
Energy: 0.8980103830708437
Energy: 0.8526864625987771
Energy: 0.8980103830721291
Energy: 0.8526864625987771
Energy: 0.8980103830708437
Energy: 0.8526864625983487
Energy: 0.9855367853652145
Energy: 0.9449838089519873
Energy: 0.9855367853652145
Energy: 0.9449838089519873
Energy: 0.9855367853639291
Energy: 0.9449838089515589
Energy: 0.8253296250918424
Energy: 0.922893739920451
Energy: 0.8253296250905569
Energy: 0.9228937399213079
Energy: 0.8253296250909854
Energy: 0.9228937399200224
Energy: 0.90469019158775
Energy: 0.8528750372957659
Energy: 0.9046901915890351
Energy: 0.852875037294909
Energy: 0.9046901915928915
Energy: 0.8528750372961943
Energy: 0.9357459369544262
Energy: 0.901241334552134
Energy: 0.9357459369535693
Energy: 0.9012413345538479
Energy: 0.9357459369548546
Energy: 0.901241334552134
Energy: 0.9030962710599798
Energy: 0.8842163484562878
Energy: 0.9030962710607978
Energy: 0.8842163484567163
Energy: 0.9030962710604082
Energy: 0.8842163484580017
Energy: 0.9014750614426552
Energy: 0.9947193931967432
Energy: 0.9014750614430836
Energy: 0.9947193931946009
Energy: 0.9014750614430836
Energy: 0.9947193931924586
Energy: 0.9236899194733286
Energy: 0.9480804678691657
Energy: 0.9236899194716148
Energy: 0.9480804678695941
Energy: 0.9236899194741854
Energy: 0.9480804678695941
Energy: 0.9017997911416151
Energy: 0.8107820733474023
Energy: 0.9017997911407584
Energy: 0.8107820733474023
Energy: 0.9017997911424721
Energy: 0.8107820733469738
Energy: 0.8257082890191687
Energy: 0.9408605925453922
Energy: 0.8257082890200257
Energy: 0.9408605925441069
Energy: 0.8257082890195971
Energy: 0.9408605925419646
Energy: 0.9849211757576991
Energy: 0.8734880627504461
Energy: 0.9849211757568422
Energy: 0.8734880627508745
Energy: 0.9849211757576991
Energy: 0.8734880627500174
Energy: 0.9154320388291283
Energy: 0.8778776903277739
Energy: 0.9154320388278429
Energy: 0.8778776903277739
Energy: 0.9154320388295567
Energy: 0.8778776903277739
Energy: 0.8992739562101875
Energy: 0.892826613497425
Energy: 0.8992739562119014
Energy: 0.8928266134978532
Energy: 0.899273956210616
Energy: 0.892826613497425
Energy: 0.9554691908468657
Energy: 0.8729653197597723
Energy: 0.9554691908490078
Energy: 0.8729653197597723
Energy: 0.9554691908464371
Energy: 0.8729653197597723
Energy: 0.8245943533471873
Energy: 0.9703777418640206
Energy: 0.8245943533459019
Energy: 0.978980795856267
Energy: 0.8245943533467589
Energy: 0.970377741864449
Energy: 0.9149450607838362
Energy: 0.9238130064404264
Energy: 0.9149450607834078
Energy: 0.9238130064399979
Energy: 0.9149450607842646
Energy: 0.9238130064399979
Energy: 0.9373460355396639
Energy: 1.1177160956235108
Energy: 0.9373460355405209
Energy: 1.1177160956239396
Energy: 0.9373460355392355
Energy: 1.1177160956235108
Energy: 0.9016788418180594
Energy: 0.9376295717379185
Energy: 0.9016788418172024
Energy: 0.9376295717357763
Energy: 0.9016788418172024
Energy: 0.9376295717409179
Energy: 0.9136972809049964
Energy: 0.8287870534883448
Energy: 0.9136972809058532
Energy: 0.8287870534870595
Energy: 0.9136972809067102
Energy: 0.8287870534883448
Energy: 0.9014627857700447
Energy: 0.9382130089367616
Energy: 0.9014627857713299
Energy: 0.9382130089376186
Energy: 0.9014627857696161
Energy: 0.9382130089376186
Energy: 0.9374900725836581
Energy: 1.117403512533886
Energy: 0.9374900725840866
Energy: 1.1174035125334572
Energy: 0.9374900725832297
Energy: 1.1174035125334572
Energy: 0.9149824250778077
Energy: 0.92357425819506
Energy: 0.914982425075237
Energy: 0.9235742581954884
Energy: 0.9149824250773793
Energy: 0.92357425819506
Energy: 0.8245954964491933
Energy: 1.0075803151019784
Energy: 0.8245954964466226
Energy: 1.0075803151019784
Energy: 0.8245954964500503
Energy: 1.0075803151015499
Energy: 0.9557036412594625
Energy: 0.8730916196336321
Energy: 0.9557036412598912
Energy: 0.8730916196349177
Energy: 0.9557036412573202
Energy: 0.8730916196349177
Energy: 0.8993058483596634
Energy: 0.9890306177269855
Energy: 0.8993058483605204
Energy: 0.9890306177265571
Energy: 0.899305848359235
Energy: 0.9890306177265571
Energy: 0.9155052671139102
Energy: 0.8775900642655623
Energy: 0.915505267113482
Energy: 0.8775900642655623
Energy: 0.9155052671130535
Energy: 0.8775900642655623
Energy: 0.9849294389301938
Energy: 0.8737603284888256
Energy: 0.9849294389297654
Energy: 0.8737603284888256
Energy: 0.9849294389297654
Energy: 0.8737603284892541
Energy: 0.8257341410839588
Energy: 0.940770774482081
Energy: 0.8257341410839588
Energy: 0.9407707744855088
Energy: 0.8257341410839588
Energy: 0.9407707744773679
Energy: 0.9019169811008824
Energy: 0.8107956298548215
Energy: 0.9019169811034532
Energy: 0.8107956298552499
Energy: 0.9019169811008824
Energy: 0.8107956298548215
Energy: 0.923307309993854
Energy: 0.948266928216048
Energy: 0.9233073099934255
Energy: 0.948266928216048
Energy: 0.9233073099955678
Energy: 0.9482669282169048
Energy: 0.9017875760643908
Energy: 0.994702634113833
Energy: 0.9017875760601061
Energy: 0.994702634113833
Energy: 0.9017875760613914
Energy: 0.9947026341142614
Energy: 0.9036449776185775
Energy: 0.8843824117372541
Energy: 0.9036449776190061
Energy: 0.8843824117376825
Energy: 0.9036449776185775
Energy: 0.884382411738968
Energy: 0.9357833444180631
Energy: 0.8679785839614051
Energy: 0.9357833444167779
Energy: 0.8679785839618336
Energy: 0.9357833444184916
Energy: 0.8679785839614051
Energy: 0.9042393423507721
Energy: 0.8529772164627113
Energy: 0.9042393423520575
Energy: 0.8529772164622829
Energy: 0.904239342351629
Energy: 0.8529772164627113
Energy: 0.8253167088041687
Energy: 0.9422464718880474
Energy: 0.8253167088041687
Energy: 0.9422464718880474
Energy: 0.8253167088037403
Energy: 0.9422464718867622
Energy: 0.9856224184051248
Energy: 0.9447422724285508
Energy: 0.9856224184076957
Energy: 0.9447422724285508
Energy: 0.9856224184051248
Energy: 0.9447422724285508
Energy: 0.8979647117982854
Energy: 0.8527125106379627
Energy: 0.8979647117965716
Energy: 0.8527125106388195
Energy: 0.897964711797857
Energy: 0.8527125106379627
Energy: 1.001541314744576
Energy: 0.8916325177980993
Energy: 1.0015413147458616
Energy: 0.8916325177993848
Energy: 1.0015413147450043
Energy: 0.8916325177989564
Energy: 0.8980103830729861
Energy: 0.8599349789420354
Energy: 0.8980103830721291
Energy: 0.859934978942464
Energy: 0.8980103830721291
Energy: 0.8599349789416069
Energy: 0.985536785364786
Energy: 0.9449838089558434
Energy: 0.9855367853630722
Energy: 0.9449838089545581
Energy: 0.9855367853635008
Energy: 0.944983808955415
Energy: 0.8253296250939848
Energy: 0.9228937399183087
Energy: 0.8253296250922708
Energy: 0.9228937399187369
Energy: 0.8253296250939848
Energy: 0.9228937399178802
Energy: 0.9046901915873213
Energy: 0.8528750372974798
Energy: 0.9046901915890351
Energy: 0.852875037296623
Energy: 0.9046901915898922
Energy: 0.8528750372961943

minimum gb energy = 0.8107820733469738 eV
minimum distance =  2.30554488064099 Angstroms
sigma value = 57


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

Energy: 0.9237562322049261
Energy: 0.8280277194140134
Energy: 0.9237562322056236
Energy: 0.8280277194147111
Energy: 0.9237562322063214
Energy: 0.8280277194147111
Energy: 0.822860890618785
Energy: 0.8014528495891627
Energy: 0.8228608906180874
Energy: 0.8014528495891627
Energy: 0.8228608906166921
Energy: 0.8014528495891627
Energy: 0.9282597737492182
Energy: 0.8831520447053142
Energy: 0.9282597737492182
Energy: 0.8831520447046165
Energy: 0.9282597737499161
Energy: 0.8831520447046165
Energy: 0.7857021556545829
Energy: 0.8854377092401233
Energy: 0.7857021556545829
Energy: 0.8854377092380304
Energy: 0.7857021556552172
Energy: 0.8854377092415187
Energy: 0.8255868595135827
Energy: 0.7577581980010503
Energy: 0.8255868595052109
Energy: 0.7577581980010503
Energy: 0.8255868595010251
Energy: 0.7577581980017479
Energy: 0.8848952077836747
Energy: 0.8117277872642515
Energy: 0.88489520778507
Energy: 0.8117277872642515
Energy: 0.88489520778507
Energy: 0.8117277872635539
Energy: 0.7736387684123646
Energy: 0.8584288097617365
Energy: 0.7736387684123646
Energy: 0.8584288097610386
Energy: 0.7736387684130622
Energy: 0.8584288097603412
Energy: 1.0449911913742667
Energy: 0.8378138497962128
Energy: 1.0449911913742667
Energy: 0.8378138497976081
Energy: 1.0449911913756618
Energy: 0.8378138497976081
Energy: 0.8141255338013317
Energy: 0.8140915197339103
Energy: 0.8141255338013317
Energy: 0.8140915197339103
Energy: 0.8141255338027269
Energy: 0.8140915197339103
Energy: 0.8324048184704781
Energy: 0.8263344097693256
Energy: 0.8324048184704781
Energy: 0.8263344097693256
Energy: 0.8324048184683851
Energy: 0.8263344097693256
Energy: 0.7722887346172301
Energy: 0.9245316859624703
Energy: 0.772288734615137
Energy: 0.924531685966656
Energy: 0.7722887346165324
Energy: 0.9245316859617725
Energy: 0.8488248100832676
Energy: 0.7804296082695915
Energy: 0.8488248100839652
Energy: 0.7804296082709868
Energy: 0.8488248100839652
Energy: 0.7804296082695915
Energy: 0.8312484445742839
Energy: 0.8927721736441598
Energy: 0.8312484445770746
Energy: 0.8927721736441598
Energy: 0.8312484445777722
Energy: 0.8927721736441598
Energy: 0.7825698369162081
Energy: 0.8635306193882903
Energy: 0.7825698369155105
Energy: 0.8635306193910809
Energy: 0.7825698369155105
Energy: 0.8635306193896857
Energy: 0.9141072176834788
Energy: 0.8224200832028757
Energy: 0.9141072176820835
Energy: 0.822420083202178
Energy: 0.9141072176820835
Energy: 0.822420083202178
Energy: 0.829055417684111
Energy: 0.8272874428512103
Energy: 0.8290554176813202
Energy: 0.827287442847722
Energy: 0.8290554176834131
Energy: 0.8272874428505127
Energy: 0.8370633895548131
Energy: 0.9381511248067683
Energy: 0.8370633895534177
Energy: 0.9381511248074659
Energy: 0.8370633895548131
Energy: 0.9381511248074659
Energy: 0.8799012196721386
Energy: 0.9138359627921913
Energy: 0.8799012196770223
Energy: 0.9138359627921913
Energy: 0.8799012196749293
Energy: 0.9138359627935866
Energy: 0.7824267829737914
Energy: 0.8860003573497415
Energy: 0.7824267829710009
Energy: 0.8860003573490439
Energy: 0.7824267829716985
Energy: 0.8860003573518345
Energy: 0.7822965463825996
Energy: 0.8877174903677472
Energy: 0.7822965463819019
Energy: 0.8877174903677472
Energy: 0.7822965463825996
Energy: 0.8877174903677472
Energy: 0.8700389002220493
Energy: 0.8847614522225581
Energy: 0.8700389002255375
Energy: 0.8847614522239534
Energy: 0.8700389002241423
Energy: 0.8847614522155818
Energy: 0.772093235605426
Energy: 0.9869406290001597
Energy: 0.772093235605426
Energy: 0.986940628999462
Energy: 0.7720932356061238
Energy: 0.9869406290001597
Energy: 0.8506013299787324
Energy: 0.8462894608411097
Energy: 0.8506013299794299
Energy: 0.8462894608411097
Energy: 0.8506013299801277
Energy: 0.8462894608411097
Energy: 0.8372044950140345
Energy: 0.9872744294296674
Energy: 0.8372044950140345
Energy: 0.9872744294296674
Energy: 0.8372044950126392
Energy: 0.9872744294296674
Energy: 0.8375725460289887
Energy: 1.0508625165384395
Energy: 0.8375725460261982
Energy: 1.0508625165384395
Energy: 0.8375725460248029
Energy: 1.0508625165384395
Energy: 0.8280684828795094
Energy: 0.8461129924210032
Energy: 0.8280684828788119
Energy: 0.8461129924210032
Energy: 0.8280684828788119
Energy: 0.8461129924203057
Energy: 0.7715211738572031
Energy: 0.886013130596046
Energy: 0.7715211738572031
Energy: 0.8860131305980755
Energy: 0.7715211738565054
Energy: 0.8860131305973779

minimum gb energy = 0.7577581980010503 eV
minimum distance =  2.28412033992071 Angstroms
sigma value = 43


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

Energy: 0.7886008551002472
Energy: 0.7553721733147809
Energy: 0.7886008550992305
Energy: 0.7553721733147809
Energy: 0.7886008551012638
Energy: 0.7553721733147809
Energy: 0.8225386239380068
Energy: 0.7586414595799386
Energy: 0.8225386239385151
Energy: 0.7586414595799386
Energy: 0.8225386239385151
Energy: 0.7586414595799386
Energy: 0.8141333328697333
Energy: 0.8076130868157344
Energy: 0.8141333328682084
Energy: 0.8076130868152261
Energy: 0.8141333328697333
Energy: 0.8076130868157344
Energy: 0.8608499738387593
Energy: 0.7803865324432874
Energy: 0.860849973838251
Energy: 0.7803865324443039
Energy: 0.8608499738387593
Energy: 0.7803865324437956
Energy: 0.8135345318925016
Energy: 0.7246603350326511
Energy: 0.813534531895043
Energy: 0.7246603350326511
Energy: 0.813534531895043
Energy: 0.7246603350326511
Energy: 0.765636180522239
Energy: 0.735515879497091
Energy: 0.7656361805227475
Energy: 0.7355158794981076
Energy: 0.7656361805227475
Energy: 0.7355158794981076
Energy: 0.6964300257742414
Energy: 0.7549654801639442
Energy: 0.6964300257788162
Energy: 0.7549654801629275
Energy: 0.6964300257727165
Energy: 0.7549654801639442
Energy: 0.8134643286699496
Energy: 0.6682231547188975
Energy: 0.8134643286699496
Energy: 0.6682231547178809
Energy: 0.8134643286709661
Energy: 0.6682231547194057
Energy: 0.732650239655342
Energy: 0.7274388982348887
Energy: 0.7326502396548338
Energy: 0.727438898235397
Energy: 0.732650239655342
Energy: 0.7274388982359054
Energy: 0.8230001828696464
Energy: 0.7185242713669056
Energy: 0.8230001828706628
Energy: 0.7185242713663973
Energy: 0.8230001828696464
Energy: 0.7185242713663973
Energy: 0.8868611057830671
Energy: 0.8704165141736849
Energy: 0.8868611057810338
Energy: 0.8704165141736849
Energy: 0.8868611057815421
Energy: 0.8704165141736849
Energy: 0.6985342164707267
Energy: 0.729362994078087
Energy: 0.6985342164697101
Energy: 0.729362994078087
Energy: 0.6985342164697101
Energy: 0.7293629940785954
Energy: 0.8199920551094947
Energy: 0.6862307276380868
Energy: 0.8199920551100032
Energy: 0.6862307276375785
Energy: 0.8199920551094947
Energy: 0.6862307276380868
Energy: 0.8875546825778685
Energy: 0.8754366069025291
Energy: 0.8875546825773603
Energy: 0.8754366069030374
Energy: 0.8875546825773603
Energy: 0.8754366069025291
Energy: 0.7146935098371209
Energy: 0.7258314602562028
Energy: 0.7146935098376291
Energy: 0.7258314602556946
Energy: 0.7146935098371209
Energy: 0.7258314602551862
Energy: 0.7655551187870197
Energy: 0.7615615811409674
Energy: 0.7655551187860029
Energy: 0.7615615811404591
Energy: 0.7655551187865113
Energy: 0.7615615811404591
Energy: 0.6942629262881547
Energy: 0.8744287084188809
Energy: 0.6942629262881547
Energy: 0.8744287084188809
Energy: 0.6942629262876464
Energy: 0.8744287084188809
Energy: 0.740443322001914
Energy: 0.6882375933586733
Energy: 0.740443322001914
Energy: 0.6882375933596898
Energy: 0.7404433220008972
Energy: 0.688237593358165
Energy: 0.7370747162046607
Energy: 0.8107856778443665
Energy: 0.737074716205169
Energy: 0.8107856778443665
Energy: 0.7370747162031358
Energy: 0.8107856778443665
Energy: 0.7311282105376803
Energy: 0.7989002494047499
Energy: 0.7311282105381887
Energy: 0.7989002494047499
Energy: 0.7311282105381887
Energy: 0.7989002494047499
Energy: 0.800545146106545
Energy: 0.7346430453946321
Energy: 0.8005451461075617
Energy: 0.7346430453925988
Energy: 0.8005451461080699
Energy: 0.7346430453925988
Energy: 0.7558566700814676
Energy: 0.8139226675826902
Energy: 0.7558566700809594
Energy: 0.8139226675821818
Energy: 0.7558566700804511
Energy: 0.8139226675826902
Energy: 0.7801786638190918
Energy: 0.8142122542521291
Energy: 0.7801786638185836
Energy: 0.8142122542521291
Energy: 0.7801786638196002
Energy: 0.8142122542521291
Energy: 0.779068406612763
Energy: 0.736948334495724
Energy: 0.7790684066102214
Energy: 0.736948334495724
Energy: 0.7790684066107297
Energy: 0.736948334495724
Energy: 0.6973511616325623
Energy: 0.7976358734676446
Energy: 0.6973511616305291
Energy: 0.7976358734676446
Energy: 0.6973511616315458
Energy: 0.7976358734676446
Energy: 0.7188075009339925
Energy: 0.7811847138906668
Energy: 0.7188075009334842
Energy: 0.7811847138906668
Energy: 0.7188075009334842
Energy: 0.7811847138901584
Energy: 0.7806432884044836
Energy: 0.7151460675310877
Energy: 0.7806432884065169
Energy: 0.7151460675310877
Energy: 0.7806432884044836
Energy: 0.7151460675305794
Energy: 0.6603972034171738
Energy: 0.7957363349272529
Energy: 0.6603972034171738
Energy: 0.7957363349272529
Energy: 0.6603972034156489
Energy: 0.7957363349267447
Energy: 0.7185572711150063
Energy: 0.7319056475438164
Energy: 0.7185572711150063
Energy: 0.7319056475438164
Energy: 0.7185572711139898
Energy: 0.7319056475438164
Energy: 0.714482487200561
Energy: 0.6668171325054599
Energy: 0.714482487200561
Energy: 0.6668171325059683
Energy: 0.714482487200561
Energy: 0.6668171325049517
Energy: 0.6489163224252301
Energy: 0.7914342552080685
Energy: 0.6489163224247219
Energy: 0.7914342552106101
Energy: 0.6489163224257384
Energy: 0.7914342552095934
Energy: 0.7191372859895337
Energy: 0.7087225991221775
Energy: 0.7191372859875006
Energy: 0.7087225991221775
Energy: 0.7191372859895337
Energy: 0.7087225991226859
Energy: 0.6929214082095696
Energy: 0.7985820647387091
Energy: 0.6929214082090611
Energy: 0.7985820647397257
Energy: 0.6929214082105861
Energy: 0.7985820647392176
Energy: 0.8830505308813763
Energy: 0.7835402151720496
Energy: 0.8830505308808679
Energy: 0.7835402151613751
Energy: 0.8830505308818845
Energy: 0.7835402151654416
Energy: 0.7206895261782184
Energy: 0.6901837888585403
Energy: 0.7206895261787267
Energy: 0.6901837888590485
Energy: 0.720689526179235
Energy: 0.6901837888585403
Energy: 0.6477091857317742
Energy: 0.795858921056903
Energy: 0.647709185733299
Energy: 0.795858921056903
Energy: 0.6477091857327909
Energy: 0.7958589210563948

minimum gb energy = 0.6477091857317742 eV
minimum distance =  2.2531743309168 Angstroms
sigma value = 81


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

Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.5965539604380575
Energy: 0.07129516517285356
Energy: 0.5965539604380575
Energy: 0.07129516517285356
Energy: 0.5965539604399251
Energy: 0.07129516517285356
Energy: 0.5966277729792985
Energy: 0.07122765610888833
Energy: 0.5966277729792985
Energy: 0.07122765610888833
Energy: 0.5966277729792985
Energy: 0.07122765610888833
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.5965539604380575
Energy: 0.07129516517285356
Energy: 0.5965539604380575
Energy: 0.07129516517285356
Energy: 0.5965539604380575
Energy: 0.07129516517285356
Energy: 0.5966277729792985
Energy: 0.07122765611075596
Energy: 0.5966277729774307
Energy: 0.07122765611075596
Energy: 0.5966277729774307
Energy: 0.07122765611075596
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.5965539604399251
Energy: 0.07129516517098591
Energy: 0.5965539604380575
Energy: 0.07129516517658883
Energy: 0.5965539604399251
Energy: 0.07129516517285356
Energy: 0.5966277729774307
Energy: 0.07122765611635887
Energy: 0.5966277729792985
Energy: 0.07122765611449124
Energy: 0.5966277729774307
Energy: 0.07122765611449124
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796
Energy: 0.06976957405061876
Energy: 0.12196766416121796

minimum gb energy = 0.06976957405061876 eV
minimum distance =  2.46561336105127 Angstroms
sigma value = 3


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

Energy: 0.8610359882872829
Energy: 0.7170326179702174
Energy: 0.8610359882878418
Energy: 0.7170326179696586
Energy: 0.8610359882872829
Energy: 0.7170326179696586
Energy: 0.718905343811981
Energy: 0.7347845420706721
Energy: 0.7189053438125399
Energy: 0.7347845420701133
Energy: 0.718905343811981
Energy: 0.7347845420706721
Energy: 0.7458871754214932
Energy: 0.7289755656288956
Energy: 0.7458871754209344
Energy: 0.7289755656294544
Energy: 0.7458871754214932
Energy: 0.7289755656288956
Energy: 0.8042864529154171
Energy: 0.7030043691371615
Energy: 0.8042864529154171
Energy: 0.7030043691371615
Energy: 0.8042864529154171
Energy: 0.7030043691377202
Energy: 0.61865685904359
Energy: 0.7328914843276328
Energy: 0.6186568590441489
Energy: 0.732891484327074
Energy: 0.6186568590430312
Energy: 0.7328914843259561
Energy: 0.7493274786631006
Energy: 0.7566950216994854
Energy: 0.7493274786647773
Energy: 0.7566950216989267
Energy: 0.7493274786631006
Energy: 0.7566950216994854
Energy: 0.7495957851743689
Energy: 0.7107218364012001
Energy: 0.7495957851760455
Energy: 0.7107218364012001
Energy: 0.7495957851749278
Energy: 0.7107218364012001
Energy: 0.6152647063351748
Energy: 0.7205102018648388
Energy: 0.6152647063374105
Energy: 0.7205102018648388
Energy: 0.6152647063351748
Energy: 0.72051020186428
Energy: 0.7569694634351902
Energy: 0.7599732138777108
Energy: 0.7569694634357491
Energy: 0.7599732138782695
Energy: 0.7569694634340725
Energy: 0.7599732138782695
Energy: 0.6978907645037319
Energy: 0.6563328401336903
Energy: 0.6978907645031729
Energy: 0.6563328401320137
Energy: 0.6978907645054084
Energy: 0.6563328401348081
Energy: 0.6539535484366717
Energy: 0.7214072971112864
Energy: 0.6539535484377895
Energy: 0.7214072971112864
Energy: 0.6539535484372306
Energy: 0.7214072971107275
Energy: 0.7778761510928754
Energy: 0.7903449797288773
Energy: 0.7778761510923166
Energy: 0.7903449797294362
Energy: 0.7778761510923166
Energy: 0.7903449797288773
Energy: 0.7354298440643728
Energy: 0.6228411350853462
Energy: 0.7354298440649318
Energy: 0.6228411350853462
Energy: 0.7354298440649318
Energy: 0.6228411350859052
Energy: 0.6796892921320697
Energy: 0.7732013877215717
Energy: 0.6796892921337464
Energy: 0.7732013877215717
Energy: 0.6796892921326286
Energy: 0.7732013877221304
Energy: 0.7509515712088126
Energy: 0.7671595079396791
Energy: 0.750951571208254
Energy: 0.767159507940238
Energy: 0.7509515712093716
Energy: 0.7671595079396791
Energy: 0.7327490763585809
Energy: 0.6150123327273036
Energy: 0.7327490763591399
Energy: 0.6150123327284213
Energy: 0.7327490763585809
Energy: 0.6150123327278624
Energy: 0.7263922822811482
Energy: 0.7968569413681695
Energy: 0.7263922822805892
Energy: 0.7968569413681695
Energy: 0.7263922822811482
Energy: 0.7968569413681695
Energy: 0.7375674734417093
Energy: 0.7418891593698581
Energy: 0.7375674734405914
Energy: 0.7418891593698581
Energy: 0.7375674734405914
Energy: 0.7418891593698581
Energy: 0.7619912526759685
Energy: 0.7084648232683906
Energy: 0.7619912526748507
Energy: 0.7084648232678316
Energy: 0.7619912526765273
Energy: 0.7084648232695084
Energy: 0.7111908056049314
Energy: 0.8447701410642747
Energy: 0.7111908056038136
Energy: 0.8447701410642747
Energy: 0.7111908056038136
Energy: 0.8447701410642747
Energy: 0.7701858945672714
Energy: 0.7234992910165094
Energy: 0.7701858945689479
Energy: 0.7234992910159506
Energy: 0.7701858945678302
Energy: 0.7234992910159506
Energy: 0.761674834387508
Energy: 0.7184642595325925
Energy: 0.761674834387508
Energy: 0.7184642595325925
Energy: 0.7616748343869492
Energy: 0.7184642595325925
Energy: 0.7310657759731753
Energy: 0.7746897499878268
Energy: 0.7310657759731753
Energy: 0.7746897499872679
Energy: 0.7310657759731753
Energy: 0.774689749986709
Energy: 0.7423419045983211
Energy: 0.707105502551677
Energy: 0.7423419045960855
Energy: 0.707105502551118
Energy: 0.7423419045966444
Energy: 0.707105502551677
Energy: 0.7628406550568745
Energy: 0.7463304762842662
Energy: 0.7628406550563156
Energy: 0.7463304762842662
Energy: 0.7628406550568745
Energy: 0.7463304762842662
Energy: 0.699989675706712
Energy: 0.7655904018644124
Energy: 0.6999896757061531
Energy: 0.7655904018632946
Energy: 0.699989675706712
Energy: 0.7655904018638535
Energy: 0.8172014502305606
Energy: 0.6214231120765082
Energy: 0.8172014502305606
Energy: 0.6214231120753905
Energy: 0.8172014502305606
Energy: 0.6214231120737139
Energy: 0.7513218680845282
Energy: 0.7607181029092734
Energy: 0.7513218680839693
Energy: 0.7607181029092734
Energy: 0.7513218680845282
Energy: 0.7607181029092734
Energy: 0.6790319985693158
Energy: 0.7332201786121058
Energy: 0.6790319985693158
Energy: 0.7332201786126645
Energy: 0.6790319985693158
Energy: 0.7332201786126645
Energy: 0.8252051437971596
Energy: 0.6630089176806581
Energy: 0.8252051437977184
Energy: 0.6630089176795403
Energy: 0.8252051437982773
Energy: 0.6630089176806581
Energy: 0.7838252218970226
Energy: 0.7568128703013272
Energy: 0.7838252218970226
Energy: 0.7568128703013272
Energy: 0.7838252218970226
Energy: 0.7568128703013272
Energy: 0.6511794465756306
Energy: 0.7179952887354502
Energy: 0.6511794465756306
Energy: 0.7179952887354502
Energy: 0.6511794465756306
Energy: 0.7179952887354502
Energy: 0.7637258608380781
Energy: 0.7180233232171344
Energy: 0.7637258608380781
Energy: 0.7180233232171344
Energy: 0.7637258608380781
Energy: 0.7180233232171344

minimum gb energy = 0.6150123327273036 eV
minimum distance =  2.2954994911014 Angstroms
sigma value = 67


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

Energy: 0.9874868730599319
Energy: 0.8734248886600334
Energy: 0.9874868730591354
Energy: 0.8734248886608298
Energy: 0.9874868730599319
Energy: 0.8734248886600334
Energy: 0.8663798063287113
Energy: 0.8947624372031087
Energy: 0.8663798063279149
Energy: 0.8947624372039049
Energy: 0.8663798063287113
Energy: 0.8947624372031087
Energy: 0.9227543534139834
Energy: 0.925105389337011
Energy: 0.9227543534131872
Energy: 0.9251053893378074
Energy: 0.9227543534147797
Energy: 0.9251053893386038
Energy: 0.9385963059158491
Energy: 0.8607077617443413
Energy: 0.9385963059158491
Energy: 0.8607077617443413
Energy: 0.9385963059158491
Energy: 0.8607077617443413
Energy: 0.7694734818346466
Energy: 0.8483037394241317
Energy: 0.769473481835443
Energy: 0.8483037394241317
Energy: 0.7694734818346466
Energy: 0.8483037394249282
Energy: 0.9187285615633706
Energy: 0.9130027323869191
Energy: 0.918728561561778
Energy: 0.9130027323869191
Energy: 0.918728561561778
Energy: 0.9130027323861227
Energy: 0.8617882260506947
Energy: 0.8360347110267621
Energy: 0.861788226049102
Energy: 0.8360347110275584
Energy: 0.8617882260522874
Energy: 0.8360347110267621
Energy: 0.8334070339182199
Energy: 0.8391794639051805
Energy: 0.8334070339174234
Energy: 0.839179463904384
Energy: 0.8334070339182199
Energy: 0.8391794639051805
Energy: 0.9451472356937715
Energy: 0.9565527010367023
Energy: 0.945147235692975
Energy: 0.9565527010367023
Energy: 0.945147235692975
Energy: 0.9565527010367023
Energy: 0.9035162757522995
Energy: 0.7875900367332309
Energy: 0.9035162757515031
Energy: 0.7875900367348236
Energy: 0.9035162757522995
Energy: 0.7875900367348236
Energy: 0.8771598238733952
Energy: 0.9178410156993785
Energy: 0.8771598238718024
Energy: 0.9178410156993785
Energy: 0.8771598238733952
Energy: 0.9178410156993785
Energy: 0.869946982797631
Energy: 0.9065873562673517
Energy: 0.8699469827984273
Energy: 0.9065873562673517
Energy: 0.869946982797631
Energy: 0.9065873562673517
Energy: 0.9024225148548917
Energy: 0.855788682232659
Energy: 0.9024225148540953
Energy: 0.8557886822342516
Energy: 0.9024225148556881
Energy: 0.8557886822334554
Energy: 0.8619852006988564
Energy: 0.9436035130344023
Energy: 0.8619852007004493
Energy: 0.943603513035995
Energy: 0.8619852006996529
Energy: 0.9436035130336059
Energy: 0.8711997536356232
Energy: 0.8629069922269704
Energy: 0.8711997536364197
Energy: 0.8629069922269704
Energy: 0.8711997536356232
Energy: 0.8629069922269704
Energy: 0.9413301100435023
Energy: 0.8822805123145768
Energy: 0.9413301100435023
Energy: 0.8822805123145768
Energy: 0.9413301100442986
Energy: 0.8822805123145768
Energy: 0.8902325250615138
Energy: 0.9342612600103282
Energy: 0.8902325250607174
Energy: 0.9342612600111245
Energy: 0.890232525059921
Energy: 0.9342612600103282
Energy: 0.8992276680221593
Energy: 0.8471420568773113
Energy: 0.8992276680237521
Energy: 0.8471420568773113
Energy: 0.8992276680221593
Energy: 0.8471420568773113
Energy: 0.9098364476213917
Energy: 0.9262160440396564
Energy: 0.9098364476205956
Energy: 0.9262160440396564
Energy: 0.9098364476213917
Energy: 0.92621604403886
Energy: 0.7738339030918041
Energy: 0.9437736647566157
Energy: 0.7738339030926005
Energy: 0.9437736647566157
Energy: 0.7738339030941932
Energy: 0.9437736647566157
Energy: 0.943099545656839
Energy: 0.8568606019941487
Energy: 0.9430995456560427
Energy: 0.8568606019941487
Energy: 0.9430995456560427
Energy: 0.8568606019941487
Energy: 0.9433845224923777
Energy: 0.9656869082813401
Energy: 0.9433845224923777
Energy: 0.9656869082813401
Energy: 0.9433845224931741
Energy: 0.9656869082813401
Energy: 0.7792561266868202
Energy: 0.926389024413389
Energy: 0.7792561266852274
Energy: 0.9263890244125927
Energy: 0.7792561266892092
Energy: 0.926389024413389

minimum gb energy = 0.7694734818346466 eV
minimum distance =  2.31992118275558 Angstroms
sigma value = 33


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

Energy: 1.0718655366683103
Energy: 0.9492028049413505
Energy: 1.0718655366678047
Energy: 0.9492028049413505
Energy: 1.0718655366693204
Energy: 0.9492028049408453
Energy: 0.9564871284651774
Energy: 0.9871360921263698
Energy: 0.9564871284646723
Energy: 0.9871360921263698
Energy: 0.9564871284646723
Energy: 0.9871360921263698
Energy: 1.0214280235834452
Energy: 1.0068855734468856
Energy: 1.0214280235819295
Energy: 1.0068855734468856
Energy: 1.02142802358294
Energy: 1.0068855734468856
Energy: 1.0250072303445181
Energy: 0.9767624369469682
Energy: 1.0250072303445181
Energy: 0.9767624369469682
Energy: 1.025007230344013
Energy: 0.976762436946463
Energy: 0.9667922459032793
Energy: 0.9821805364643486
Energy: 0.9667922459022689
Energy: 0.9821805364643486
Energy: 0.9667922459042897
Energy: 0.9821805364638433
Energy: 1.0843519832973836
Energy: 1.0159939478034596
Energy: 1.0843519832983939
Energy: 1.015993947803965
Energy: 1.0843519832968784
Energy: 1.015993947803965
Energy: 0.9565062181723393
Energy: 0.9216244215961914
Energy: 0.956506218171834
Energy: 0.9216244215966967
Energy: 0.9565062181733497
Energy: 0.9216244215961914
Energy: 0.9492654592268636
Energy: 1.0183806346209194
Energy: 0.949265459225853
Energy: 1.0183806346209194
Energy: 0.949265459225853
Energy: 1.0183806346209194
Energy: 0.9741863992614529
Energy: 1.0239603349487703
Energy: 0.9741863992614529
Energy: 1.0239603349487703
Energy: 0.9741863992614529
Energy: 1.0239603349482649
Energy: 1.062961320256259
Energy: 0.9770810258736614
Energy: 1.0629613202577746
Energy: 0.9571229878183507
Energy: 1.062961320256764
Energy: 0.9362586183684254
Energy: 0.996972064734969
Energy: 1.010003591605831
Energy: 0.9969720647359795
Energy: 1.010003591605831
Energy: 0.9969720647354745
Energy: 1.010003591605831
Energy: 0.9589501512889924
Energy: 0.9651339056344344
Energy: 0.9589501512884872
Energy: 0.9651339056344344
Energy: 0.9589501512889924
Energy: 0.9651339056344344
Energy: 1.0632421067978568
Energy: 0.9660247040491419
Energy: 1.0632421067988675
Energy: 0.9660247040491419
Energy: 1.0632421067983624
Energy: 0.9660247040486367
Energy: 0.9609706522501872
Energy: 1.0100716712424005
Energy: 0.9609706522501872
Energy: 1.0100716712424005
Energy: 0.9609706522501872
Energy: 1.0100716712424005
Energy: 0.9940382520358046
Energy: 0.9837881154103212
Energy: 0.9940382520368151
Energy: 0.9837881154103212
Energy: 0.9940382520358046
Energy: 0.9837881154103212
Energy: 1.0247425418948872
Energy: 1.024126057547439
Energy: 1.024742541894382
Energy: 1.0241260575469338
Energy: 1.024742541894382
Energy: 1.0241260575464286
Energy: 0.891136819387766
Energy: 1.0073170170923436
Energy: 0.89113681938524
Energy: 1.0073170170923436
Energy: 0.8911368193837245
Energy: 1.0073170170918384
Energy: 1.0472131897958075
Energy: 1.0638596375022493
Energy: 1.047213189795302
Energy: 1.0638596375022493
Energy: 1.047213189795302
Energy: 1.0638596375022493
Energy: 0.9521660247817448
Energy: 1.0327068974423346
Energy: 0.9521660247832603
Energy: 1.0327068974433449
Energy: 0.9521660247827552
Energy: 1.03270689744284
Energy: 0.9562106856427426
Energy: 1.007873036486985
Energy: 0.9562106856427426
Energy: 1.007873036486985
Energy: 0.9562106856442583
Energy: 1.0078730364864799
Energy: 1.0232863001050034
Energy: 1.0214637158678703
Energy: 1.023286300107024
Energy: 1.0214637158683755
Energy: 1.0232863001055086
Energy: 1.0214637158678703
Energy: 0.9894070029110729
Energy: 0.946348485058737
Energy: 0.9894070029105678
Energy: 0.9463484850592423
Energy: 0.9894070029120833
Energy: 0.9463484850592423
Energy: 0.9845067035522391
Energy: 1.0097522875757698
Energy: 0.9845067035527443
Energy: 1.009752287575265
Energy: 0.9845067035502183
Energy: 1.009752287575265
Energy: 1.0621594617811783
Energy: 0.9607644607155782
Energy: 1.0621594617821886
Energy: 0.9607644607145678
Energy: 1.0621594617816834
Energy: 0.9607644607140626
Energy: 0.9559146210014519
Energy: 0.9596018153851117
Energy: 0.955914621001957
Energy: 0.9596018153851117
Energy: 0.9559146210024623
Energy: 0.9596018153846063
Energy: 0.9943623578942682
Energy: 1.0236966844189654
Energy: 0.9943623578952784
Energy: 1.0236966844189654
Energy: 0.9943623578937627
Energy: 1.0236966844189654
Energy: 0.9561449734956383
Energy: 0.9466460680024575
Energy: 0.956144973497154
Energy: 0.9466460680024575
Energy: 0.9561449734961435
Energy: 0.9466460680024575
Energy: 1.0208098446028668
Energy: 1.0785686302148267
Energy: 1.0208098446038776
Energy: 1.0690165372631932
Energy: 1.0208098446038776
Energy: 1.0785686302148267
Energy: 0.9487640298143077
Energy: 0.9828627151104149
Energy: 0.9487640298143077
Energy: 0.9828627151099095
Energy: 0.9487640298168336
Energy: 0.9828627151099095
Energy: 0.9513812434541432
Energy: 0.9178117162322866
Energy: 0.9513812434556589
Energy: 0.9178117162317815
Energy: 0.9513812434536381
Energy: 0.9178117162327918
Energy: 1.0792841339045018
Energy: 1.0628329761969513
Energy: 1.0792841339034913
Energy: 1.0628329761969513
Energy: 1.0792841339045018
Energy: 1.0628329761969513
Energy: 0.9073211159248341
Energy: 1.0237389926690368
Energy: 0.9073211159258446
Energy: 1.0237389926695422
Energy: 0.9073211159268549
Energy: 1.0237389926695422
Energy: 1.0244310735290858
Energy: 1.0024841522810917
Energy: 1.0244310735295912
Energy: 1.0024841522805865
Energy: 1.0244310735295912
Energy: 1.0024841522810917
Energy: 0.9911630708341352
Energy: 0.9869373404543532
Energy: 0.9911630708346406
Energy: 0.9869373404543532
Energy: 0.9911630708351457
Energy: 0.9869373404548584
Energy: 0.9600172595299864
Energy: 1.007168566988586
Energy: 0.9600172595309968
Energy: 1.007168566988586
Energy: 0.9600172595309968
Energy: 1.007168566988586
Energy: 1.073602649783764
Energy: 0.9491185227035475
Energy: 1.0736026497827538
Energy: 0.9491185227030423
Energy: 1.073602649783259
Energy: 0.9491185227030423
Energy: 0.9585431794151078
Energy: 0.9820302639911015
Energy: 0.9585431794161183
Energy: 0.9820302639905962
Energy: 0.9585431794151078
Energy: 0.9820302639905962

minimum gb energy = 0.8911368193837245 eV
minimum distance =  2.28751780812777 Angstroms
sigma value = 41


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

Energy: 1.1736099799073432
Energy: 1.126865481008397
Energy: 1.1736099799045845
Energy: 1.126865481008397
Energy: 1.1736099799059636
Energy: 1.1268654810070176
Energy: 1.1015368819719789
Energy: 1.1287673973427472
Energy: 1.1015368819747375
Energy: 1.1287673973427472
Energy: 1.1015368819733584
Energy: 1.1287673973427472
Energy: 1.2526704071200592
Energy: 1.1244426642932324
Energy: 1.2526704071228176
Energy: 1.1244426642932324
Energy: 1.2526704071228176
Energy: 1.1244426642932324
Energy: 1.166508658332604
Energy: 1.1565396864145174
Energy: 1.166508658332604
Energy: 1.1565396864145174
Energy: 1.1665086583339834
Energy: 1.1565396864145174
Energy: 1.0861596692592457
Energy: 1.1170522897106339
Energy: 1.0861596692606248
Energy: 1.1170522897106339
Energy: 1.0861596692578663
Energy: 1.1170522897106339
Energy: 1.2460998614475927
Energy: 1.1992184773021748
Energy: 1.2460998614475927
Energy: 1.1992184773035541
Energy: 1.246099861448972
Energy: 1.1992184773021748
Energy: 1.1633019762388725
Energy: 1.075808825352827
Energy: 1.1633019762374932
Energy: 1.075808825352827
Energy: 1.1633019762374932
Energy: 1.075808825352827
Energy: 1.162683623219066
Energy: 1.1303009962031114
Energy: 1.1626836232204456
Energy: 1.1303009962031114
Energy: 1.1626836232204456
Energy: 1.1303009962031114
Energy: 1.1062117596843992
Energy: 1.1017416071651018
Energy: 1.10621175968302
Energy: 1.1017416071651018
Energy: 1.10621175968302
Energy: 1.1017416071651018
Energy: 1.166331221619263
Energy: 1.139087846467396
Energy: 1.166331221619263
Energy: 1.139087846467396
Energy: 1.166331221619263
Energy: 1.139087846467396
Energy: 1.1579840433271533
Energy: 1.124729988060933
Energy: 1.1969674354977582
Energy: 1.124729988060933
Energy: 1.1047701569166763
Energy: 1.124729988060933
Energy: 1.1542227291391889
Energy: 1.14650242426343
Energy: 1.1542227291391889
Energy: 1.14650242426343
Energy: 1.154222729140568
Energy: 1.14650242426343
Energy: 1.1787988844113801
Energy: 1.1781436541852612
Energy: 1.1787988844113801
Energy: 1.1781436541852612
Energy: 1.1787988844127597
Energy: 1.1781436541852612
Energy: 1.0928203142497972
Energy: 1.130552092360877
Energy: 1.0928203142484179
Energy: 1.130552092360877
Energy: 1.0928203142484179
Energy: 1.130552092360877

minimum gb energy = 1.075808825352827 eV
minimum distance =  2.27836108027961 Angstroms
sigma value = 11


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

Energy: 1.3481550663829462
Energy: 1.3119143526995514
Energy: 1.3481550663835522
Energy: 1.311914352700157
Energy: 1.3481550663829462
Energy: 1.3119143526995514
Energy: 1.2149353604827846
Energy: 1.2562469677695802
Energy: 1.2149353604821789
Energy: 1.256246967768974
Energy: 1.2149353604821789
Energy: 1.2562469677695802
Energy: 1.287069641252768
Energy: 1.2627201739825573
Energy: 1.2870696412594334
Energy: 1.2627201739831357
Energy: 1.287069641261857
Energy: 1.2627201739831357
Energy: 1.2766019578680585
Energy: 1.2184760154717902
Energy: 1.2766019578680585
Energy: 1.2184760154711842
Energy: 1.2766019578674526
Energy: 1.2184760154711842
Energy: 1.2866117085287245
Energy: 1.2565455942885015
Energy: 1.2866117085287245
Energy: 1.2565455942885015
Energy: 1.2866117085293305
Energy: 1.2565455942891075
Energy: 1.249824952398447
Energy: 1.3037581391193007
Energy: 1.249824952397841
Energy: 1.3037581391199065
Energy: 1.249824952397841
Energy: 1.3037581391193007
Energy: 1.2661594528927114
Energy: 1.247029180750547
Energy: 1.2661594528921054
Energy: 1.247029180750547
Energy: 1.2661594528933173
Energy: 1.247029180750547
Energy: 1.258457444753761
Energy: 1.2753983546517507
Energy: 1.2584574447549732
Energy: 1.2753983546511447
Energy: 1.2584574447543673
Energy: 1.2753983546511447
Energy: 1.2784149182269386
Energy: 1.25066243291254
Energy: 1.278414918226333
Energy: 1.25066243291254
Energy: 1.2784149182269386
Energy: 1.2506624329131462
Energy: 1.2517456736666108
Energy: 1.277852052363891
Energy: 1.2517456736666108
Energy: 1.277852052363891
Energy: 1.2517456736672168
Energy: 1.277852052363891
Energy: 1.2231619645333809
Energy: 1.2617913492403456
Energy: 1.2231619645333809
Energy: 1.2617913492403456
Energy: 1.2231619645333809
Energy: 1.2617913492403456
Energy: 1.2743846502387794
Energy: 1.285759225813352
Energy: 1.2743846502369618
Energy: 1.285759225813352
Energy: 1.2743846502381737
Energy: 1.285759225813352
Energy: 1.2768245295473448
Energy: 1.2523658981704011
Energy: 1.2768245295467389
Energy: 1.2523658981710073
Energy: 1.2768245295467389
Energy: 1.2523658981710073
Energy: 1.2676823803094401
Energy: 1.2812776736403475
Energy: 1.2676823803094401
Energy: 1.2812776736403475
Energy: 1.267682380310046
Energy: 1.2812776736403475
Energy: 1.2103051834666936
Energy: 1.2637303482503823
Energy: 1.2103051834666936
Energy: 1.2637303482503823
Energy: 1.2103051834654819
Energy: 1.2637303482503823
Energy: 1.2680681544715173
Energy: 1.2463112587455767
Energy: 1.2680681544715173
Energy: 1.2463112587455767
Energy: 1.2680681544709111
Energy: 1.2463112587455767
Energy: 1.226420178228965
Energy: 1.254703438836753
Energy: 1.2264201782283592
Energy: 1.254703438836753
Energy: 1.226420178228965
Energy: 1.254703438836147
Energy: 1.2894828899709654
Energy: 1.2915484579207521
Energy: 1.2894828899703594
Energy: 1.2915484579213583
Energy: 1.2894828899697532
Energy: 1.29154845792257
Energy: 1.2640198603971138
Energy: 1.207276399149839
Energy: 1.2640198603959292
Energy: 1.207276399149233
Energy: 1.2640198603959292
Energy: 1.207276399149839
Energy: 1.2548438990218598
Energy: 1.2557792121683087
Energy: 1.2548438990218598
Energy: 1.2557792121677027
Energy: 1.2548438990224657
Energy: 1.2557792121683087
Energy: 1.2277796384088049
Energy: 1.2458861688765948
Energy: 1.2277796384094106
Energy: 1.2458861688759888
Energy: 1.227779638408199
Energy: 1.2458861688759888
Energy: 1.3135603812238557
Energy: 1.3003257266639745
Energy: 1.3135603812238557
Energy: 1.3003257266639745
Energy: 1.3135603812238557
Energy: 1.3003257266639745
Energy: 1.2586396421199455
Energy: 1.2628372035205073
Energy: 1.2586396421211574
Energy: 1.2628372035199011
Energy: 1.2586396421205515
Energy: 1.2628372035205073
Energy: 1.3027911975903397
Energy: 1.267093849398084
Energy: 1.3027911975891278
Energy: 1.267093849398084
Energy: 1.3027911975897337
Energy: 1.2670938493986899
Energy: 1.255091403279408
Energy: 1.2641141043681805
Energy: 1.255091403279408
Energy: 1.2641141043681805
Energy: 1.255091403280014
Energy: 1.2641141043681805
Energy: 1.2371944924162126
Energy: 1.2555452308649555
Energy: 1.2371944924174247
Energy: 1.2555452308649555
Energy: 1.2371944924168188
Energy: 1.2555452308649555
Energy: 1.2404179860893894
Energy: 1.313687277623408
Energy: 1.2404179860893894
Energy: 1.31368727762462
Energy: 1.240417986089995
Energy: 1.31368727762462
Energy: 1.2731979786014844
Energy: 1.2481125191198434
Energy: 1.2731979786014844
Energy: 1.2481125191198434
Energy: 1.2731979786008785
Energy: 1.2481125191198434
Energy: 1.2676923900823962
Energy: 1.2806116884953456
Energy: 1.2676923900823962
Energy: 1.2806116884953456
Energy: 1.2676923900817905
Energy: 1.2806116884959517
Energy: 1.2505392006562548
Energy: 1.2027841770724894
Energy: 1.2505392006568607
Energy: 1.2027841770749133
Energy: 1.2505392006562548
Energy: 1.202784177074307
Energy: 1.247341265316574
Energy: 1.3143811374590233
Energy: 1.247341265316574
Energy: 1.3143811374590233
Energy: 1.247341265316574
Energy: 1.3143811374590233

minimum gb energy = 1.2027841770724894 eV
minimum distance =  2.23924201492103 Angstroms
sigma value = 57


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

Energy: 1.2118769278762451
Energy: 1.2298522264860297
Energy: 1.2118769278751667
Energy: 1.2298522264871081
Energy: 1.2118769278762451
Energy: 1.2298522264871081
Energy: 1.222628962313116
Energy: 1.251076846617665
Energy: 1.2226289623152724
Energy: 1.251076846617665
Energy: 1.222628962313116
Energy: 1.251076846617665
Energy: 1.2821105079371726
Energy: 1.2624762484479366
Energy: 1.2821105079360942
Energy: 1.2624762484479366
Energy: 1.2821105079371726
Energy: 1.2624762484479366
Energy: 1.2243351991735725
Energy: 1.3889567400706557
Energy: 1.224335199174651
Energy: 1.3889567400706557
Energy: 1.2243351991735725
Energy: 1.3889567400706557
Energy: 1.2820001221476756
Energy: 1.2625291012436068
Energy: 1.2820001221476756
Energy: 1.2625291012436068
Energy: 1.2820001221476756
Energy: 1.2625291012436068
Energy: 1.2233207609078536
Energy: 1.2510482431506948
Energy: 1.2233207609067753
Energy: 1.2510482431506948
Energy: 1.2233207609089318
Energy: 1.3249732787118165
Energy: 1.2118769278751667
Energy: 1.2298522264849514
Energy: 1.2118769278751667
Energy: 1.2298522264849514
Energy: 1.2118769278751667
Energy: 1.2298522264849514
Energy: 1.2226289623152724
Energy: 1.2510768466187434
Energy: 1.2226289623163509
Energy: 1.2510768466187434
Energy: 1.2226289623152724
Energy: 1.2510768466187434
Energy: 1.2821105079404076
Energy: 1.2624762484490148
Energy: 1.2821105079393291
Energy: 1.2624762484490148
Energy: 1.2821105079393291
Energy: 1.2624762484490148
Energy: 1.2243351991735725
Energy: 1.3889567400706557
Energy: 1.2243351991757292
Energy: 1.3889567400706557
Energy: 1.224335199174651
Energy: 1.3889567400706557
Energy: 1.2820001221476756
Energy: 1.262529101244685
Energy: 1.2820001221465975
Energy: 1.262529101244685
Energy: 1.2820001221476756
Energy: 1.262529101244685
Energy: 1.223320760905697
Energy: 1.2510482431539298
Energy: 1.2233207609067753
Energy: 1.2510482431528518
Energy: 1.2233207609078536
Energy: 1.3411553906799347
Energy: 1.2118769278762451
Energy: 1.2298522264860297
Energy: 1.2118769278751667
Energy: 1.2298522264871081
Energy: 1.2118769278762451
Energy: 1.2298522264860297
Energy: 1.2226289623120374
Energy: 1.251076846617665
Energy: 1.222628962313116
Energy: 1.2510768466187434
Energy: 1.222628962313116
Energy: 1.251076846617665
Energy: 1.2821105079371726
Energy: 1.2624762484479366
Energy: 1.2821105079371726
Energy: 1.2624762484479366
Energy: 1.2821105079371726
Energy: 1.2624762484479366
Energy: 1.2243351991735725
Energy: 1.3733867439082574
Energy: 1.224335199174651
Energy: 1.3733867439082574
Energy: 1.2243351991735725
Energy: 1.3733867439082574
Energy: 1.2820001221476756
Energy: 1.2625291012436068
Energy: 1.2820001221476756
Energy: 1.2625291012436068
Energy: 1.2820001221476756
Energy: 1.2625291012436068

minimum gb energy = 1.2118769278751667 eV
minimum distance =  2.27302315265177 Angstroms
sigma value = 9


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

Energy: 1.332167363995128
Energy: 1.2683197491975464
Energy: 1.332167363994247
Energy: 1.2683197491975464
Energy: 1.332167363995128
Energy: 1.2683197491975464
Energy: 1.3147556309187094
Energy: 1.2694803565696389
Energy: 1.3147556309204702
Energy: 1.2694803565687582
Energy: 1.3147556309195898
Energy: 1.2694803565687582
Energy: 1.3011056921320967
Energy: 1.2984129622431728
Energy: 1.3011056921320967
Energy: 1.2984129622431728
Energy: 1.3011056921320967
Energy: 1.2984129622431728
Energy: 1.2853441190990642
Energy: 1.3809757129543607
Energy: 1.2853441190990642
Energy: 1.3809757129543607
Energy: 1.2853441191008248
Energy: 1.3809757129534803
Energy: 1.3059484138633108
Energy: 1.3070271337830615
Energy: 1.3059484138633108
Energy: 1.3070271337830615
Energy: 1.3059484138624304
Energy: 1.3070271337830615
Energy: 1.322507561251861
Energy: 1.305779091375983
Energy: 1.3225075612509807
Energy: 1.3057790913768639
Energy: 1.3225075612509807
Energy: 1.3057790913768639
Energy: 1.2861742815288102
Energy: 1.3234323235195944
Energy: 1.2861742815296908
Energy: 1.3234323235195944
Energy: 1.2861742815288102
Energy: 1.3234323235187138
Energy: 1.2883549798037959
Energy: 1.336061920782281
Energy: 1.2883549798029155
Energy: 1.336061920782281
Energy: 1.2883549798037959
Energy: 1.336061920782281
Energy: 1.4031179603365365
Energy: 1.317836520207491
Energy: 1.4031179603365365
Energy: 1.317836520207491
Energy: 1.4031179603356563
Energy: 1.3178365202083713
Energy: 1.2827869157846399
Energy: 1.2955838961752055
Energy: 1.2827869157846399
Energy: 1.295583896176086
Energy: 1.2827869157846399
Energy: 1.2955838961752055
Energy: 1.293229731610148
Energy: 1.312981253258054
Energy: 1.2932297316110286
Energy: 1.3129812532571736
Energy: 1.2932297316127892
Energy: 1.312981253258054
Energy: 1.3703209566075574
Energy: 1.3029569626927326
Energy: 1.3703209566101986
Energy: 1.3029569626927326
Energy: 1.3703209566101986
Energy: 1.3029569626927326
Energy: 1.2868517752344015
Energy: 1.3521379160635245
Energy: 1.2868517752335211
Energy: 1.3521379160635245
Energy: 1.2868517752335211
Energy: 1.3521379160635245
Energy: 1.2929029310532962
Energy: 1.2989473853596785
Energy: 1.2929029310532962
Energy: 1.2989473853596785
Energy: 1.2929029310532962
Energy: 1.2989473853596785
Energy: 1.331407389546854
Energy: 1.3025302058219654
Energy: 1.3314073895459735
Energy: 1.3025302058219654
Energy: 1.3314073895459735
Energy: 1.3025302058219654
Energy: 1.32985289159198
Energy: 1.3123878810682148
Energy: 1.3298528915928607
Energy: 1.3123878810682148
Energy: 1.32985289159198
Energy: 1.3123878810682148
Energy: 1.327680360203498
Energy: 1.3119366773371772
Energy: 1.327680360203498
Energy: 1.3119366773362968
Energy: 1.3276803602017373
Energy: 1.3119366773362968
Energy: 1.4361398522667497
Energy: 1.303653764426651
Energy: 1.4361398522667497
Energy: 1.303653764426651
Energy: 1.4361398522667497
Energy: 1.303653764426651
Energy: 1.2811256515659053
Energy: 1.3023615444622343
Energy: 1.2811256515676661
Energy: 1.3023615444622343
Energy: 1.2811256515676661
Energy: 1.3023615444622343
Energy: 1.2916915484259799
Energy: 1.269930290838852
Energy: 1.291691548427741
Energy: 1.269930290838852
Energy: 1.2916915484259799
Energy: 1.2699302908397325
Energy: 1.3753053629916754
Energy: 1.300862351967522
Energy: 1.375305362990795
Energy: 1.300862351967522
Energy: 1.3753053629916754
Energy: 1.300862351967522

minimum gb energy = 1.2683197491975464 eV
minimum distance =  2.24813117636336 Angstroms
sigma value = 27


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

Energy: 1.366525157039827
Energy: 1.255688276594171
Energy: 1.366525157040569
Energy: 1.2556882765919448
Energy: 1.366525157040569
Energy: 1.2556882765949133
Energy: 1.333756704863724
Energy: 1.2481760095373655
Energy: 1.333756704863724
Energy: 1.2481760095373655
Energy: 1.333756704863724
Energy: 1.2481760095373655
Energy: 1.2697008062319681
Energy: 1.2433312136553678
Energy: 1.2697008062312258
Energy: 1.2433312136561097
Energy: 1.269700806230484
Energy: 1.2433312136561097
Energy: 1.248194837061492
Energy: 1.2658084315351026
Energy: 1.248194837061492
Energy: 1.2658084315351026
Energy: 1.2481948370607499
Energy: 1.2658084315351026
Energy: 1.248356260533742
Energy: 1.2895758385770695
Energy: 1.2483562605329996
Energy: 1.289575838575585
Energy: 1.248356260533742
Energy: 1.2895758385763274
Energy: 1.2784953941889217
Energy: 1.3325965556404187
Energy: 1.2784953941889217
Energy: 1.332596555641161
Energy: 1.2784953941889217
Energy: 1.332596555641161
Energy: 1.2261430742308226
Energy: 1.3031890802034671
Energy: 1.2261430742308226
Energy: 1.3031890802004988
Energy: 1.2261430742308226
Energy: 1.3031890802004988
Energy: 1.2597432211328785
Energy: 1.2692424792707508
Energy: 1.2597432211328785
Energy: 1.2692424792707508
Energy: 1.2597432211336204
Energy: 1.2692424792707508
Energy: 1.2717791637676867
Energy: 1.2598499274626354
Energy: 1.2717791637684286
Energy: 1.2598499274626354
Energy: 1.2717791637676867
Energy: 1.2598499274633774
Energy: 1.3643438222697035
Energy: 1.266945155831573
Energy: 1.3643438222697035
Energy: 1.266945155831573
Energy: 1.3643438222697035
Energy: 1.266945155831573
Energy: 1.3370948003293275
Energy: 1.2989256394587552
Energy: 1.3370948003293275
Energy: 1.2989256394587552
Energy: 1.3370948003293275
Energy: 1.2989256394580129
Energy: 1.3055646812357138
Energy: 1.2256696162663956
Energy: 1.3055646812364559
Energy: 1.2256696162663956
Energy: 1.3055646812349717
Energy: 1.2256696162656535
Energy: 1.3079812938429618
Energy: 1.2859378169672984
Energy: 1.3079812938429618
Energy: 1.2859378169680404
Energy: 1.3079812938422197
Energy: 1.2859378169665563
Energy: 1.2550471304774216
Energy: 1.2731245697147677
Energy: 1.2550471304781636
Energy: 1.2731245697147677
Energy: 1.2550471304774216
Energy: 1.2731245697147677
Energy: 1.268240248182091
Energy: 1.3491402039828067
Energy: 1.2682402481806068
Energy: 1.3491402039828067
Energy: 1.268240248182091
Energy: 1.3491402039828067
Energy: 1.2771749233380398
Energy: 1.3485642067775525
Energy: 1.277174923336556
Energy: 1.3485642067775525
Energy: 1.2771749233372978
Energy: 1.3485642067775525
Energy: 1.2263710375998638
Energy: 1.2710117686192737
Energy: 1.2263710375998638
Energy: 1.2710117686192737
Energy: 1.2263710375998638
Energy: 1.2710117686192737
Energy: 1.2668794204834002
Energy: 1.2763420634071285
Energy: 1.2668794204841425
Energy: 1.2763420634071285
Energy: 1.2668794204841425
Energy: 1.2763420634078708
Energy: 1.2169904792049535
Energy: 1.270367363472969
Energy: 1.2169904792056958
Energy: 1.270367363472969
Energy: 1.2169904792056958
Energy: 1.270367363472227
Energy: 1.3665251570450219
Energy: 1.2556882765912027
Energy: 1.3665251570450219
Energy: 1.2556882765963977
Energy: 1.3665251570450219
Energy: 1.255688276592687
Energy: 1.33375670486224
Energy: 1.2481760095388497
Energy: 1.3337567048629821
Energy: 1.2481760095388497
Energy: 1.3337567048629821
Energy: 1.2481760095388497
Energy: 1.2697008062282575
Energy: 1.2433312136546257
Energy: 1.2697008062282575
Energy: 1.2433312136546257
Energy: 1.2697008062289996
Energy: 1.2433312136546257
Energy: 1.2481948370629763
Energy: 1.265808431537329
Energy: 1.248194837062234
Energy: 1.265808431536587
Energy: 1.248194837062234
Energy: 1.265808431536587
Energy: 1.248356260533742
Energy: 1.2895758385748433
Energy: 1.248356260533742
Energy: 1.289575838574101
Energy: 1.248356260533742
Energy: 1.289575838574101
Energy: 1.2784953941859531
Energy: 1.3325965556419028
Energy: 1.2784953941866954
Energy: 1.3325965556419028
Energy: 1.2784953941859531
Energy: 1.3325965556419028

minimum gb energy = 1.2169904792049535 eV
minimum distance =  2.23951747837477 Angstroms
sigma value = 19


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

Energy: 1.2516089191769402
Energy: 1.2791503140953029
Energy: 1.2516089191762996
Energy: 1.2791503140953029
Energy: 1.2516089191769402
Energy: 1.2791503140953029
Energy: 1.2685131529159306
Energy: 1.2314132618965592
Energy: 1.2685131529159306
Energy: 1.2314132618959186
Energy: 1.2685131529159306
Energy: 1.2314132618959186
Energy: 1.2938932940629355
Energy: 1.1888424920079774
Energy: 1.293893294062295
Energy: 1.1888424920079774
Energy: 1.293893294062295
Energy: 1.1888424920079774
Energy: 1.2061267558333815
Energy: 1.267031464554662
Energy: 1.206126755834022
Energy: 1.2670314645540215
Energy: 1.206126755834022
Energy: 1.267031464554662
Energy: 1.2348373852536039
Energy: 1.2569921985102643
Energy: 1.2348373852523225
Energy: 1.2569921985102643
Energy: 1.234837385252963
Energy: 1.2569921985096237
Energy: 1.2704331971065914
Energy: 1.2148384894491826
Energy: 1.2704331971065914
Energy: 1.2148384894491826
Energy: 1.270433197107232
Energy: 1.2148384894491826
Energy: 1.1844423170124634
Energy: 1.283916739631564
Energy: 1.1844423170118228
Energy: 1.283916739631564
Energy: 1.1844423170124634
Energy: 1.283916739631564
Energy: 1.2258035824256202
Energy: 1.2994985036985365
Energy: 1.2258035824256202
Energy: 1.2994985036985365
Energy: 1.2258035824249796
Energy: 1.2994985036985365
Energy: 1.328394040271048
Energy: 1.1862186235946335
Energy: 1.328394040271048
Energy: 1.186218623593993
Energy: 1.3283940402716885
Energy: 1.186218623593993
Energy: 1.2474963078548729
Energy: 1.2556143386864305
Energy: 1.2474963078555135
Energy: 1.2556143386864305
Energy: 1.2474963078548729
Energy: 1.2556143386864305
Energy: 1.1899893481938024
Energy: 1.2887004938974593
Energy: 1.1899893481938024
Energy: 1.2887004938981
Energy: 1.1899893481931618
Energy: 1.2887004938981
Energy: 1.280089507119246
Energy: 1.1864213070352887
Energy: 1.2800895071205272
Energy: 1.1864213070352887
Energy: 1.2800895071198866
Energy: 1.1864213070352887
Energy: 1.252578721211345
Energy: 1.2402503883190439
Energy: 1.2525787212119857
Energy: 1.2402503883190439
Energy: 1.252578721211345
Energy: 1.2402503883190439
Energy: 1.2095376413480263
Energy: 1.2671432206459192
Energy: 1.209537641348667
Energy: 1.2671432206452786
Energy: 1.209537641348667
Energy: 1.2671432206459192
Energy: 1.2811915551533954
Energy: 1.2036337613615726
Energy: 1.2811915551533954
Energy: 1.2036337613622132
Energy: 1.2811915551533954
Energy: 1.2036337613615726
Energy: 1.2747945905383236
Energy: 1.180254714823634
Energy: 1.2747945905370426
Energy: 1.180254714823634
Energy: 1.2747945905383236
Energy: 1.180254714823634
Energy: 1.204966260934379
Energy: 1.2705328174597301
Energy: 1.204966260934379
Energy: 1.270532817460371
Energy: 1.204966260934379
Energy: 1.2705328174597301
Energy: 1.2535305040204252
Energy: 1.2700501255292584
Energy: 1.2535305040204252
Energy: 1.2700501255292584
Energy: 1.2535305040197844
Energy: 1.2700501255292584
Energy: 1.2571158419045787
Energy: 1.2124073889689535
Energy: 1.2571158419045787
Energy: 1.2124073889683127
Energy: 1.2571158419039383
Energy: 1.2124073889689535
Energy: 1.2217226105735524
Energy: 1.2739554308706547
Energy: 1.2217226105735524
Energy: 1.2739554308706547
Energy: 1.2217226105729118
Energy: 1.2739554308706547
Energy: 1.1756867077318285
Energy: 1.2882736170532947
Energy: 1.1756867077318285
Energy: 1.2882736170520133
Energy: 1.175686707732469
Energy: 1.288273617052654
Energy: 1.3324641841881235
Energy: 1.1880497264381895
Energy: 1.332464184187483
Energy: 1.1880497264381895
Energy: 1.3324641841881235
Energy: 1.1880497264381895
Energy: 1.2474955095056424
Energy: 1.2409287797639654
Energy: 1.2474955095050018
Energy: 1.240928779764606
Energy: 1.2474955095056424
Energy: 1.240928779764606
Energy: 1.2469993951788894
Energy: 1.2835436861112208
Energy: 1.2469993951788894
Energy: 1.2835436861112208
Energy: 1.24699939517953
Energy: 1.2835436861112208
Energy: 1.2615585337193205
Energy: 1.1890485258096013
Energy: 1.2615585337180393
Energy: 1.1890485258096013
Energy: 1.2615585337193205
Energy: 1.189048525808961
Energy: 1.266689016067128
Energy: 1.2033606826572183
Energy: 1.266689016067128
Energy: 1.203360682657859
Energy: 1.2666890160664874
Energy: 1.2033606826572183
Energy: 1.1771820498778522
Energy: 1.2709754824620307
Energy: 1.1771820498772116
Energy: 1.2709754824620307
Energy: 1.1771820498778522
Energy: 1.2709754824620307
Energy: 1.2869799190136557
Energy: 1.2128427833901048
Energy: 1.2869799190136557
Energy: 1.2128427833894642
Energy: 1.2869799190136557
Energy: 1.2128427833901048
Energy: 1.2695020709328446
Energy: 1.2101335239275
Energy: 1.2695020709334852
Energy: 1.2101335239275
Energy: 1.2695020709328446
Energy: 1.2101335239275

minimum gb energy = 1.1756867077318285 eV
minimum distance =  2.23999143103899 Angstroms
sigma value = 101


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

Energy: 1.1750891476240415
Energy: 1.2696354484733545
Energy: 1.175089147622352
Energy: 1.2696354484739178
Energy: 1.1750891476240415
Energy: 1.2696354484733545
Energy: 1.2164022354594095
Energy: 1.1944742507599933
Energy: 1.2164022354582833
Energy: 1.1944742507605564
Energy: 1.2164022354588462
Energy: 1.1944742507605564
Energy: 1.2353380656470763
Energy: 1.1372346236053172
Energy: 1.2353380656498918
Energy: 1.1372346236053172
Energy: 1.2353380656487656
Energy: 1.1372346236053172
Energy: 1.1168173622287094
Energy: 1.2171966399635266
Energy: 1.1168173622287094
Energy: 1.2171966399635266
Energy: 1.116817362228146
Energy: 1.2171966399635266
Energy: 1.1843775462921968
Energy: 1.191002650136841
Energy: 1.1843775462921968
Energy: 1.191002650136841
Energy: 1.18437754629276
Energy: 1.191002650136841
Energy: 1.2299852793400474
Energy: 1.1362174385662285
Energy: 1.2299852793394843
Energy: 1.1362174385662285
Energy: 1.2299852793389212
Energy: 1.1362174385662285
Energy: 1.1679044054966232
Energy: 1.2013082116669795
Energy: 1.1679044054977494
Energy: 1.2013082116669795
Energy: 1.1679044054977494
Energy: 1.2013082116664675
Energy: 1.123541486746151
Energy: 1.2008133245660746
Energy: 1.1235414867467142
Energy: 1.2008133245643853
Energy: 1.123541486746151
Energy: 1.2008133245660746
Energy: 1.2386940420554318
Energy: 1.1403965688725175
Energy: 1.2386940420554318
Energy: 1.1403965688725175
Energy: 1.2386940420554318
Energy: 1.1403965688719546
Energy: 1.1844965258230993
Energy: 1.2024057270317439
Energy: 1.184496525822536
Energy: 1.2024057270311805
Energy: 1.1844965258236622
Energy: 1.2024057270311805
Energy: 1.12006494359892
Energy: 1.3645935361656207
Energy: 1.120064943598357
Energy: 1.3645935361650576
Energy: 1.120064943598357
Energy: 1.3645935361656207
Energy: 1.235020546865278
Energy: 1.1943245148812045
Energy: 1.2350205468647149
Energy: 1.1943245148806412
Energy: 1.235020546865278
Energy: 1.1943245148806412
Energy: 1.2315437040165702
Energy: 1.1364369430525558
Energy: 1.2315437040188224
Energy: 1.1364369430531187
Energy: 1.2315437040176964
Energy: 1.1364369430525558
Energy: 1.1811525736082096
Energy: 1.2417964889160997
Energy: 1.181152573608773
Energy: 1.2417964889155366
Energy: 1.181152573608773
Energy: 1.2417964889160997
Energy: 1.2474705697726605
Energy: 1.1872624898704496
Energy: 1.2474705697720974
Energy: 1.1872624898710127
Energy: 1.2474705697720974
Energy: 1.1872624898704496
Energy: 1.2351804706944907
Energy: 1.135527046295693
Energy: 1.2351804706933642
Energy: 1.135527046295693
Energy: 1.2351804706933642
Energy: 1.13552704629513
Energy: 1.1174183968572167
Energy: 1.2501196385410738
Energy: 1.1174183968566536
Energy: 1.2501196385388216
Energy: 1.1174183968572167
Energy: 1.2501196385354427
Energy: 1.1218279249368166
Energy: 1.1899281453444803
Energy: 1.121827924937943
Energy: 1.1899281453439172
Energy: 1.12182792493738
Energy: 1.1899281453439172
Energy: 1.2304596948232744
Energy: 1.140162539050313
Energy: 1.2304596948232744
Energy: 1.140162539050313
Energy: 1.2304596948238373
Energy: 1.1401625390508758
Energy: 1.1437684698055273
Energy: 1.2325121036839404
Energy: 1.1437684698044008
Energy: 1.2325121036839404
Energy: 1.1437684698066535
Energy: 1.2325121036839404
Energy: 1.12038235569643
Energy: 1.3611227918704822
Energy: 1.1203823556958667
Energy: 1.3611227918721713
Energy: 1.1203823556958667
Energy: 1.3611227918710451
Energy: 1.2639841286799862
Energy: 1.1311698132174846
Energy: 1.2639841286799862
Energy: 1.1311698132180477
Energy: 1.2639841286794231
Energy: 1.1311698132174846
Energy: 1.262588673147905
Energy: 1.1304838605969658
Energy: 1.2625886731484681
Energy: 1.1304838605969658
Energy: 1.262588673147905
Energy: 1.1304838605969658
Energy: 1.1166835560593156
Energy: 1.2614580012134584
Energy: 1.1166835560610047
Energy: 1.2614580012123322
Energy: 1.1166835560598785
Energy: 1.2614580012134584
Energy: 1.2676122725171866
Energy: 1.172576651755587
Energy: 1.2676122725171866
Energy: 1.172576651755587
Energy: 1.2676122725171866
Energy: 1.172576651755587
Energy: 1.2353169833297701
Energy: 1.135377055278092
Energy: 1.2353169833303332
Energy: 1.135377055278092
Energy: 1.2353169833314592
Energy: 1.1353770552786553
Energy: 1.1753299190009228
Energy: 1.2427236212468198
Energy: 1.1753299190003599
Energy: 1.2427236212468198
Energy: 1.1753299189997966
Energy: 1.2427236212468198
Energy: 1.175276876614557
Energy: 1.2401645036543618
Energy: 1.175276876614557
Energy: 1.240164503653799
Energy: 1.1752768766156831
Energy: 1.240164503653799
Energy: 1.266975042792564
Energy: 1.1523402628221462
Energy: 1.266975042793127
Energy: 1.1523402628221462
Energy: 1.266975042792564
Energy: 1.1523402628221462
Energy: 1.1209380268846978
Energy: 1.2540605931110944
Energy: 1.1209380268846978
Energy: 1.2540605931105315
Energy: 1.1209380268852607
Energy: 1.2540605931099682
Energy: 1.1173740833304635
Energy: 1.2294121227390853
Energy: 1.1173740833366579
Energy: 1.2294121227396482
Energy: 1.1173740833310266
Energy: 1.2294121227396482
Energy: 1.2634326962681384
Energy: 1.1311080359640047
Energy: 1.2634326962675755
Energy: 1.1311080359634416
Energy: 1.2634326962681384
Energy: 1.1311080359634416
Energy: 1.2685482085211615
Energy: 1.1303216123763267
Energy: 1.2685482085211615
Energy: 1.1303216123763267
Energy: 1.2685482085211615
Energy: 1.1303216123763267

minimum gb energy = 1.1166835560593156 eV
minimum distance =  2.25956652828756 Angstroms
sigma value = 33


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

Energy: 0.020726126175503363
Energy: 0.9196587100765277
Energy: 0.020726126175503363
Energy: 0.9196587100774115
Energy: 0.020726126175503363
Energy: 0.9196587100769957
Energy: 0.022231128161904996
Energy: 0.42789803342386473
Energy: 0.02223112816143712
Energy: 0.42789803342386473
Energy: 0.022231128161904996
Energy: 0.42789803342386473
Energy: 1.31674419498456
Energy: 0.42859900961473113
Energy: 1.3167441949795173
Energy: 0.4285990096142633
Energy: 1.3167441949795173
Energy: 0.42859900961473113
Energy: 0.022231128162372864
Energy: 0.42789803342386473
Energy: 0.022231128162372864
Energy: 0.42789803342386473
Energy: 0.022231128162372864
Energy: 0.42789803342339683

minimum gb energy = 0.020726126175503363 eV
minimum distance =  2.48110823147429 Angstroms
sigma value = 1