Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Ni__MO_110256178378_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5196183800697343
cohesive_energy=4.450347496491574
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.8512349917553e-19, 2.7130137596512197e-19, 3.3901416704786395e-19, 3.97871727874488e-19, 4.49038840857912e-19, 4.92183855434898e-19, 5.282680775858459e-19, 5.58597281267466e-19, 5.8422569870492995e-19, 6.059592247451399e-19, 6.244323213351599e-19, 6.401737067642099e-19, 6.536255817832739e-19, 6.651580491948059e-19, 6.750627051461939e-19, 6.83555843483028e-19, 6.907848644556359e-19, 6.968555117218619e-19, 7.018543028199419e-19, 7.058821748778181e-19, 7.090096236673861e-19, 7.112270361288419e-19, 7.1253601443882e-19, 7.12963795600098e-19, 7.125087774360419e-19, 7.11036377109396e-19, 7.083927856632958e-19, 7.044065701979039e-19, 6.988742542807019e-19, 6.915603179464919e-19, 6.8218277810769e-19, 6.703939624347179e-19, 6.55751670176592e-19, 6.3768232209834e-19, 6.1541206688574e-19, 5.8789468319679e-19, 5.537522991262499e-19, 5.112064986103799e-19, 4.580270517746519e-19, 3.9143898868897797e-19, 3.07951166467872e-19, 2.02934896815708e-19, 6.984400644128879e-20, -1.0111625128968118e-19, -3.2419883971326597e-19, -6.194864020660019e-19]
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: 2.38418579101562e-07 eV

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

Energy: 0.01810591326679306
Energy: 0.15345773424011305
Energy: 0.8119139122476416
Energy: 0.018950413211381367
Energy: 0.15345773424011305
Energy: 0.9900220711130765
Energy: 0.018950413211381367
Energy: 0.9900220711137014
Energy: 0.8119139122463183
Energy: 0.018950413211381367
Energy: 0.01810591326679306
Energy: 0.15345773423882647
Energy: 0.018950413211381367
Energy: 0.9900220711150248
Energy: 0.15345773423948814
Energy: 0.9900220711137014

minimum gb energy = 0.01810591326679306 eV
minimum distance =  2.44201302411922 Angstroms
sigma value = 1


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

Energy: 1.6287820823676036
Energy: 1.1714876077313399
Energy: 1.173149547110245
Energy: 1.0900648493846183
Energy: 1.1080359229711574
Energy: 1.2071717265798807
Energy: 1.1090307686738718
Energy: 1.2071717265814854
Energy: 1.17446125516565
Energy: 1.1719808708714559
Energy: 1.1069700521316561
Energy: 1.1719808708706536
Energy: 1.1121647692259105
Energy: 1.1081636953065606
Energy: 1.1087958619814495
Energy: 1.1081636953081655
Energy: 1.1702297888922868
Energy: 1.1094047921810604
Energy: 1.1127832102224073
Energy: 1.1094047921794554
Energy: 1.1843005473421553
Energy: 1.241995566910729
Energy: 1.1097144698847219
Energy: 1.2419955669099265
Energy: 1.1713342315780924
Energy: 1.203834109850564
Energy: 1.1698325085592236
Energy: 1.2038341098497618
Energy: 1.1741770273132695
Energy: 1.1718020227085952
Energy: 1.2240857526704116
Energy: 1.1718020227102002
Energy: 1.1958810654916923
Energy: 1.2728001914618319
Energy: 1.1976493371823052
Energy: 1.2728001914634368
Energy: 1.222010683034614
Energy: 1.252965616886619
Energy: 1.1991426475530718
Energy: 1.2529656168858165
Energy: 1.1934900006019808
Energy: 1.2719621647678432
Energy: 1.1972382787092337
Energy: 1.2719621647678432
Energy: 1.1723936828225532
Energy: 1.2726668753873978
Energy: 1.2294387584505428
Energy: 1.2726668753865953
Energy: 1.1853738486030887
Energy: 1.2040989446186676
Energy: 1.1286314115770464
Energy: 1.204098944617865
Energy: 1.185332691192351
Energy: 1.2118650614123816
Energy: 1.1795225738822077
Energy: 1.2118650614123816
Energy: 1.1289035607212525
Energy: 1.1078778646829563
Energy: 1.1081925005089137
Energy: 1.107877864682154
Energy: 1.0858000241573305
Energy: 1.108245437220749
Energy: 1.1078244211303028
Energy: 1.1082454372199464
Energy: 1.1707690838607046
Energy: 1.170072420626681
Energy: 1.0838957213955729
Energy: 1.1700724206258786
Energy: 1.108890826644355
Energy: 1.1088177159870705
Energy: 1.130178932845422
Energy: 1.1088177159894779
Energy: 1.1076815083177065
Energy: 1.173846987234331
Energy: 1.1723576143035144
Energy: 1.173846987232726
Energy: 1.1698303557760001
Energy: 1.1086054182108764
Energy: 1.11168900273363
Energy: 1.108605418208469
Energy: 1.109010952319934
Energy: 1.1095222597125625
Energy: 1.1685364463588628
Energy: 1.10952225971176
Energy: 1.1092218993386649
Energy: 1.1083438416189282
Energy: 1.1847740731865724
Energy: 1.1083438416189282
Energy: 1.169032599899023
Energy: 1.2070139697033886
Energy: 1.1695856505433768
Energy: 1.2070139697033886
Energy: 1.2244332710129213
Energy: 1.20624094521419
Energy: 1.173185089577151
Energy: 1.2062409452109804
Energy: 1.1994294058544446
Energy: 1.2756665827597402
Energy: 1.1969257817389831
Energy: 1.2756665827597402
Energy: 1.2010350787898807
Energy: 1.2694549663052086
Energy: 1.224135933581482
Energy: 1.2694549663044061
Energy: 1.197222988149556
Energy: 1.2718144636500306
Energy: 1.1946126534043602
Energy: 1.2718144636508328
Energy: 1.2260689014310417
Energy: 1.2727667581257074
Energy: 1.1724145710878653
Energy: 1.2727667581257074
Energy: 1.129295981474557
Energy: 1.2059998742598501
Energy: 1.1863769685126402
Energy: 1.2059998742574425
Energy: 1.1792422683365194
Energy: 1.2032349189390033
Energy: 1.17369341104549
Energy: 1.2032349189382008
Energy: 1.1073787640361674
Energy: 1.1076288134763954
Energy: 1.128414778498246
Energy: 1.107628813475593
Energy: 1.1079337812207086
Energy: 1.1084211456396078
Energy: 1.0856785197844843
Energy: 1.1084211456380029
Energy: 1.0839562426167217
Energy: 1.1706594170870483
Energy: 1.1701670281793353
Energy: 1.170659417087851

minimum gb energy = 1.0838957213955729 eV
minimum distance =  2.24581308576167 Angstroms
sigma value = 1


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

Energy: 1.8393313114856629
Energy: 1.2285763680108783
Energy: 1.2301926711948228
Energy: 1.135019353181905
Energy: 1.1598033887519321
Energy: 1.2616024954863652
Energy: 1.1598987118092003
Energy: 1.2616024954854503
Energy: 1.2276050803704694
Energy: 1.2294027760953115
Energy: 1.1584483051474646
Energy: 1.2294027760998862
Energy: 1.1658575467473857
Energy: 1.1594123271950825
Energy: 1.1598891542315728
Energy: 1.1594123271950825
Energy: 1.158351438895532
Energy: 1.160816060920603
Energy: 1.1601516511903809
Energy: 1.1608160609260927
Energy: 1.2523184970285495
Energy: 1.303966557071485
Energy: 1.1591265517202713
Energy: 1.30396655706874
Energy: 1.23640779370974
Energy: 1.2735584365250354
Energy: 1.2317901342943671
Energy: 1.273558436526865
Energy: 1.2375422937392788
Energy: 1.278756033855707
Energy: 1.2914764661316864
Energy: 1.278756033857537
Energy: 1.2344854095950646
Energy: 1.3399187808173711
Energy: 1.2528300002433264
Energy: 1.3399187808155415
Energy: 1.294231028161415
Energy: 1.3352223690566924
Energy: 1.2354689285141949
Energy: 1.3352223690539475
Energy: 1.1880309633323316
Energy: 1.273309984288342
Energy: 1.2609985536729649
Energy: 1.273309984290172
Energy: 1.1885537621531799
Energy: 1.2756190157805063
Energy: 1.2534900000956233
Energy: 1.2756190157814211
Energy: 1.1607650204407218
Energy: 1.1600334795073033
Energy: 1.1881562918273025
Energy: 1.1600334795109633
Energy: 1.1592234223251265
Energy: 1.160382389000153
Energy: 1.1287982220870019
Energy: 1.1603823890056428
Energy: 1.1275413268744252
Energy: 1.2264917782538942
Energy: 1.2278344389300164
Energy: 1.2264917782612137
Energy: 1.1900782414165159
Energy: 1.1598142941853085
Energy: 1.1594910069919393
Energy: 1.1598142941843934
Energy: 1.2294830581972245
Energy: 1.2306081629973584
Energy: 1.1578531260658618
Energy: 1.2306081629964434
Energy: 1.165710154225272
Energy: 1.1593327202799129
Energy: 1.1700056118421112
Energy: 1.159332720271678
Energy: 1.1594096973376264
Energy: 1.160708609138019
Energy: 1.161680712508772
Energy: 1.160708609140764
Energy: 1.2521600466851637
Energy: 1.1607301462466213
Energy: 1.162004737852552
Energy: 1.1607301462402166
Energy: 1.2331749272460877
Energy: 1.2788731995208047
Energy: 1.2328108036181329
Energy: 1.2788731995180598
Energy: 1.2347763835576555
Energy: 1.2780183583472604
Energy: 1.2924958712741694
Energy: 1.2780183583472604
Energy: 1.2339125709677092
Energy: 1.3415374873949153
Energy: 1.254021184260023
Energy: 1.341537487400405
Energy: 1.2931328221454372
Energy: 1.339676593581733
Energy: 1.2359947762054593
Energy: 1.3396765935863078
Energy: 1.1885326756089707
Energy: 1.2736108763971308
Energy: 1.2625562935334322
Energy: 1.273610876395301
Energy: 1.1888280508777234
Energy: 1.274741929215122
Energy: 1.2550080516237383
Energy: 1.2747419292132922
Energy: 1.1597349853011585
Energy: 1.1601481788407522
Energy: 1.1871675747441603
Energy: 1.1601481788416672
Energy: 1.1590073290281857
Energy: 1.1600159066510578
Energy: 1.1289502870962174
Energy: 1.1600159066446534
Energy: 1.1274323385416374
Energy: 1.1662366174310663
Energy: 1.2268674347301531
Energy: 1.1662366174255765

minimum gb energy = 1.1274323385416374 eV
minimum distance =  2.20293390517066 Angstroms
sigma value = 25


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

Energy: 1.7618535997254328
Energy: 1.291842414442445
Energy: 1.2916045748169136
Energy: 1.1830368342687596
Energy: 1.2182338172704186
Energy: 1.3181201397419524
Energy: 1.2181316553356165
Energy: 1.3181201397398252
Energy: 1.2903014033602125
Energy: 1.2911381617363529
Energy: 1.215470833326904
Energy: 1.2911381617363529
Energy: 1.226034943862329
Energy: 1.2188844770839573
Energy: 1.217725666410871
Energy: 1.2188844770860845
Energy: 1.2155147828581199
Energy: 1.21836325045501
Energy: 1.2194595873246101
Energy: 1.21836325045501
Energy: 1.2259537312236404
Energy: 1.2180760892328397
Energy: 1.2179172176434196
Energy: 1.2180760892328397
Energy: 1.2994899853454505
Energy: 1.3610886764339047
Energy: 1.2963413440381215
Energy: 1.3610886764349681
Energy: 1.2986988988245893
Energy: 1.3660009124259667
Energy: 1.1985362404483875
Energy: 1.3660009124270305
Energy: 1.299093303716582
Energy: 1.3605982798095455
Energy: 1.2616476428029957
Energy: 1.3605982798095455
Energy: 1.2284475443133456
Energy: 1.3613166164484471
Energy: 1.2173446087167956
Energy: 1.3613166164484471
Energy: 1.1730879520138404
Energy: 1.2181346541297688
Energy: 1.2195429413713055
Energy: 1.2181346541297688
Energy: 1.1736495270217047
Energy: 1.218391466330796
Energy: 1.2180652086970418
Energy: 1.218391466330796
Energy: 1.2906064790387188
Energy: 1.2891167403268469
Energy: 1.172679640770563
Energy: 1.2891167403247197
Energy: 1.2177694037297306
Energy: 1.2276217805518272
Energy: 1.2617363850903403
Energy: 1.2276217805518272
Energy: 1.2160474164026571
Energy: 1.2947317586606168
Energy: 1.2941509516069478
Energy: 1.2947317586595535
Energy: 1.2237780699979062
Energy: 1.2181076388749448
Energy: 1.2270871732021225
Energy: 1.2181076388760086
Energy: 1.2174178213302767
Energy: 1.2270533690873382
Energy: 1.2163145328187828
Energy: 1.2270533690873382
Energy: 1.217728363700389
Energy: 1.2179117051444306
Energy: 1.2256249632594474
Energy: 1.2179117051444306
Energy: 1.2960372422017528
Energy: 1.3650819745580733
Energy: 1.3018373178464075
Energy: 1.3650819745580733
Energy: 1.1972672109310931
Energy: 1.3646707261630913
Energy: 1.2990002827816551
Energy: 1.364670726160964
Energy: 1.258287469007202
Energy: 1.3599841282246683
Energy: 1.2989658525800825
Energy: 1.3599841282257321
Energy: 1.2605714798485634
Energy: 1.3608922274943493
Energy: 1.3354014293946967
Energy: 1.3608922274943493
Energy: 1.2182009160323044
Energy: 1.217835711992485
Energy: 1.173763649100628
Energy: 1.2178357119935488
Energy: 1.2172498939513683
Energy: 1.218018250445829
Energy: 1.1740201089716253
Energy: 1.218018250445829
Energy: 1.172473637497207
Energy: 1.2265031033370137
Energy: 1.289420387540265
Energy: 1.2265031033370137

minimum gb energy = 1.172473637497207 eV
minimum distance =  2.21107597686114 Angstroms
sigma value = 9


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

Energy: 1.6449435311908522
Energy: 1.3588634290332313
Energy: 1.3594133198432714
Energy: 1.231271053812237
Energy: 1.2862587152827185
Energy: 1.3739703867677988
Energy: 1.2861998649206376
Energy: 1.3739703867677988
Energy: 1.3582371133243145
Energy: 1.3565350393813895
Energy: 1.3547405071414906
Energy: 1.356535039380121
Energy: 1.2893583259812476
Energy: 1.3755081990913405
Energy: 1.2869251240050388
Energy: 1.3755081990900717
Energy: 1.2834592444931248
Energy: 1.286470587118676
Energy: 1.2904524999694507
Energy: 1.286470587117407
Energy: 1.2918397860942499
Energy: 1.287350433892226
Energy: 1.2891701153178072
Energy: 1.2873504338795378
Energy: 1.3518061467415927
Energy: 1.4451795921597486
Energy: 1.2901204401190738
Energy: 1.4451795921584796
Energy: 1.2892400757857672
Energy: 1.4530758305009128
Energy: 1.2864982639674922
Energy: 1.4530758305059879
Energy: 1.2857738526978948
Energy: 1.2865003141339841
Energy: 1.2163264384972263
Energy: 1.2865003141314462
Energy: 1.2864411935480287
Energy: 1.2868520441378102
Energy: 1.2162136366913985
Energy: 1.2868520441352724
Energy: 1.214457562599465
Energy: 1.3554678777927454
Energy: 1.3548266798644675
Energy: 1.355467877795283
Energy: 1.3547691269176192
Energy: 1.2945271703945573
Energy: 1.35457274781092
Energy: 1.2945271703958263
Energy: 1.3641122972304762
Energy: 1.3554176085273475
Energy: 1.3546321859623305
Energy: 1.3554176085286163
Energy: 1.356496307864258
Energy: 1.2862241672511106
Energy: 1.3540915509355025
Energy: 1.286224167252379
Energy: 1.2835469999811742
Energy: 1.2942156583187814
Energy: 1.2979895449939267
Energy: 1.2942156583187814
Energy: 1.2930984658886204
Energy: 1.2884261087466349
Energy: 1.2972603753416163
Energy: 1.2884261087466349
Energy: 1.355380374822222
Energy: 1.4479486164319508
Energy: 1.287549824010508
Energy: 1.4479486164319508
Energy: 1.3556816691972051
Energy: 1.4459499172274883
Energy: 1.2871015131869512
Energy: 1.445949917230026
Energy: 1.2842656860279014
Energy: 1.2862941815129791
Energy: 1.215718421442829
Energy: 1.2862941815117104
Energy: 1.2873469511886586
Energy: 1.2872698875110737
Energy: 1.2163130473444774
Energy: 1.287269887508536
Energy: 1.214419828286336
Energy: 1.2895114356350037
Energy: 1.3534423210504127
Energy: 1.2895114356337347

minimum gb energy = 1.214419828286336 eV
minimum distance =  2.24664462029144 Angstroms
sigma value = 25


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

Energy: 1.4768988952138047
Energy: 1.432502561223735
Energy: 1.4324841693587451
Energy: 1.2738812893704163
Energy: 1.4275748755646216
Energy: 1.3756817317935741
Energy: 1.425692035959161
Energy: 1.3756817317935741
Energy: 1.4310120030222457
Energy: 1.428160457037829
Energy: 1.4251109561922202
Energy: 1.428160457037829
Energy: 1.429954869207522
Energy: 1.3761508911971607
Energy: 1.3011518510301574
Energy: 1.3761508911971607
Energy: 1.364563527602054
Energy: 1.37542033803704
Energy: 1.3001824375832485
Energy: 1.3754203380354713
Energy: 1.2631811907953923
Energy: 1.3733934742611524
Energy: 1.2984763459747586
Energy: 1.3733934742611524
Energy: 1.2557763554192614
Energy: 1.3776022883711734
Energy: 1.3026893163621365
Energy: 1.3776022883711734
Energy: 1.2563515663651796
Energy: 1.3768270364265898
Energy: 1.3011982401373556
Energy: 1.3768270364265898
Energy: 1.4258748435414388
Energy: 1.4265824863925138
Energy: 1.585533848521685
Energy: 1.4265824863925138
Energy: 1.4259433618628035
Energy: 1.2659520604440142
Energy: 1.4248883587844323
Energy: 1.2659520604424452
Energy: 1.4285536778782368
Energy: 1.4266769293171153
Energy: 1.4384165442650665
Energy: 1.4266769293155463
Energy: 1.42662954359429
Energy: 1.3778793974760235
Energy: 1.4269351510171229
Energy: 1.3778793974760235
Energy: 1.2998714176734967
Energy: 1.3021337389037932
Energy: 1.3645071067002554
Energy: 1.3021337389022245
Energy: 1.3008460815108775
Energy: 1.377114786837556
Energy: 1.265240558055072
Energy: 1.377114786837556
Energy: 1.369095119235313
Energy: 1.3750110939233644
Energy: 1.2560004557822355
Energy: 1.3750110939233644
Energy: 1.299963850900265
Energy: 1.450233589829327
Energy: 1.2560735041006863
Energy: 1.4502335898308603
Energy: 1.5866524555199806
Energy: 1.2639984978868233
Energy: 1.4238248892374075
Energy: 1.2639984978868233

minimum gb energy = 1.2557763554192614 eV
minimum distance =  2.27536431655266 Angstroms
sigma value = 17


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

Energy: 1.995042224370252
Energy: 1.5645288018880918
Energy: 1.5645558373346218
Energy: 1.4662670121804897
Energy: 1.3558429784478088
Energy: 1.3922808411695717
Energy: 1.482886257071749
Energy: 1.3922808411686833
Energy: 1.3742937913766835
Energy: 1.3736944281187173
Energy: 1.558781713877224
Energy: 1.3736944281213836
Energy: 1.3740498623859516
Energy: 1.374378833025757
Energy: 1.3899787088717583
Energy: 1.3743788330239797
Energy: 1.372406345070461
Energy: 1.4919588158754855
Energy: 1.2935556023933388
Energy: 1.4919588158745967
Energy: 1.3731737563582609
Energy: 1.450049954323871
Energy: 1.3728993137921537
Energy: 1.4500499543159135
Energy: 1.4460506188108044
Energy: 1.3714680709221985
Energy: 1.3756962113792504
Energy: 1.3714680709284193
Energy: 1.6655971243503946
Energy: 1.39019961182078
Energy: 1.372929178928516
Energy: 1.3901996118198914
Energy: 1.5731160824368375
Energy: 1.5592917323065296
Energy: 1.5583413132647346
Energy: 1.5592917323074182
Energy: 1.5568044067963687
Energy: 1.4852715354606507
Energy: 1.481654667821984
Energy: 1.4852715354615393
Energy: 1.370134068683549
Energy: 1.3236466306659578
Energy: 1.3217544671065176
Energy: 1.3236466306659578
Energy: 1.5796678964911202
Energy: 1.3581659079147321
Energy: 1.3273855545703503
Energy: 1.3581659079120663
Energy: 1.4463543822874643
Energy: 1.3572690572537454
Energy: 1.3554693113555438
Energy: 1.3572690572528567
Energy: 1.4465569080411755
Energy: 1.3572816266424108
Energy: 1.3232610630811958
Energy: 1.3572816266424108
Energy: 1.5576996267609953
Energy: 1.576642978929443
Energy: 1.6647904904930564
Energy: 1.576642978929443
Energy: 1.5790989603162384
Energy: 1.5567798258023766
Energy: 1.665367024655356
Energy: 1.5567798258032652
Energy: 1.559403259950364
Energy: 1.372136537219944
Energy: 1.3728203448176108
Energy: 1.372136537219944
Energy: 1.5589207022869316
Energy: 1.3723594311669105
Energy: 1.3694388200797025
Energy: 1.372359431165133
Energy: 1.3723155789304906
Energy: 1.4925858689136449
Energy: 1.3728641300906694
Energy: 1.4925858689118674
Energy: 1.4138708101566413
Energy: 1.4915647457967152
Energy: 1.372537832608921
Energy: 1.4915647457967152
Energy: 1.3729964223352131
Energy: 1.373401014657096
Energy: 1.5971212512664363
Energy: 1.373401014657096
Energy: 1.3738619650179678
Energy: 1.3751005973688248
Energy: 1.4470636397312522
Energy: 1.375100597367936
Energy: 1.4817807047597495
Energy: 1.485499732109813
Energy: 1.5736893518185688
Energy: 1.4854997321107017
Energy: 1.5578445121679925
Energy: 1.559582833761862
Energy: 1.5594300727826809
Energy: 1.5595828337636393
Energy: 1.352325515772307
Energy: 1.3576344934175408
Energy: 1.5622250863496772
Energy: 1.3576344934175408
Energy: 1.3271391782022608
Energy: 1.357877257619058
Energy: 1.3707331080009324
Energy: 1.357877257619947
Energy: 1.3215661792174493
Energy: 1.326232250792545
Energy: 1.447523618360941
Energy: 1.326232250792545
Energy: 1.325174369542604
Energy: 1.357618894490087
Energy: 1.4475578226029233
Energy: 1.357618894490976
Energy: 1.3552646737580814
Energy: 1.3557949918267065
Energy: 1.4461953408079713
Energy: 1.355794991824929
Energy: 1.6642428978037125
Energy: 1.5597601894306339
Energy: 1.56163553494242
Energy: 1.5597601894315227

minimum gb energy = 1.2935556023933388 eV
minimum distance =  2.23073348743796 Angstroms
sigma value = 53


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

Energy: 1.8228070875149565
Energy: 1.4657206957941598
Energy: 1.4674739528937453
Energy: 1.2550190799025704
Energy: 1.446939537301179
Energy: 1.3337240758518516
Energy: 1.4487790889843113
Energy: 1.3337240758559432
Energy: 1.4505197323088008
Energy: 1.451041334457774
Energy: 1.4629108578244285
Energy: 1.45104133445982
Energy: 1.4526204721156597
Energy: 1.3354850471384232
Energy: 1.44540404491451
Energy: 1.3354850471425148
Energy: 1.4699903316092522
Energy: 1.3342147229933137
Energy: 1.2314717369653683
Energy: 1.3342147229933137
Energy: 1.4459163165059044
Energy: 1.3375314323241085
Energy: 1.232439039347502
Energy: 1.3375314323261545
Energy: 1.6500675692948132
Energy: 1.4477205994837388
Energy: 1.4482962617474275
Energy: 1.4477205994837388
Energy: 1.6472705089190525
Energy: 1.4485522702345905
Energy: 1.4446115347783248
Energy: 1.4485522702366365
Energy: 1.454428576688062
Energy: 1.448993140327309
Energy: 1.4647462706110048
Energy: 1.448993140327309
Energy: 1.4444901034769035
Energy: 1.3361246972775442
Energy: 1.452731757440112
Energy: 1.3361246972734524
Energy: 1.4701465438931964
Energy: 1.339226889759249
Energy: 1.255872010337381
Energy: 1.339226889759249
Energy: 1.4515316852318065
Energy: 1.3336293631994374
Energy: 1.2326077461839136
Energy: 1.3336293631994374
Energy: 1.6474562460154292
Energy: 1.4461870059741646
Energy: 1.4431747948467997
Energy: 1.4461870059803024

minimum gb energy = 1.2314717369653683 eV
minimum distance =  2.25989428938427 Angstroms
sigma value = 9


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

Energy: 1.778449751350389
Energy: 1.6333596537812625
Energy: 1.6364398579231587
Energy: 1.5087812047055131
Energy: 1.3473261212508705
Energy: 1.345252526709789
Energy: 1.6206946267399678
Energy: 1.3452525267105464
Energy: 1.3483516429560087
Energy: 1.3499995817616761
Energy: 1.6553927604085659
Energy: 1.3499995817624328
Energy: 1.3498074390022725
Energy: 1.3474055436309584
Energy: 1.712463113606093
Energy: 1.3474055436324728
Energy: 1.3480668057118097
Energy: 1.3451264413555228
Energy: 1.7016869516272837
Energy: 1.345126441353251
Energy: 1.344877142580328
Energy: 1.3455756396091156
Energy: 1.7012997905761447
Energy: 1.3455756396098733
Energy: 1.622613099176152
Energy: 1.5985446788888766
Energy: 1.618150599333521
Energy: 1.5985446788911484
Energy: 1.6240285238983254
Energy: 1.598717509755379
Energy: 1.598747411686705
Energy: 1.598717509756136
Energy: 1.4204934460677232
Energy: 1.5258135369337564
Energy: 1.44051822227304
Energy: 1.5258135369307277
Energy: 1.340013726954324
Energy: 1.44578171604901
Energy: 1.5995041794404692
Energy: 1.44578171604901
Energy: 1.417833779220473
Energy: 1.4189686728698956
Energy: 1.4896553468209306
Energy: 1.4189686728698956
Energy: 1.4314663662908722
Energy: 1.421689025646481
Energy: 1.7008907416152579
Energy: 1.4216890256457237
Energy: 1.6262508273118748
Energy: 1.4188023887706616
Energy: 1.4353176481064047
Energy: 1.4188023887699044
Energy: 1.6246433393460866
Energy: 1.4196976010614144
Energy: 1.4243744808220784
Energy: 1.4196976010606572
Energy: 1.5992520339345988
Energy: 1.4459705946280552
Energy: 1.4312580745312966
Energy: 1.4459705946280552
Energy: 1.539305762237033
Energy: 1.5151513269957377
Energy: 1.4302120639864409
Energy: 1.515151326996495
Energy: 1.5998030486119081
Energy: 1.5004576762939397
Energy: 1.4227611111438574
Energy: 1.5004576762916684
Energy: 1.5978607731413241
Energy: 1.5996991596814607
Energy: 1.7769011969226307
Energy: 1.599699159678432
Energy: 1.6203632952323561
Energy: 1.3461420766281302
Energy: 1.3415439653489662
Energy: 1.3461420766296446
Energy: 1.659459464261605
Energy: 1.3519645196537653
Energy: 1.3610349329056448
Energy: 1.3519645196507362
Energy: 1.7150312598720998
Energy: 1.3473125519849405
Energy: 1.3459724734708016
Energy: 1.3473125519849405
Energy: 1.7012932566266006
Energy: 1.3446706152201768
Energy: 1.3454819720560045
Energy: 1.3446706152224486
Energy: 1.701982700585893
Energy: 1.3460947579420304
Energy: 1.344997536270881
Energy: 1.3460947579435447
Energy: 1.6210867421358088
Energy: 1.5980712000835537
Energy: 1.6222344853067248
Energy: 1.598071200084311
Energy: 1.6005991807803601
Energy: 1.5990381194225198
Energy: 1.623226217891657
Energy: 1.599038119423277
Energy: 1.441299056329986
Energy: 1.6091734901901464
Energy: 1.420881940437833
Energy: 1.6091734901916608
Energy: 1.6015089546787193
Energy: 1.445873347882886
Energy: 1.3390727820340271
Energy: 1.4458733478836434
Energy: 1.4891197677027925
Energy: 1.420084029840476
Energy: 1.419232063752941
Energy: 1.4200840298419906
Energy: 1.7003101784036876
Energy: 1.4251056354151375
Energy: 1.4310228481683385
Energy: 1.4251056354151375
Energy: 1.435381756571961
Energy: 1.4191050712335507
Energy: 1.6281512079529328
Energy: 1.419105071232036
Energy: 1.4275856077805926
Energy: 1.420868012646261
Energy: 1.5986837701374799
Energy: 1.4208680126455042
Energy: 1.4222714001910195
Energy: 1.4398280844622127
Energy: 1.5997119185505364
Energy: 1.439828084460698
Energy: 1.4309137560391754
Energy: 1.5255480082688677
Energy: 1.5369913699447295
Energy: 1.5255480082711395
Energy: 1.4205348476177146
Energy: 1.5150302028246194
Energy: 1.4912055084927178
Energy: 1.5150302028223477
Energy: 1.703508555626566
Energy: 1.5987565640781574
Energy: 1.5976618987201179
Energy: 1.5987565640781574

minimum gb energy = 1.3390727820340271 eV
minimum distance =  2.22833735159274 Angstroms
sigma value = 73


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

Energy: 1.8987586248769392
Energy: 1.58594627180449
Energy: 1.586725138694179
Energy: 1.4266959971246427
Energy: 1.3785399065055512
Energy: 1.3763629882724866
Energy: 1.528403758426473
Energy: 1.3763629882736883
Energy: 1.3811051775889294
Energy: 1.3810056654093956
Energy: 1.6069116827461856
Energy: 1.381005665408249
Energy: 1.378361659288496
Energy: 1.3778095308883707
Energy: 1.6870829037365804
Energy: 1.377809530889572
Energy: 1.3798454719715596
Energy: 1.3792492933897273
Energy: 1.6992092680488387
Energy: 1.3792492933885259
Energy: 1.4708356055550622
Energy: 1.3780380795780103
Energy: 1.6111974166160932
Energy: 1.3780380795792115
Energy: 1.5090609208293555
Energy: 1.572283860465195
Energy: 1.5990754430210898
Energy: 1.572283860465195
Energy: 1.4481666128548498
Energy: 1.5733000813424622
Energy: 1.5754757290463413
Energy: 1.573300081344865
Energy: 1.4361535197497706
Energy: 1.5444715940519598
Energy: 1.5784947907088818
Energy: 1.5444715940507585
Energy: 1.4339594129363733
Energy: 1.4053458358396111
Energy: 1.5730022589833683
Energy: 1.4053458358408124
Energy: 1.4535768685343635
Energy: 1.3536656168019165
Energy: 1.3472033560164907
Energy: 1.3536656168031178
Energy: 1.4273283757493087
Energy: 1.353367100281641
Energy: 1.6542587117476564
Energy: 1.3533671002851906
Energy: 1.5789687108591608
Energy: 1.4691048097087078
Energy: 1.4160743029110636
Energy: 1.4691048097099093
Energy: 1.5811237404444638
Energy: 1.4406168421340046
Energy: 1.4333455583120687
Energy: 1.440616842135206
Energy: 1.6053917921734746
Energy: 1.4155972130091237
Energy: 1.4206362908576937
Energy: 1.4155972130091237
Energy: 1.6631413890752662
Energy: 1.418590597591528
Energy: 1.4184470330447407
Energy: 1.418590597591528
Energy: 1.6074088013026184
Energy: 1.4170448494876622
Energy: 1.4346493540396696
Energy: 1.417044849490065
Energy: 1.5301368692421582
Energy: 1.5311751468726396
Energy: 1.5098564617477221
Energy: 1.531175146873841
Energy: 1.5367826578602262
Energy: 1.4878003603352152
Energy: 1.4483624011214453
Energy: 1.4878003603364167
Energy: 1.5447312196993088
Energy: 1.487423948757421
Energy: 1.531169425783952
Energy: 1.4874239487598238
Energy: 1.5351853397997934
Energy: 1.4849595570804597
Energy: 1.4363731118524479
Energy: 1.4849595570804597
Energy: 1.6053156762369192
Energy: 1.528654871563857
Energy: 1.5304465421971678
Energy: 1.528654871563857

minimum gb energy = 1.3472033560164907 eV
minimum distance =  2.21716862397215 Angstroms
sigma value = 7


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

Energy: 2.2150077770325125
Energy: 1.5157881716095
Energy: 1.5839434056489488
Energy: 1.3867491006982617
Energy: 1.3929306033805342
Energy: 1.3800363078773594
Energy: 1.521309306712253
Energy: 1.3800363078807576
Energy: 1.3971772716472344
Energy: 1.3882461407538766
Energy: 1.5069827426917872
Energy: 1.3882461407505555
Energy: 1.3783843986954953
Energy: 1.3775855747054802
Energy: 1.6715525627327983
Energy: 1.3775855747063295
Energy: 1.3897927933309306
Energy: 1.3871111224293808
Energy: 1.6230287135573995
Energy: 1.3871111224302304
Energy: 1.3749217199544457
Energy: 1.3870762523364377
Energy: 1.6216841459659126
Energy: 1.3870762523296414
Energy: 1.6186426507172615
Energy: 1.39093746843452
Energy: 1.3759683519166739
Energy: 1.3909374684260247
Energy: 1.5146873432704666
Energy: 1.3872038983611406
Energy: 1.3865425862528675
Energy: 1.3872038983628396
Energy: 1.6203488182422767
Energy: 1.3759854030340914
Energy: 1.3748897282138264
Energy: 1.3759854030357903
Energy: 1.6326618823662438
Energy: 1.3914631016921468
Energy: 1.3868665603079606
Energy: 1.3914631016912973
Energy: 1.5201764026410594
Energy: 1.5230686601760073
Energy: 1.3728904523549679
Energy: 1.5230686601760073
Energy: 1.5213391734427524
Energy: 1.5215395961366596
Energy: 1.6178376187149628
Energy: 1.5215395961341112
Energy: 1.5209540584881531
Energy: 1.4775619552174404
Energy: 1.5206630827344991
Energy: 1.4775619552216879
Energy: 1.509651561642885
Energy: 1.4692154103023831
Energy: 1.3937047248682957
Energy: 1.4692154102989854
Energy: 1.527377670248451
Energy: 1.4752748166371437
Energy: 1.4118922033103427
Energy: 1.4752748166362941
Energy: 1.6112664412212176
Energy: 1.5222216618627733
Energy: 1.5227839648685417
Energy: 1.5222216618602247
Energy: 1.4094496907292018
Energy: 1.5214058260684709
Energy: 1.514694571286889
Energy: 1.521405826065922
Energy: 1.3869207106348584
Energy: 1.3875711372257349
Energy: 1.5063193471460699
Energy: 1.3875711372274337
Energy: 1.3710564971069656
Energy: 1.3765405343759054
Energy: 1.5177400038285687
Energy: 1.376540534371658
Energy: 1.3863274854438548
Energy: 1.3869630726078308
Energy: 1.5042135648150596
Energy: 1.3869630726120783
Energy: 1.3763110319075416
Energy: 1.3908831648499642
Energy: 1.6256554779868082
Energy: 1.3908831648516633
Energy: 1.5132731560428003
Energy: 1.387437302771947
Energy: 1.3749262885714373
Energy: 1.3874373027727966
Energy: 1.6151163169076714
Energy: 1.3877492107630962
Energy: 1.3897266569106623
Energy: 1.3877492107664942
Energy: 1.6655902468511696
Energy: 1.3780937550644314
Energy: 1.3774997974207763
Energy: 1.3780937550593342
Energy: 1.6320146333430043
Energy: 1.3876506062185145
Energy: 1.397301396157598
Energy: 1.3876506062100968
Energy: 1.62838493347152
Energy: 1.377473103916218
Energy: 1.3925776805112948
Energy: 1.377473103926412
Energy: 1.5188715613492623
Energy: 1.5213811167299698
Energy: 1.9200411163283697
Energy: 1.5213811167350668
Energy: 1.5195408215423603
Energy: 1.4789391355254227
Energy: 1.5221056932432304
Energy: 1.4789391355237234
Energy: 1.5112541036680418
Energy: 1.4724128105387042
Energy: 1.523303100749232
Energy: 1.4724128105378544
Energy: 1.5237610489821334
Energy: 1.471405685577212
Energy: 1.3942751110824207
Energy: 1.4714056855746633
Energy: 1.6022072782954266
Energy: 1.519686669274489
Energy: 1.5198534486140076
Energy: 1.5196866692710909

minimum gb energy = 1.3710564971069656 eV
minimum distance =  2.1997921148552 Angstroms
sigma value = 29


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

Energy: 1.2936534903954389
Energy: 1.575132624108596
Energy: 1.3446125980949915
Energy: 1.2954320786550164
Energy: 1.3392361657522827
Energy: 1.4560988796800534
Energy: 1.3414166221125976
Energy: 1.4560988796803493
Energy: 1.3348979092417916
Energy: 1.4141708319721022
Energy: 1.3022658939813165
Energy: 1.4141708319723982
Energy: 1.3019978125252656
Energy: 1.3261247744650204
Energy: 1.3427383357347888
Energy: 1.3261247744647244
Energy: 1.3363779082196454
Energy: 1.3359004064421267
Energy: 1.2995862452346192
Energy: 1.3359004064424227
Energy: 1.3420397183684185
Energy: 1.4351316523120947
Energy: 1.3007669645239477
Energy: 1.4351316523112398
Energy: 1.300518541571288
Energy: 1.4152368519742387
Energy: 1.335465132211698
Energy: 1.4152368519736798
Energy: 1.3383210517052533
Energy: 1.3406889086805276
Energy: 1.3021833059095727
Energy: 1.3406889086808236
Energy: 1.3012663044183577
Energy: 1.3342660565557958
Energy: 1.3419769679056275
Energy: 1.334266056554349

minimum gb energy = 1.2936534903954389 eV
minimum distance =  2.23790776726803 Angstroms
sigma value = 5


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

Energy: 1.7744644196284876
Energy: 1.300135919429123
Energy: 1.507941627856513
Energy: 1.2673709574689487
Energy: 1.4771614563267554
Energy: 1.3028087372419617
Energy: 1.5252856201881775
Energy: 1.3028087372411594
Energy: 1.5252204697071066
Energy: 1.4101611425877885
Energy: 1.52659120487399
Energy: 1.4101611425877885
Energy: 1.325292691009387
Energy: 1.29513969474333
Energy: 1.4792797871957637
Energy: 1.2951396947425273
Energy: 1.4782578383406824
Energy: 1.2964466366452128
Energy: 1.52216255687808
Energy: 1.2964466366460148
Energy: 1.2975071907135483
Energy: 1.2983178400557938
Energy: 1.5212243013629376
Energy: 1.2983178400557938
Energy: 1.2968712265402194
Energy: 1.2956111352073891
Energy: 1.4809535610160116
Energy: 1.295611135208994
Energy: 1.2992285498901028
Energy: 1.302872522438538
Energy: 1.7015026481059363
Energy: 1.302872522440945
Energy: 1.3266131321736732
Energy: 1.3513022164126358
Energy: 1.7060727042848154
Energy: 1.351302216414241
Energy: 1.546287830189186
Energy: 1.2732194691940137
Energy: 1.283831638328635
Energy: 1.2732194691948162
Energy: 1.3258982129407284
Energy: 1.270729208358081
Energy: 1.2753049413435091
Energy: 1.2707292083604884
Energy: 1.7118819802089982
Energy: 1.2688577702335082
Energy: 1.2702547620452451
Energy: 1.268857770234311
Energy: 1.6987394686726203
Energy: 1.2700475448084705
Energy: 1.2984878827380415
Energy: 1.2700475448084705
Energy: 1.325574942555576
Energy: 1.3472410214477175
Energy: 1.5222282655136947
Energy: 1.3472410214493225
Energy: 1.2964472912392502
Energy: 1.2971020597011913
Energy: 1.5204036738898934
Energy: 1.2971020597019935
Energy: 1.304510634766923
Energy: 1.3005232898699846
Energy: 1.4768948051582897
Energy: 1.3005232898715893
Energy: 1.2974102519540767
Energy: 1.2970851100276595
Energy: 1.3199841509267598
Energy: 1.2970851100308693
Energy: 1.551611618239981
Energy: 1.3026045927754966
Energy: 1.3219807608001488
Energy: 1.3026045927771017
Energy: 1.529516728673352
Energy: 1.4130591662364549
Energy: 1.497514181667039
Energy: 1.4130591662364549
Energy: 1.4828774320628664
Energy: 1.2949481761023278
Energy: 1.3207696929917516
Energy: 1.2949481761095498
Energy: 1.5203241675737265
Energy: 1.3047854609461178
Energy: 1.481743430697669
Energy: 1.30478546094692
Energy: 1.5219626682199523
Energy: 1.2960411607700502
Energy: 1.2953711667160333
Energy: 1.2960411607700502
Energy: 1.478532850070167
Energy: 1.2962055854155456
Energy: 1.2990430365674914
Energy: 1.2962055854155456
Energy: 1.702437478352652
Energy: 1.3010715180354748
Energy: 1.3057768069254003
Energy: 1.3010715180338697
Energy: 1.7102208756577955
Energy: 1.3483920076606228
Energy: 1.3283884389427305
Energy: 1.3483920076622276
Energy: 1.2698097282661391
Energy: 1.275031585120796
Energy: 1.5461253612093038
Energy: 1.2750315851240062
Energy: 1.281662850054421
Energy: 1.27344526776284
Energy: 1.3266846850091063
Energy: 1.2734452677612353
Energy: 1.2720561216110486
Energy: 1.2747761089002918
Energy: 1.3913061075183328
Energy: 1.2747761088994893
Energy: 1.268232578474552
Energy: 1.2714490487481158
Energy: 1.6972271156809333
Energy: 1.2714490487489185
Energy: 1.5208014000509418
Energy: 1.346296829304496
Energy: 1.3269735104428455
Energy: 1.346296829304496
Energy: 1.5215044346497897
Energy: 1.2987105598091797
Energy: 1.300455621163221
Energy: 1.2987105598091797
Energy: 1.4765916532159187
Energy: 1.2985284374262533
Energy: 1.2995023147890583
Energy: 1.2985284374278583
Energy: 1.3225351803487004
Energy: 1.295933815516141
Energy: 1.2960641498596053
Energy: 1.295933815516141

minimum gb energy = 1.2673709574689487 eV
minimum distance =  2.20831779947316 Angstroms
sigma value = 1


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

Energy: 1.8938366477966198
Energy: 1.2414066562638204
Energy: 1.4645437800831098
Energy: 1.2068067576303916
Energy: 1.2481373395675455
Energy: 1.2458390407331763
Energy: 1.5150602247210996
Energy: 1.2458390407298476
Energy: 1.5166373895796597
Energy: 1.383590398548734
Energy: 1.517198046985775
Energy: 1.3835903985520621
Energy: 1.2685177451632306
Energy: 1.3847605333976782
Energy: 1.4951719353002793
Energy: 1.3847605333965691
Energy: 1.2404175386861167
Energy: 1.239244566962183
Energy: 1.5074860787486737
Energy: 1.239244566959964
Energy: 1.2394377610746594
Energy: 1.2412626712746118
Energy: 1.5077323053451515
Energy: 1.2412626712757215
Energy: 1.236728484858301
Energy: 1.2388854535625022
Energy: 1.4961177627088293
Energy: 1.2388854535658307
Energy: 1.2534894834637953
Energy: 1.250001905458062
Energy: 1.71311596088122
Energy: 1.2500019054591711
Energy: 1.4978387518410226
Energy: 1.3192660609566187
Energy: 1.7119854995164556
Energy: 1.3192660609588378
Energy: 1.5114411489329846
Energy: 1.2514706623531018
Energy: 1.2538945064597742
Energy: 1.251470662350883
Energy: 1.4986214289347775
Energy: 1.2381492568370553
Energy: 1.2369462479031414
Energy: 1.2381492568359458
Energy: 1.7064167868784383
Energy: 1.2571455888360412
Energy: 1.2401972823762653
Energy: 1.2571455888382606
Energy: 1.705849674829851
Energy: 1.2397421315109016
Energy: 1.2389872798043313
Energy: 1.2397421315142299
Energy: 1.4933326052653413
Energy: 1.383160246789216
Energy: 1.5157101217885014
Energy: 1.3831602467925446
Energy: 1.2710183345315063
Energy: 1.3830192784850748
Energy: 1.514849926044529
Energy: 1.3830192784839652
Energy: 1.2648434902100563
Energy: 1.2426727762435434
Energy: 1.4965098912489878
Energy: 1.242672776244653
Energy: 1.2403257328143238
Energy: 1.2409879433855426
Energy: 1.5096446639515235
Energy: 1.2409879433888713
Energy: 1.2540100586557528
Energy: 1.2497048636536228
Energy: 1.4883296136568271
Energy: 1.2497048636547323
Energy: 1.236858438130852
Energy: 1.2392383870067356
Energy: 1.7123092595944431
Energy: 1.239238387005626
Energy: 1.2441486597981237
Energy: 1.251944769898603
Energy: 1.712780186141512
Energy: 1.2519447698997124
Energy: 1.5081414269666575
Energy: 1.3142190130751823
Energy: 1.4967693013150127
Energy: 1.3142190130685252
Energy: 1.5096714497340158
Energy: 1.2424243019420504
Energy: 1.2460544994870908
Energy: 1.2424243019398313
Energy: 1.496462480546107
Energy: 1.2385732699987306
Energy: 1.2404967274175671
Energy: 1.2385732699998404
Energy: 1.7058977272750018
Energy: 1.2398165194391397
Energy: 1.238582108806862
Energy: 1.2398165194446873

minimum gb energy = 1.2068067576303916 eV
minimum distance =  2.21522978598906 Angstroms
sigma value = 17


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

Energy: 2.0214253143603784
Energy: 1.2311602895156937
Energy: 1.4659569379524182
Energy: 1.2041703999996916
Energy: 1.2395916789240324
Energy: 1.2292003603837884
Energy: 1.400246586221846
Energy: 1.2292003603803594
Energy: 1.5577920142632111
Energy: 1.2237516617337734
Energy: 1.4275078062985673
Energy: 1.2237516617310304
Energy: 1.6062301786719424
Energy: 1.3023649548763099
Energy: 1.385598667632421
Energy: 1.3023649548776817
Energy: 1.3680226843599637
Energy: 1.2056086904995436
Energy: 1.606900495537708
Energy: 1.2056086904982342
Energy: 1.2071073246235429
Energy: 1.20524966812157
Energy: 1.5558187551249687
Energy: 1.2052496681208844
Energy: 1.2068243902460298
Energy: 1.2044524073450726
Energy: 1.2463982568124299
Energy: 1.204452407346444
Energy: 1.2181880103539457
Energy: 1.2078252747634104
Energy: 1.581885880664248
Energy: 1.2078252747647817
Energy: 1.5696999601655066
Energy: 1.2085868587402042
Energy: 1.5329432784399475
Energy: 1.20858685874089
Energy: 1.431160045320336
Energy: 1.3038724656392464
Energy: 1.4023844568991557
Energy: 1.3038724656413037
Energy: 1.5630748046628011
Energy: 1.224757770744813
Energy: 1.240259324691888
Energy: 1.224757770744127
Energy: 1.5544227597312639
Energy: 1.2352943664732496
Energy: 1.3886675682338676
Energy: 1.2352943664732496
Energy: 1.5578014147059518
Energy: 1.2248720798823785
Energy: 1.2258470243532171
Energy: 1.224872079886493
Energy: 1.2266415287328012
Energy: 1.2243308884048432
Energy: 1.2279603048618888
Energy: 1.2243308884062145
Energy: 1.5981445969472527
Energy: 1.2285121380997963
Energy: 1.239754358459676
Energy: 1.2285121380984247
Energy: 1.5835987047073248
Energy: 1.2255337801702435
Energy: 1.229698324277848
Energy: 1.2255337801716153
Energy: 1.225262505040719
Energy: 1.2311466307757377
Energy: 1.5975645435868098
Energy: 1.231146630790077
Energy: 1.224708588884408
Energy: 1.2243924065335774
Energy: 1.5707310898482438
Energy: 1.2243924065335774
Energy: 1.2305766589931488
Energy: 1.229469069204979
Energy: 1.5267181413876256
Energy: 1.2294690692070365
Energy: 1.2273543583587982
Energy: 1.2241155959495813
Energy: 1.5823220641148596
Energy: 1.2241155959495813
Energy: 1.4316037144247162
Energy: 1.227704609262286
Energy: 1.2269685711764544
Energy: 1.2277046092636577
Energy: 1.4282277172569875
Energy: 1.2287647101015626
Energy: 1.5976139283743145
Energy: 1.228764710099505
Energy: 1.3861440955690947
Energy: 1.2984245193404411
Energy: 1.6009201724534654
Energy: 1.2984245193370743
Energy: 1.6085518529079363
Energy: 1.2077314615176622
Energy: 1.3673076377033768
Energy: 1.2077314615190338
Energy: 1.5551779297928652
Energy: 1.2045324612078567
Energy: 1.205068478008281
Energy: 1.2045324612112855
Energy: 1.3893746291507585
Energy: 1.206262818999849
Energy: 1.212957961004868
Energy: 1.206262819002592
Energy: 1.582071241333855
Energy: 1.210769844087862
Energy: 1.2205115471565051
Energy: 1.2107698440851187
Energy: 1.3898828183350385
Energy: 1.2095103777158904
Energy: 1.5755535326171208
Energy: 1.209510377713833
Energy: 1.3994260328201749
Energy: 1.3053466889478464
Energy: 1.4258811134746048
Energy: 1.3053466889457892
Energy: 1.2422153261159936
Energy: 1.2241271816907027
Energy: 1.5599007525213786
Energy: 1.2241271816872734
Energy: 1.3870663942069967
Energy: 1.2257839748636659
Energy: 1.5556825547144106
Energy: 1.2257839748622945
Energy: 1.2247788773258461
Energy: 1.2262314047512144
Energy: 1.556990625314281
Energy: 1.226231404746414
Energy: 1.224369615355927
Energy: 1.2234698252486822
Energy: 1.4190838008780469
Energy: 1.223469825247311
Energy: 1.237776709330671
Energy: 1.2289452059834263
Energy: 1.6032195348097213
Energy: 1.2289452059834263
Energy: 1.4242321765689236
Energy: 1.2739739832489063
Energy: 1.5834974610063974
Energy: 1.2739739832495922
Energy: 1.8239298211272148
Energy: 1.233449845228875
Energy: 1.2284102599735731
Energy: 1.2334498452268177
Energy: 1.5651006494142605
Energy: 1.2244009936878704
Energy: 1.2263141222722627
Energy: 1.2244009936858131
Energy: 1.5317578572481962
Energy: 1.2346263515300335
Energy: 1.2257232720112834
Energy: 1.2346263515314049

minimum gb energy = 1.2041703999996916 eV
minimum distance =  2.21413016667762 Angstroms
sigma value = 89


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

Energy: 2.148772289444332
Energy: 1.1265293063956923
Energy: 1.1274703208879464
Energy: 1.1713194812667145
Energy: 1.1288263060797965
Energy: 1.2458957316390706
Energy: 1.1262053071886429
Energy: 1.2458957316372763
Energy: 1.112162159514282
Energy: 1.247448693289957
Energy: 1.1573795620337999
Energy: 1.247448693289957
Energy: 1.1155849770693405
Energy: 1.2483781676708832
Energy: 1.1239655111884426
Energy: 1.2483781676708832
Energy: 1.12345676814922
Energy: 1.1248314269831736
Energy: 1.1458643657497032
Energy: 1.1248314269831736
Energy: 1.123491774556533
Energy: 1.1230260020633185
Energy: 1.1457545304373655
Energy: 1.1230260020615241
Energy: 1.123033369247873
Energy: 1.121008926202571
Energy: 1.1254303087815956
Energy: 1.1210089262043654
Energy: 1.124797926158233
Energy: 1.1269976302754223
Energy: 1.1114141694737711
Energy: 1.1269976302772169
Energy: 1.12856620460341
Energy: 1.1245817511399476
Energy: 1.1116384417585297
Energy: 1.1245817511399476
Energy: 1.1570723107264136
Energy: 1.251014881506735
Energy: 1.1280245331573315
Energy: 1.251014881506735
Energy: 1.125579045950083
Energy: 1.2387973042491665
Energy: 1.1109189743244638
Energy: 1.2387973042491665
Energy: 1.1452614018544816
Energy: 1.123635702096791
Energy: 1.1263691803139124
Energy: 1.123635702096791
Energy: 1.147743543473486
Energy: 1.1267794682427632
Energy: 1.124004797977112
Energy: 1.1267794682409689
Energy: 1.1250102574255643
Energy: 1.1202383476162634
Energy: 1.1203615337498882
Energy: 1.120238347618017
Energy: 1.111532037541408
Energy: 1.1251923441581542
Energy: 1.1274339850215662
Energy: 1.1251923441599485

minimum gb energy = 1.1109189743244638 eV
minimum distance =  2.23517269341481 Angstroms
sigma value = 13


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

Energy: 1.9097209923152114
Energy: 1.0701279312778214
Energy: 1.3574414534523163
Energy: 1.0613194099113759
Energy: 1.245661934156917
Energy: 1.0674389262991515
Energy: 1.265365819657494
Energy: 1.0674389262968953
Energy: 1.071723320824469
Energy: 1.0653974561461805
Energy: 1.2747232520207024
Energy: 1.0653974561454285
Energy: 1.473558146585257
Energy: 1.070076765219948
Energy: 1.2534878786734127
Energy: 1.070076765210923
Energy: 1.457783529715072
Energy: 1.0679052203097994
Energy: 1.271818182404138
Energy: 1.0679052203052868
Energy: 1.2530848118516311
Energy: 1.0666873185976014
Energy: 1.2691493563501641
Energy: 1.066687318608062
Energy: 1.2726922016981526
Energy: 1.0659963675201425
Energy: 1.247167451620187
Energy: 1.0659963675178865
Energy: 1.2528965582919989
Energy: 1.0652526716090633
Energy: 1.2834217560614243
Energy: 1.0652526716075592
Energy: 1.0637104727304127
Energy: 1.070733467767723
Energy: 1.2561685696409404
Energy: 1.070733467765467
Energy: 1.0644172943409578
Energy: 1.065097735858875
Energy: 1.256517165811771
Energy: 1.065097735859627
Energy: 1.0676170523619732
Energy: 1.0858946871548183
Energy: 1.9103409369467785
Energy: 1.085894687160083
Energy: 1.2466233914627785
Energy: 1.0638278462605466
Energy: 1.2569404544794887
Energy: 1.0638278462545299
Energy: 1.271112738760557
Energy: 1.1356449513647737
Energy: 1.2460573032367224
Energy: 1.1356449513617655
Energy: 1.4547660466229027
Energy: 1.140771017053404
Energy: 1.4727467178707936
Energy: 1.140771017057848
Energy: 1.2841948913055272
Energy: 1.0680668290640078
Energy: 1.4534169749260246
Energy: 1.0680668290677682
Energy: 1.2839608476990356
Energy: 1.0673262072045526
Energy: 1.070360741549524
Energy: 1.0673262072090652
Energy: 1.4559417384723463
Energy: 1.0651256287363378
Energy: 1.070113088673106
Energy: 1.065125628737842
Energy: 1.114062515533172
Energy: 1.064617389988421
Energy: 1.0682803271836212
Energy: 1.0646173899778917
Energy: 1.4148189849638126
Energy: 1.0695226767592974
Energy: 1.2456219821963215
Energy: 1.0695226767487682
Energy: 1.2554805099626212
Energy: 1.0639276436784713
Energy: 1.2747273678819377
Energy: 1.0639276436882485
Energy: 1.4789554712784412
Energy: 1.0666163776040605
Energy: 1.2472526850896501
Energy: 1.0666163776003001
Energy: 1.2557136987193847
Energy: 1.1564002625970025
Energy: 1.2444518677365504
Energy: 1.1564002625970025
Energy: 1.258057367093496
Energy: 1.0680112549113165
Energy: 1.2724316868569485
Energy: 1.0680112549098124
Energy: 1.0716224236828022
Energy: 1.0639758916001592
Energy: 1.4555300043347963
Energy: 1.0639758915994073
Energy: 1.2494465074672791
Energy: 1.0668908336476013
Energy: 1.2832751852920932
Energy: 1.0668908336483534
Energy: 1.0671012286219193
Energy: 1.0642887512608632
Energy: 1.280411067923169
Energy: 1.064288751259359
Energy: 1.0651926242328045
Energy: 1.0634073496188565
Energy: 1.4602217459986355
Energy: 1.0634073496233694
Energy: 1.087541239439019
Energy: 1.0716122469494906
Energy: 1.1140568030184357
Energy: 1.0716122469502427
Energy: 1.2449811404434263
Energy: 1.0688853546024393
Energy: 1.416073667692317
Energy: 1.0688853545949184
Energy: 1.273680037691883
Energy: 1.1409631730564345
Energy: 1.2453728995133342
Energy: 1.1409631730624512
Energy: 1.2484657540351058
Energy: 1.1350612990312272
Energy: 1.4805908231809404
Energy: 1.1350612990395001
Energy: 1.2572484853542387
Energy: 1.0667598877382185
Energy: 1.245557988929101
Energy: 1.0667598877389708
Energy: 1.2854952521957446
Energy: 1.0689611437909332
Energy: 1.0914698537516987
Energy: 1.0689611437992064
Energy: 1.457925541652117
Energy: 1.0635371835818106
Energy: 1.0653315174649327
Energy: 1.0635371835922716
Energy: 1.4147835310503205
Energy: 1.0671620663243124
Energy: 1.0721065425535963
Energy: 1.0671620663062624

minimum gb energy = 1.0613194099113759 eV
minimum distance =  2.22647454614957 Angstroms
sigma value = 37


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

Energy: 1.6794744264707304
Energy: 0.9770615830851651
Energy: 0.9822487467770458
Energy: 0.9772241720537842
Energy: 1.6117388784328484
Energy: 0.9763187964975067
Energy: 1.2905231098748715
Energy: 0.9763187964975067
Energy: 1.594050671991168
Energy: 0.9735733788630944
Energy: 1.2963559153704693
Energy: 0.9735733788618005
Energy: 1.594191007153493
Energy: 1.1071944704957295
Energy: 1.2871993283066727
Energy: 1.1071944704970234
Energy: 1.6092508424817895
Energy: 1.1053255167592773
Energy: 1.2903214569198382
Energy: 1.1053255167579834
Energy: 1.1771649089191132
Energy: 0.9746606938702805
Energy: 1.6101232808753434
Energy: 0.9746606938689866
Energy: 0.968100717956497
Energy: 0.9734793291115748
Energy: 1.6106273187491629
Energy: 0.9734793291115748
Energy: 0.9907892849407617
Energy: 0.9753469680031354
Energy: 1.6009182543376002
Energy: 0.9753469680018415
Energy: 0.9740150553129332
Energy: 0.9801410848477333
Energy: 1.6010907344877596
Energy: 0.9801410848464394
Energy: 0.9740230044047381
Energy: 0.9757897973443742
Energy: 1.4777813957767663
Energy: 0.975789797345668
Energy: 0.9822487467654003
Energy: 0.977224172056372
Energy: 1.6794744264707304
Energy: 0.9770615761488706
Energy: 1.2905231098735777
Energy: 0.9763187964975067
Energy: 1.4764709699850813
Energy: 0.9763187964987712
Energy: 1.296355915373057
Energy: 0.9735733788618005
Energy: 1.594050671991168
Energy: 0.9735733788618005
Energy: 1.2871993283079666
Energy: 1.1071944704983172
Energy: 1.594191007153493
Energy: 1.1071944704970234
Energy: 1.2903214569211323
Energy: 1.1053255167592773
Energy: 1.6092508424817895
Energy: 1.1053255167592773
Energy: 1.5030748116903179
Energy: 0.9746606938689866
Energy: 1.2983163652144318
Energy: 0.9746606938702805
Energy: 1.6106273187491629
Energy: 0.9734793291141627
Energy: 0.9681007179552031
Energy: 0.9734793291128688
Energy: 1.6009182543376002
Energy: 0.9753469680005475
Energy: 0.9907892849381738
Energy: 0.9753469680005475
Energy: 1.6010907344864655
Energy: 0.9801410848490272
Energy: 0.9740150553142272
Energy: 0.9801410848477333
Energy: 1.6118889430181065
Energy: 0.975789797345668
Energy: 0.9740230044034442
Energy: 0.9757897973469619

minimum gb energy = 0.9681007179552031 eV
minimum distance =  2.23898666275502 Angstroms
sigma value = 25


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

Energy: 1.9924079840705882
Energy: 0.8745606482256841
Energy: 1.213485786968287
Energy: 0.8839210478715124
Energy: 1.598339211230353
Energy: 0.8719988986938513
Energy: 1.1290031454395233
Energy: 0.8719988986938513
Energy: 1.8011168879866248
Energy: 0.8704244583566482
Energy: 1.1339129950591502
Energy: 0.8704244583576585
Energy: 1.4063704268381423
Energy: 0.8728811747336989
Energy: 1.1291372397479729
Energy: 0.8728811747336989
Energy: 1.4075964331953275
Energy: 0.9749869756963291
Energy: 1.5966720859896846
Energy: 0.9749869756973394
Energy: 1.385893062957323
Energy: 0.9733056535726282
Energy: 1.5972846971571766
Energy: 0.9733056535716178
Energy: 1.3897403296196515
Energy: 0.9753853394790925
Energy: 1.5983559271423482
Energy: 0.9753853394790925
Energy: 1.1288587298447248
Energy: 0.8783584719045324
Energy: 1.5914440492996462
Energy: 0.8783584719035221
Energy: 1.1337800295493552
Energy: 0.8703172622556749
Energy: 1.596959106950696
Energy: 0.8703172622556749
Energy: 1.136078371152577
Energy: 0.8719582974881608
Energy: 1.5968245703403774
Energy: 0.8719582974881608
Energy: 0.8724501902783367
Energy: 0.8780104427079
Energy: 1.6993045988414306
Energy: 0.8780104427129518
Energy: 0.8774140508265674
Energy: 0.8716089930456598
Energy: 1.5978261760442032
Energy: 0.8716089930446492
Energy: 0.8734103636614704
Energy: 0.8701411011823932
Energy: 1.3858893702931627
Energy: 0.8701411011823932
Energy: 0.8952147659986467
Energy: 0.8709653887641041
Energy: 1.791458767487863
Energy: 0.8709653887620834
Energy: 1.1341225713306982
Energy: 0.8701120909320462
Energy: 1.804102168436045
Energy: 0.8701120909340669
Energy: 1.136606567214419
Energy: 0.872401132814561
Energy: 1.8048085849470283
Energy: 0.872401132814561
Energy: 1.4106684754246603
Energy: 0.8739604059669377
Energy: 1.7975925726302788
Energy: 0.8739604059669377
Energy: 1.1376489405492256
Energy: 0.9800483574853665
Energy: 1.603817552533031
Energy: 0.9800483574863768
Energy: 1.5963945320964719
Energy: 0.9748528721296782
Energy: 1.3882534502058081
Energy: 0.9748528721296782
Energy: 1.5980479008320474
Energy: 0.9740247647518042
Energy: 1.386333119590517
Energy: 0.974024764753825
Energy: 1.7017059793148586
Energy: 0.8758270075306167
Energy: 1.1294515202943896
Energy: 0.8758270075296063
Energy: 1.6006759813218678
Energy: 0.8693587020575222
Energy: 0.8713808990087388
Energy: 0.8693587020565118
Energy: 1.5954122699172848
Energy: 0.8750488508462264
Energy: 1.129041742394885
Energy: 0.8750488508472368
Energy: 1.5896575657634435
Energy: 0.8746669224416944
Energy: 0.8713948884824811
Energy: 0.8746669224386632
Energy: 1.601208131420921
Energy: 0.870210539551837
Energy: 0.8712371772119298
Energy: 0.870210539551837
Energy: 1.791573123038677
Energy: 0.8733267614130337
Energy: 0.8792809652412571
Energy: 0.8733267614120233

minimum gb energy = 0.8693587020565118 eV
minimum distance =  2.23713090954469 Angstroms
sigma value = 41


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

Energy: 2.1848684780426053
Energy: 0.7983643442486464
Energy: 1.1589308382182566
Energy: 0.8121046587963968
Energy: 1.7605873999817774
Energy: 0.7958515174271863
Energy: 1.0095285426013314
Energy: 0.7958515174271863
Energy: 1.9332081119131612
Energy: 0.7937471556480088
Energy: 1.0171151199711033
Energy: 0.7937471556488372
Energy: 1.584704460245841
Energy: 0.7975055639667694
Energy: 1.2522036174483573
Energy: 0.7975055639642845
Energy: 1.6012562335238412
Energy: 0.7917842101028212
Energy: 1.4155200101604324
Energy: 0.7917842101028212
Energy: 1.5888988865695497
Energy: 0.7935860318856532
Energy: 1.4098021712120992
Energy: 0.7935860318914516
Energy: 1.595350834317869
Energy: 0.8824017379343112
Energy: 1.6018456723031789
Energy: 0.8824017379334829
Energy: 1.4110957786388143
Energy: 0.8852120799398607
Energy: 1.416063302056026
Energy: 0.8852120799431742
Energy: 1.2273005033393192
Energy: 0.7953083081214504
Energy: 1.7620542585440957
Energy: 0.7953083081231072
Energy: 1.2268659326304874
Energy: 0.7919553099871444
Energy: 1.7605183030585434
Energy: 0.7919553099863159
Energy: 1.0107647749888116
Energy: 0.7999758477011878
Energy: 1.755465009716038
Energy: 0.7999758476987027
Energy: 1.0121586671477742
Energy: 0.7927319352525519
Energy: 1.7591997315757382
Energy: 0.7927319352508951
Energy: 1.0117518054640389
Energy: 0.7965300614694224
Energy: 1.7566052807135122
Energy: 0.7965300614710791
Energy: 0.7945167977733408
Energy: 0.7992009720280644
Energy: 1.7535579282100715
Energy: 0.7992009720280644
Energy: 0.7961351695534988
Energy: 0.7941649285064634
Energy: 1.7623524101472414
Energy: 0.7941649285081199
Energy: 0.8023867088434699
Energy: 0.7961849531125299
Energy: 1.9332812632700433
Energy: 0.7961849531133582
Energy: 1.0226027231602905
Energy: 0.7996140748226648
Energy: 1.9208880843990324
Energy: 0.7996140748234931
Energy: 1.0132280151929154
Energy: 0.7918767488211312
Energy: 1.9300333212950769
Energy: 0.7918767488211312
Energy: 1.0136685118174034
Energy: 0.7980071590870542
Energy: 1.5924953162355202
Energy: 0.7980071590870542
Energy: 1.4144220822712632
Energy: 0.7954114220749263
Energy: 1.5888707270120312
Energy: 0.7954114220716128
Energy: 1.4216010666307768
Energy: 0.7933209040050397
Energy: 1.7590121369169918
Energy: 0.7933209040100099
Energy: 1.4151346754713823
Energy: 0.880173324625144
Energy: 1.599578500436714
Energy: 0.8801733246234871
Energy: 1.7624028790486828
Energy: 0.8775059301429479
Energy: 1.5871290054664164
Energy: 0.8775059301429479
Energy: 1.4162127094080974
Energy: 0.8809852269596443
Energy: 1.4129274559371476
Energy: 0.8809852270183824
Energy: 1.761735673819202
Energy: 0.7934211327998495
Energy: 1.2305579862751441
Energy: 0.7934211328015063
Energy: 1.7613848423953489
Energy: 0.7948021530931183
Energy: 1.4101485603590402
Energy: 0.7948021530931183
Energy: 1.7692259068959564
Energy: 0.7985486841694777
Energy: 1.0257618368855324
Energy: 0.7985486841694777
Energy: 1.9291914833768893
Energy: 0.7927001098290862
Energy: 1.0123662650821308
Energy: 0.792700109835713
Energy: 1.7657545851305088
Energy: 0.798510080551809
Energy: 1.0213381705947833
Energy: 0.7985100805534658
Energy: 1.7624308628396925
Energy: 0.7968700610617779
Energy: 0.7960383899691693
Energy: 0.7968700610617779
Energy: 1.929776038719237
Energy: 0.7937735897287037
Energy: 0.7954195611796253
Energy: 0.7937735897287037
Energy: 1.9202853428164635
Energy: 0.8024493082703622
Energy: 0.8092107804756559
Energy: 0.8024493082687056

minimum gb energy = 0.7917842101028212 eV
minimum distance =  2.24170022442734 Angstroms
sigma value = 15


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

Energy: 1.8960534257456731
Energy: 0.7430295513260042
Energy: 1.114779468949089
Energy: 0.7535916142443435
Energy: 1.871679622242692
Energy: 0.736883562586838
Energy: 0.9196712444230472
Energy: 0.736883562586838
Energy: 2.0228943315703143
Energy: 0.7350957583255311
Energy: 0.9249347348679051
Energy: 0.7350957583248294
Energy: 1.7408455978934172
Energy: 0.7389758378118303
Energy: 1.2808387771082945
Energy: 0.7389758378097251
Energy: 1.7373459052680655
Energy: 0.7322401964895602
Energy: 1.2671510524666567
Energy: 0.732240196487455
Energy: 1.7309764144046407
Energy: 0.7333358449506162
Energy: 1.265240592512891
Energy: 0.7333358449478093
Energy: 1.4271596627567542
Energy: 0.7334217786475395
Energy: 1.5805630010655276
Energy: 0.7334217786419257
Energy: 1.5879065760950422
Energy: 0.8132340024842388
Energy: 1.2665720457097172
Energy: 0.8132340024828991
Energy: 1.4222437399842802
Energy: 0.8055732923846075
Energy: 1.5746933890973067
Energy: 0.8055732923923267
Energy: 1.420558094574568
Energy: 0.8053108118186497
Energy: 1.8721658218068051
Energy: 0.8053108118277722
Energy: 1.2780259234421663
Energy: 0.7363650623139206
Energy: 1.5899656008810272
Energy: 0.7363650623173654
Energy: 1.1039422028935089
Energy: 0.7321128265467001
Energy: 1.8720206647857016
Energy: 0.7321128265417878
Energy: 1.2673406754769383
Energy: 0.7331804798237951
Energy: 1.8739465095069854
Energy: 0.7331804798259004
Energy: 0.9345738209208704
Energy: 0.7385380042258881
Energy: 1.5889070095429
Energy: 0.738538004223783
Energy: 0.9197650144673215
Energy: 0.7325808385551495
Energy: 2.0157879113089505
Energy: 0.7325808385593602
Energy: 0.9271600069055808
Energy: 0.7360804431979678
Energy: 1.8787500157412043
Energy: 0.7360804432007747
Energy: 0.7431650509336233
Energy: 0.73894144980712
Energy: 1.8844874438732073
Energy: 0.7389414498057164
Energy: 0.7326132627729404
Energy: 0.733668794192108
Energy: 2.0149384545431768
Energy: 0.7336687941907045
Energy: 0.7494540932217674
Energy: 0.7383078906969175
Energy: 1.736573395117453
Energy: 0.7383078906962157
Energy: 0.9305964489787291
Energy: 0.7359959444611761
Energy: 2.0260269729420273
Energy: 0.7359959444639831
Energy: 0.915948573460742
Energy: 0.7325816146732049
Energy: 1.871342269380664
Energy: 0.7325816146718015
Energy: 0.935359403216345
Energy: 0.7390222561343899
Energy: 1.7412639782389856
Energy: 0.7390222561364951
Energy: 1.2669330574876954
Energy: 0.7339761454921103
Energy: 1.7265555555618888
Energy: 0.733976145495619
Energy: 1.2696343643022923
Energy: 0.7323007836782242
Energy: 1.8736975917272207
Energy: 0.7323007836782242
Energy: 1.2760499127162088
Energy: 0.7359973075632561
Energy: 1.4322643912608939
Energy: 0.7359973075660632
Energy: 1.5770333600013262
Energy: 0.8047056446572005
Energy: 1.8729753563301517
Energy: 0.804705644655797
Energy: 1.2654382012643695
Energy: 0.8058313255877829
Energy: 1.5766061859079143
Energy: 0.8058313255877829
Energy: 1.5865033777004938
Energy: 0.8131862541759726
Energy: 1.4352432463001032
Energy: 0.8131862541759726
Energy: 1.581089360861956
Energy: 0.7389234909361382
Energy: 1.57997575624487
Energy: 0.7389234909326295
Energy: 1.5760467215276635
Energy: 0.73306665070025
Energy: 1.26691308189194
Energy: 0.7330666506995482
Energy: 1.7344499939564695
Energy: 0.7321954403941167
Energy: 1.1036790713323466
Energy: 0.7321954403955201
Energy: 1.586463859969957
Energy: 0.7400248542628206
Energy: 1.2783616628239756
Energy: 0.7400248542628206
Energy: 1.8752380493489307
Energy: 0.7351828358298413
Energy: 0.9256412571176984
Energy: 0.7351828358312448
Energy: 1.8699355161454925
Energy: 0.7353905787237155
Energy: 0.9257195359206764
Energy: 0.7353905787216103
Energy: 1.8667721777197461
Energy: 0.7401926203147671
Energy: 0.7589734743332994
Energy: 0.7401926203140654
Energy: 1.869867234035753
Energy: 0.7354120831400021
Energy: 0.7411401153473678
Energy: 0.7354120831407038
Energy: 2.017287520458201
Energy: 0.7357747251871611
Energy: 0.7379741110260919
Energy: 0.7357747251864594

minimum gb energy = 0.7321128265417878 eV
minimum distance =  2.23918017746692 Angstroms
sigma value = 85


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

Energy: 2.0235274531226732
Energy: 0.6652306020939823
Energy: 0.6646082714588692
Energy: 0.7010276095930154
Energy: 1.9387715069821834
Energy: 0.6653019299714212
Energy: 0.8269055355542945
Energy: 0.6653019299720297
Energy: 1.809132886042367
Energy: 0.6646757604850307
Energy: 0.8332316208015277
Energy: 0.6646757604856393
Energy: 1.537901242997211
Energy: 0.6633525984023302
Energy: 1.1323840007990438
Energy: 0.6633525984005042
Energy: 1.819340708371485
Energy: 0.6622987651261336
Energy: 1.1323546898816146
Energy: 0.6622987651243079
Energy: 1.5416541272187045
Energy: 0.6636048214281932
Energy: 1.1342538258410741
Energy: 0.6636048214281932
Energy: 1.5395703780071954
Energy: 0.6640919919906891
Energy: 1.40867910452
Energy: 0.6640919919912701
Energy: 1.6797778181627288
Energy: 0.6624401371271795
Energy: 1.1303057817016262
Energy: 0.6624401371320484
Energy: 1.5428745520495062
Energy: 0.6640222745405758
Energy: 1.4096533927346586
Energy: 0.6640222746202769
Energy: 1.546162038929126
Energy: 0.7855886388304051
Energy: 1.6773933264828282
Energy: 0.7855886388279705
Energy: 1.4089395741203894
Energy: 0.7850165424981662
Energy: 1.4059895002651972
Energy: 0.7850165424987748
Energy: 1.274042084369372
Energy: 0.6634562925853457
Energy: 1.678544531940624
Energy: 0.663456292778775
Energy: 1.4074895514888552
Energy: 0.6628048531242218
Energy: 1.6765320519141416
Energy: 0.6628048531230045
Energy: 1.1325550188804951
Energy: 0.6648276900778941
Energy: 1.4028758187467274
Energy: 0.6648276900778941
Energy: 0.9822792981743739
Energy: 0.6626065643402532
Energy: 1.9364586646664461
Energy: 0.6626065643408617
Energy: 1.1322353047193374
Energy: 0.6657139729060509
Energy: 1.6769646152651543
Energy: 0.6657139729042251
Energy: 0.8295852107293898
Energy: 0.6629892413769111
Energy: 1.6729231989557876
Energy: 0.6629892413756938
Energy: 0.8237706824570558
Energy: 0.6627968767248396
Energy: 1.8184821313941826
Energy: 0.6627968767254483
Energy: 0.8270699146226245
Energy: 0.6627652069387733
Energy: 1.9302097101800604
Energy: 0.6627652069387733
Energy: 0.665107967051022
Energy: 0.6636533015021909
Energy: 1.930108679094198
Energy: 0.6636533015021909
Energy: 0.6640570666425587
Energy: 0.6634669206936402
Energy: 1.9395137306861157
Energy: 0.6634669206936402
Energy: 0.6638798894511662
Energy: 0.6637277414370368
Energy: 1.8034280234382496
Energy: 0.663727741435211
Energy: 0.8352521737150334
Energy: 0.6663918863172248
Energy: 2.054293757728674
Energy: 0.6663918863178335
Energy: 0.8267586342612875
Energy: 0.662804862513433
Energy: 1.938252713537738
Energy: 0.662804862513433
Energy: 0.8271797944686659
Energy: 0.6629136113090967
Energy: 1.538591802275105
Energy: 0.6629136113090967
Energy: 1.1324624842492912
Energy: 0.6635058742943403
Energy: 2.0591630687310114
Energy: 0.6635058742912973
Energy: 1.1314884164701704
Energy: 0.6628543452791568
Energy: 1.8111439138487255
Energy: 0.6628543452791568
Energy: 1.30102860116729
Energy: 0.6656627369055151
Energy: 1.5405261737867746
Energy: 0.6656627369079496
Energy: 1.4118285409303342
Energy: 0.662497605623097
Energy: 1.8189989565429985
Energy: 0.6624976056243143
Energy: 1.4083546272548164
Energy: 0.6638249468563048
Energy: 1.5435794983155537
Energy: 0.6638249468763614
Energy: 1.6843545068564159
Energy: 0.7861338875747851
Energy: 1.2712860313509498
Energy: 0.7861338875778283
Energy: 1.4053583753545913
Energy: 0.7862803014205328
Energy: 1.5616416800686306
Energy: 0.7862803014180983
Energy: 1.6791031451548328
Energy: 0.6640545617495368
Energy: 1.268467236086188
Energy: 0.664054561961861
Energy: 1.8219296583589746
Energy: 0.6623319573330949
Energy: 1.269344153494693
Energy: 0.6623319573337038
Energy: 1.4035799194928276
Energy: 0.6660004957320351
Energy: 1.132343441762477
Energy: 0.6660004957314264
Energy: 1.9394036640083891
Energy: 0.6625500509730894
Energy: 1.1315439222751815
Energy: 0.6625500509730894
Energy: 1.932986915261905
Energy: 0.663738575915878
Energy: 1.1325855747666675
Energy: 0.6637385759152695
Energy: 1.6740141464274163
Energy: 0.6631509038239654
Energy: 0.8278315635774821
Energy: 0.6631509038239654
Energy: 1.9384505261750746
Energy: 0.6626612526390262
Energy: 0.8264267946968467
Energy: 0.6626612526390262
Energy: 1.9301947179267656
Energy: 0.6661028471065691
Energy: 0.8274445628003861
Energy: 0.6661028471059605
Energy: 1.6715571076547513
Energy: 0.6638745282112505
Energy: 0.6634300528255409
Energy: 0.6638745282124677
Energy: 1.9396969114892557
Energy: 0.663289118993894
Energy: 0.663514156132887
Energy: 0.6632891189926768
Energy: 1.8033985410455828
Energy: 0.6631170498620613
Energy: 0.6630671922600522
Energy: 0.6631170498620613

minimum gb energy = 0.6622987651243079 eV
minimum distance =  2.24059312943128 Angstroms
sigma value = 113


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

Energy: 0.020484502454493316
Energy: 0.6001533282241855
Energy: 1.5891066101350015
Energy: 0.02220723941018174
Energy: 1.1522035927598218
Energy: 0.16867607830240922
Energy: 1.1533349763935161
Energy: 0.16867607830240922
Energy: 0.02209188577590689
Energy: 0.1660883398402966
Energy: 1.1504317737641694
Energy: 0.16608833984164825
Energy: 0.024029756956513833
Energy: 0.1676880245397668
Energy: 1.1518495211789834
Energy: 0.16768802453883105
Energy: 1.151755669948176
Energy: 0.168236673910956
Energy: 1.1509022998716993
Energy: 0.16823667391183975
Energy: 0.02201572700371574
Energy: 0.16580537770526232
Energy: 1.1503361690727245
Energy: 0.16580537770666592

minimum gb energy = 0.020484502454493316 eV
minimum distance =  2.4565816866723 Angstroms
sigma value = 1