Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Ni__MO_937008984446_002
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=3.5200000256299973
cohesive_energy=4.450350014603218
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=[1.9956551935440598e-19, 2.85121751610006e-19, 3.50810993604006e-19, 4.0444225425052197e-19, 4.49606011386348e-19, 4.88341835866566e-19, 5.219522972946179e-19, 5.5133301240891e-19, 5.771360670994799e-19, 5.99853329592966e-19, 6.189288445973699e-19, 6.33186614463336e-19, 6.463132476256979e-19, 6.58698073006518e-19, 6.69937342094028e-19, 6.79760287037082e-19, 6.881236490665619e-19, 6.95117150073972e-19, 7.008337163040839e-19, 7.053614674717679e-19, 7.087741037021879e-19, 7.111405185906059e-19, 7.125199926724798e-19, 7.1296860213e-19, 7.124879491398e-19, 7.109338378048199e-19, 7.081220178121499e-19, 7.038329909629319e-19, 6.97800795935922e-19, 6.89716212640758e-19, 6.792011273918159e-19, 6.658037263783079e-19, 6.489728608381378e-19, 6.2784816191884795e-19, 6.0172947843138e-19, 5.69754839346642e-19, 5.306729447134799e-19, 4.828495743652139e-19, 4.2423394221032397e-19, 3.5223532863163196e-19, 2.63508388817346e-19, 1.53677578380012e-19, 1.6900239788422197e-20, -1.54736617135086e-19, -3.7263904806562195e-19, -6.54626942179524e-19, -1.030278082317066e-18, -1.5517497266214838e-18, -2.3172921528195598e-18, -3.5258780749111196e-18, -5.61423520849842e-18, -9.6314047264593e-18, -1.8362386184610598e-17, -3.99480313215024e-17]
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: 0.01810389385790153
Energy: 0.01847484624367313
Energy: 0.7553325746775915
Energy: 0.15767604130697277
Energy: 0.018474846244334656
Energy: 1.9293470157488612
Energy: 0.15767604130634796
Energy: 1.9293470157495232
Energy: 0.7553325746769299
Energy: 0.15767604130634796
Energy: 0.018103893858563064
Energy: 0.018474846244334656
Energy: 0.15767604130634796
Energy: 1.9293470157495232
Energy: 0.018474846244996186
Energy: 1.9293470157495232

minimum gb energy = 0.01810389385790153 eV
minimum distance =  2.43206953661324 Angstroms
sigma value = 1


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

Energy: 1.5461879219575068
Energy: 1.137273617305516
Energy: 1.2248283485507458
Energy: 1.224015764525648
Energy: 1.119323272844839
Energy: 1.2609617377771565
Energy: 1.1274208189080923
Energy: 1.2609617377763545
Energy: 1.2255911939009627
Energy: 1.22457573681428
Energy: 1.6794969998822036
Energy: 1.2245757368134778
Energy: 1.1314313108578253
Energy: 1.1269904310134367
Energy: 1.1283658389463416
Energy: 1.1269904310158436
Energy: 1.444778926928658
Energy: 1.125270002407245
Energy: 1.1305892394710533
Energy: 1.1252700024056403
Energy: 1.185351458213799
Energy: 1.238630776719397
Energy: 1.1266482055840563
Energy: 1.2386307767185945
Energy: 1.1624207410926657
Energy: 1.157874601215735
Energy: 1.4443710318438752
Energy: 1.1578746012149328
Energy: 1.1665523447507775
Energy: 1.168653300373828
Energy: 1.243718055579349
Energy: 1.1686533003730255
Energy: 1.2678216987074034
Energy: 1.27023966575894
Energy: 1.2719271049577874
Energy: 1.2702396657573354
Energy: 1.2472431831323543
Energy: 1.2695091737979252
Energy: 1.1954919632861296
Energy: 1.2695091737963207
Energy: 1.340321906921348
Energy: 1.2757410347547002
Energy: 1.2691867324773969
Energy: 1.2757410347547002
Energy: 1.1655451906843082
Energy: 1.269010681011675
Energy: 1.2429935518540163
Energy: 1.269010681008466
Energy: 1.1578843838866582
Energy: 1.1578121733191014
Energy: 1.5403938639947954
Energy: 1.1578121733199036
Energy: 1.1859417573836897
Energy: 1.1606877983824773
Energy: 1.1856973397423711
Energy: 1.1606877983856867
Energy: 1.5411858191778756
Energy: 1.1263636492208435
Energy: 1.126498448017508
Energy: 1.126363649220041
Energy: 1.183727617742889
Energy: 1.1261228669666876
Energy: 1.128101262223824
Energy: 1.1261228669658851
Energy: 1.2240781040257385
Energy: 1.2237955836782788
Energy: 1.1323628514649546
Energy: 1.2237955836774763
Energy: 1.1274812930314306
Energy: 1.1261173630405046
Energy: 1.124125867384773
Energy: 1.1261173630421093
Energy: 1.67486564661118
Energy: 1.2245117512610881
Energy: 1.2257912028941433
Energy: 1.2245117512610881
Energy: 1.1841871375160637
Energy: 1.1254706153787672
Energy: 1.13029627260829
Energy: 1.1254706153170637
Energy: 1.125867217497156
Energy: 1.1273825092987937
Energy: 1.4431725441417682
Energy: 1.127382509204999
Energy: 1.126391027625126
Energy: 1.1278742332624598
Energy: 1.1858623237204555
Energy: 1.127874233254437
Energy: 1.4435150660012053
Energy: 1.1574312499986443
Energy: 1.1597165603225703
Energy: 1.1574312499817963
Energy: 1.2443385539984027
Energy: 1.1593166313783059
Energy: 1.1665381109921191
Energy: 1.1593166313783059
Energy: 1.2187064060386086
Energy: 1.2717047763979734
Energy: 1.2684786662871468
Energy: 1.2717047764011826
Energy: 1.1980156197814567
Energy: 1.270073930449073
Energy: 1.2490968412818944
Energy: 1.270073930449073
Energy: 1.269924064901901
Energy: 1.2697223550826717
Energy: 1.3397310437608523
Energy: 1.2697223550810675
Energy: 1.2455576040399334
Energy: 1.2695400526086498
Energy: 1.164338831127629
Energy: 1.2695400526086498
Energy: 1.1861140769726264
Energy: 1.1584067204658555
Energy: 1.15691480473402
Energy: 1.1584067204642507
Energy: 1.1855670416620963
Energy: 1.1600912754878112
Energy: 1.1853756180349597
Energy: 1.1600912754886135
Energy: 1.1253401375198602
Energy: 1.1260594539928492
Energy: 1.1855418857232527
Energy: 1.1260594539928492
Energy: 1.1265459363649724
Energy: 1.1272426637601178
Energy: 1.1839510667490103
Energy: 1.1272426637625248
Energy: 1.1325855507907743
Energy: 1.136116307719826
Energy: 1.2249544925366966
Energy: 1.1361163077214305

minimum gb energy = 1.119323272844839 eV
minimum distance =  2.23786521016716 Angstroms
sigma value = 1


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

Energy: 1.7535758790900193
Energy: 1.1780014365396605
Energy: 1.278359246881311
Energy: 1.2782748252901888
Energy: 1.1652427812098107
Energy: 1.311400566292003
Energy: 1.169866731726129
Energy: 1.3114005662938324
Energy: 1.2773109199560388
Energy: 1.2788861982807451
Energy: 1.6160306975616798
Energy: 1.27888619828166
Energy: 1.1767665172760975
Energy: 1.169777959251202
Energy: 1.1692238951094032
Energy: 1.169777959251202
Energy: 1.6149270983775548
Energy: 1.1697262923467775
Energy: 1.1686810236136522
Energy: 1.1697262923486074
Energy: 1.2444105073085865
Energy: 1.2328333517303307
Energy: 1.167716147708502
Energy: 1.2328333517312455
Energy: 1.2195226043155913
Energy: 1.2192893434755556
Energy: 1.37429865564082
Energy: 1.219289343529526
Energy: 1.2181013502576161
Energy: 1.2259272110601354
Energy: 1.3096374810503084
Energy: 1.2259272110592203
Energy: 1.3746905108709873
Energy: 1.3520274498073206
Energy: 1.272987056439653
Energy: 1.3520274498064058
Energy: 1.3086650424671296
Energy: 1.353077732727188
Energy: 1.215452721161959
Energy: 1.3530777327299324
Energy: 1.4722387646602224
Energy: 1.2192907056622033
Energy: 1.219768918275311
Energy: 1.2192907056603737
Energy: 1.2452058600604663
Energy: 1.2195825766649915
Energy: 1.2446699552619669
Energy: 1.2195825766485258
Energy: 1.1699179284423233
Energy: 1.1688632918123971
Energy: 1.473011704223616
Energy: 1.168863291813312
Energy: 1.1700874049980774
Energy: 1.1687235559689817
Energy: 1.2354312021805545
Energy: 1.1687235559671523
Energy: 1.7457240003593828
Energy: 1.277011027534585
Energy: 1.2773542408248624
Energy: 1.2770110275373294
Energy: 1.164926616503037
Energy: 1.1743776594669835
Energy: 1.1690942056840556
Energy: 1.174377659467898
Energy: 1.277637206487961
Energy: 1.2786622688916727
Energy: 1.6127510628712636
Energy: 1.2786622688907578
Energy: 1.1757334450421855
Energy: 1.1677144878526273
Energy: 1.2429012366860934
Energy: 1.1677144878517123
Energy: 1.6128626703490645
Energy: 1.1670391963077678
Energy: 1.1693371459525772
Energy: 1.1670391963077678
Energy: 1.2438520207426473
Energy: 1.1698027351936253
Energy: 1.1702687755916754
Energy: 1.169802735191796
Energy: 1.2257790401667559
Energy: 1.2193148645192506
Energy: 1.3738659056937195
Energy: 1.2193148645192506
Energy: 1.2172040208906056
Energy: 1.221072952938626
Energy: 1.311114514448643
Energy: 1.221072952939541
Energy: 1.375693306012016
Energy: 1.3572892850942042
Energy: 1.2815509455013552
Energy: 1.3572892850942042
Energy: 1.3098715386969888
Energy: 1.351472028527936
Energy: 1.215297138348994
Energy: 1.3514720285261064
Energy: 1.2450092191877433
Energy: 1.2194922147287974
Energy: 1.218949638337556
Energy: 1.2194922147105023
Energy: 1.2440099051983535
Energy: 1.2214613877862326
Energy: 1.244216024183803
Energy: 1.2214613877889768
Energy: 1.1685661355528685
Energy: 1.1685302933628436
Energy: 1.4672689405498383
Energy: 1.168530293364673
Energy: 1.1693663066993008
Energy: 1.1698258502066694
Energy: 1.2358851011816163
Energy: 1.1698258502094137
Energy: 1.1705971721079593
Energy: 1.1744473451342219
Energy: 1.276517685320966
Energy: 1.1744473451342219

minimum gb energy = 1.164926616503037 eV
minimum distance =  2.23322333907664 Angstroms
sigma value = 25


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

Energy: 1.8012022109144656
Energy: 1.279529024732421
Energy: 1.3494703872134908
Energy: 1.3479305823647711
Energy: 1.217405000097677
Energy: 1.3750258751535445
Energy: 1.232729090348074
Energy: 1.3750258751546078
Energy: 1.3498477367733308
Energy: 1.3486608118656882
Energy: 1.603775108959635
Energy: 1.3486608118656882
Energy: 1.2380295292797816
Energy: 1.4090455103832078
Energy: 1.2330481045183166
Energy: 1.409045510381081
Energy: 1.604094144097048
Energy: 1.2330294935642827
Energy: 1.231590739482521
Energy: 1.2330294935632193
Energy: 1.3316983422758644
Energy: 1.318069448142248
Energy: 1.2322530452820775
Energy: 1.3180694481411848
Energy: 1.3262735014603626
Energy: 1.362389140239361
Energy: 1.3437238992220848
Energy: 1.362389140239361
Energy: 1.2873148118015099
Energy: 1.362562977515076
Energy: 1.366920238238308
Energy: 1.3625629775161392
Energy: 1.3356345562625265
Energy: 1.336271357310335
Energy: 1.458826494419804
Energy: 1.3362713573082081
Energy: 1.3581541446642746
Energy: 1.3409983080204104
Energy: 1.2322876068124384
Energy: 1.3409983080172683
Energy: 1.2289369906231593
Energy: 1.2786471004600322
Energy: 1.2770179842186682
Energy: 1.2786471004600322
Energy: 1.2293751051285287
Energy: 1.2144975527013082
Energy: 1.215511339206094
Energy: 1.2144975527002446
Energy: 1.2249474510407408
Energy: 1.2246455376606873
Energy: 1.6690013324140214
Energy: 1.2246455376606873
Energy: 1.224663112736743
Energy: 1.207058594018866
Energy: 1.2168026545163204
Energy: 1.2070585940199294
Energy: 1.600632635875509
Energy: 1.3959079221888617
Energy: 1.398090720661194
Energy: 1.3959079221888617
Energy: 1.2907934458252595
Energy: 1.2311309134416062
Energy: 1.231485081713687
Energy: 1.2311309134405428
Energy: 1.246679826400186
Energy: 1.2470268065079229
Energy: 1.602722057441824
Energy: 1.2470268065079229
Energy: 1.2588805639022056
Energy: 1.2489608137049504
Energy: 1.3078678552925862
Energy: 1.2489608137049504
Energy: 1.3429587009370494
Energy: 1.344773597075259
Energy: 1.3007893642632098
Energy: 1.3447735970763224
Energy: 1.3975459942103823
Energy: 1.3454887223934033
Energy: 1.2865453542041139
Energy: 1.3454887223934033
Energy: 1.2214668061939893
Energy: 1.3235281785876614
Energy: 1.3210889967732098
Energy: 1.3235281785865978
Energy: 1.2175817897357604
Energy: 1.3379235535306886
Energy: 1.3341328047040975
Energy: 1.3379235535296252
Energy: 1.2270765605687761
Energy: 1.2289570110725192
Energy: 1.2292927758748993
Energy: 1.2289570110725192
Energy: 1.229889359915273
Energy: 1.2286698198622745
Energy: 1.2284383360961013
Energy: 1.2286698198601478
Energy: 1.2295966265125915
Energy: 1.2948239943311937
Energy: 1.3486685444997168
Energy: 1.2948239943311937

minimum gb energy = 1.207058594018866 eV
minimum distance =  2.2230680962683 Angstroms
sigma value = 9


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

Energy: 1.5570714218171255
Energy: 1.2439574884858329
Energy: 1.3835972623963775
Energy: 1.3829381138383017
Energy: 1.3072846843633665
Energy: 1.3956913178908905
Energy: 1.255711048858529
Energy: 1.3956913178921593
Energy: 1.383292898911096
Energy: 1.3833367725406533
Energy: 1.8339616115484099
Energy: 1.3833367725393848
Energy: 1.2706292692082999
Energy: 1.395860970848012
Energy: 1.2570421853990987
Energy: 1.3958609708492808
Energy: 1.4171180865502626
Energy: 1.2565726163457875
Energy: 1.2576769660940366
Energy: 1.2565726163483246
Energy: 1.3861513301195192
Energy: 1.2564272469647157
Energy: 1.2589993844809757
Energy: 1.256427246965984
Energy: 1.282155158656299
Energy: 1.391650076610009
Energy: 1.4203587073738715
Energy: 1.391650076610009
Energy: 1.2575489795612849
Energy: 1.393943216818241
Energy: 1.3882530545791598
Energy: 1.393943216818241
Energy: 1.2560910807887269
Energy: 1.256416097033002
Energy: 1.2276252701631603
Energy: 1.2564160970291962
Energy: 1.2575925051683265
Energy: 1.256901507940399
Energy: 1.2275413392505918
Energy: 1.2569015079391306
Energy: 1.5508951216605238
Energy: 1.2707422244361746
Energy: 1.3826005494136893
Energy: 1.2707422244349058
Energy: 1.3091618673194316
Energy: 1.271398190548228
Energy: 1.2572437806048555
Energy: 1.2713981905494964
Energy: 1.3835721884800791
Energy: 1.38347400035887
Energy: 1.2678184866042965
Energy: 1.3834740003614068
Energy: 1.2702819655026523
Energy: 1.2572868843732063
Energy: 1.379756641553005
Energy: 1.2572868843732063
Energy: 1.416678138819888
Energy: 1.2569651266697044
Energy: 1.2584179487313047
Energy: 1.2569651266697044
Energy: 1.3871858185700703
Energy: 1.2575083791200912
Energy: 1.2566359630091153
Energy: 1.2575083791200912
Energy: 1.2822697964625882
Energy: 1.3944883866042783
Energy: 1.4206375104287288
Energy: 1.3944883866055464
Energy: 1.2835371100645625
Energy: 1.3930041080093376
Energy: 1.386168771095418
Energy: 1.3930041080080693
Energy: 1.2549412140698235
Energy: 1.256407593423899
Energy: 1.2275054800291982
Energy: 1.256407593423899
Energy: 1.2573442865959803
Energy: 1.257212879492243
Energy: 1.2277820428102009
Energy: 1.257212879492243
Energy: 1.2271713572336995
Energy: 1.27136586154181
Energy: 1.3838931954788547
Energy: 1.27136586154181

minimum gb energy = 1.2271713572336995 eV
minimum distance =  2.22930698016998 Angstroms
sigma value = 25


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

Energy: 1.3884149246245916
Energy: 1.2568947130741046
Energy: 1.433674167237787
Energy: 1.4333290453872942
Energy: 1.2373749731379846
Energy: 1.3655771951538145
Energy: 1.28524178651363
Energy: 1.3655771951538145
Energy: 1.4331659997089015
Energy: 1.4339925420143076
Energy: 1.6943657973792965
Energy: 1.4339925420143076
Energy: 1.2450693407783338
Energy: 1.3660393471931744
Energy: 1.2849046881833455
Energy: 1.3660393471947432
Energy: 1.3137328854122279
Energy: 1.323111178745709
Energy: 1.3213415192462232
Energy: 1.32311117874414
Energy: 1.2452993280655171
Energy: 1.3231159788005131
Energy: 1.2841356394208872
Energy: 1.3231159788020816
Energy: 1.3930185176211622
Energy: 1.423393308886447
Energy: 1.3167299792089135
Energy: 1.423393308886447
Energy: 1.238032155088615
Energy: 1.4151568368219802
Energy: 1.2863803259775282
Energy: 1.4151568368204113
Energy: 1.4321917869620062
Energy: 1.246345855002025
Energy: 1.2409185079316682
Energy: 1.246345855002025
Energy: 1.2865447768027376
Energy: 1.327142333154023
Energy: 1.246385550238125
Energy: 1.3271423331524546
Energy: 1.6918332205558961
Energy: 1.4344369991430617
Energy: 1.4367268442207974
Energy: 1.4344369991446304
Energy: 1.2417447124737542
Energy: 1.4134452099409336
Energy: 1.2462876889201946
Energy: 1.4134452099409336
Energy: 1.2879084581921203
Energy: 1.4157971156747655
Energy: 1.3135133763269258
Energy: 1.415797115673197
Energy: 1.321845970267136
Energy: 1.3195549479365902
Energy: 1.2450524550031934
Energy: 1.3195549479365902
Energy: 1.315355645148589
Energy: 1.3258419873124059
Energy: 1.3970264127917782
Energy: 1.3258419873124059
Energy: 1.2843301689148217
Energy: 1.411046229076335
Energy: 1.3944949498828167
Energy: 1.4110462290794725
Energy: 1.2396884374120287
Energy: 1.246738318678136
Energy: 1.4339022018569472
Energy: 1.2467383186640169

minimum gb energy = 1.2373749731379846 eV
minimum distance =  2.30948855237956 Angstroms
sigma value = 17


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

Energy: 1.9494016648061332
Energy: 1.47484499137781
Energy: 1.5858221856543013
Energy: 1.586994302440026
Energy: 1.2583851921851932
Energy: 1.3428169086242479
Energy: 1.3404759444753582
Energy: 1.3428169086251363
Energy: 1.365748429916879
Energy: 1.3659948274188363
Energy: 1.7697906995311117
Energy: 1.3659948274197249
Energy: 1.3430771969215343
Energy: 1.3451128804837276
Energy: 1.3418277554405478
Energy: 1.345112880484616
Energy: 1.4684960964987719
Energy: 1.4254902282718556
Energy: 1.3507876792964566
Energy: 1.4254902282718556
Energy: 1.345865960585085
Energy: 1.472357100613003
Energy: 1.3436352742995403
Energy: 1.4723571006121146
Energy: 1.5843720852779928
Energy: 1.3662212707916093
Energy: 1.3633872866077954
Energy: 1.3662212707924974
Energy: 1.4203492868582042
Energy: 1.3420190324769168
Energy: 1.295789705425028
Energy: 1.3420190324778054
Energy: 1.5875777602223407
Energy: 1.5880997070480751
Energy: 1.5099847352412312
Energy: 1.5880997070480751
Energy: 1.5778379032603547
Energy: 1.4704774177401772
Energy: 1.339471210650233
Energy: 1.4704774177392885
Energy: 1.4653696215625618
Energy: 1.307649433859906
Energy: 1.2949699966391037
Energy: 1.307649433859906
Energy: 1.427027813442122
Energy: 1.3047261959606875
Energy: 1.3029831074534872
Energy: 1.3047261959606875
Energy: 1.4211654004258762
Energy: 1.3047368963781147
Energy: 1.3017959096184566
Energy: 1.3047368963718953
Energy: 1.5858007356558463
Energy: 1.3826797043365997
Energy: 1.2914375356318932
Energy: 1.3826797043374883
Energy: 1.5876306333333485
Energy: 1.4241821925892009
Energy: 1.4189066467311147
Energy: 1.4241821925892009
Energy: 1.5886688398459372
Energy: 1.5541136159036382
Energy: 1.419475593921291
Energy: 1.5541117250941419
Energy: 1.4257003690216263
Energy: 1.3417292511137189
Energy: 1.3676132996014314
Energy: 1.3417292511128303
Energy: 1.4244065985441856
Energy: 1.3423063319902042
Energy: 1.3643951029099357
Energy: 1.3423063319893156
Energy: 1.3430453135004505
Energy: 1.4289174429437437
Energy: 1.4692955019461365
Energy: 1.4289174429516998
Energy: 1.3390425973444626
Energy: 1.4285187667777857
Energy: 1.4131353698478526
Energy: 1.4285187667768975
Energy: 1.3420159882763503
Energy: 1.3432381991745912
Energy: 1.420119504092812
Energy: 1.3432381991754794
Energy: 1.3666708979547055
Energy: 1.366846755140813
Energy: 1.5879491689613445
Energy: 1.3668467551417014
Energy: 1.3391524514611077
Energy: 1.4439962338995387
Energy: 1.4796127088365352
Energy: 1.4439962338986503
Energy: 1.7639619024300506
Energy: 1.5869817755517717
Energy: 1.5864748686548893
Energy: 1.5869817755517717
Energy: 1.2989496181458768
Energy: 1.3423348639911845
Energy: 1.4263911117720574
Energy: 1.3423348639894075
Energy: 1.3026903555551999
Energy: 1.3037260271099214
Energy: 1.467254896643428
Energy: 1.3037260271099214
Energy: 1.2917847757878107
Energy: 1.3679387264178564
Energy: 1.4232752587186484
Energy: 1.367938726418745
Energy: 1.3026875159142237
Energy: 1.302005058540052
Energy: 1.5889766181140434
Energy: 1.302005058540052
Energy: 1.3030340194509487
Energy: 1.3435006858792042
Energy: 1.4216602834534764
Energy: 1.3435006858792042
Energy: 1.9434589988883324
Energy: 1.5866276762648304
Energy: 1.5845641678379143
Energy: 1.5866276762648304

minimum gb energy = 1.2583851921851932 eV
minimum distance =  2.24937695433103 Angstroms
sigma value = 53


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

Energy: 1.7557727639809793
Energy: 1.1935511233812235
Energy: 1.4558961638477113
Energy: 1.4550821608000521
Energy: 1.6837088494587154
Energy: 1.2773962010246023
Energy: 1.4329630639853403
Energy: 1.2773962010246023
Energy: 1.4539302012683875
Energy: 1.4549799351145605
Energy: 1.4542307165091397
Energy: 1.454979935116606
Energy: 1.432253714140321
Energy: 1.2788451221939023
Energy: 1.4296503618766998
Energy: 1.2788451221959478
Energy: 1.4568420428643023
Energy: 1.2773824437817527
Energy: 1.1664126458794075
Energy: 1.2773824437837982
Energy: 1.4286122445850118
Energy: 1.278930313686052
Energy: 1.167247347936958
Energy: 1.278930313686052
Energy: 1.7319313685712092
Energy: 1.4540888592557029
Energy: 1.4515983833864914
Energy: 1.4540888592557029
Energy: 1.7193652367486272
Energy: 1.280149938438191
Energy: 1.4555131520635547
Energy: 1.280149938438191
Energy: 1.4543478186140593
Energy: 1.457262888655831
Energy: 1.449763951474971
Energy: 1.4572628886578765
Energy: 1.4324071709545527
Energy: 1.2784562505548587
Energy: 1.4326625286318657
Energy: 1.2784562505548587
Energy: 1.4602204685780407
Energy: 1.2800044775117676
Energy: 1.216475311198659
Energy: 1.2800044775117676
Energy: 1.4323753589526411
Energy: 1.2795460182902738
Energy: 1.1688673562573082
Energy: 1.2795460182902738
Energy: 1.7216547275853165
Energy: 1.279174350750143
Energy: 1.4561180240151643
Energy: 1.2791743507480973

minimum gb energy = 1.1664126458794075 eV
minimum distance =  2.29696867647212 Angstroms
sigma value = 9


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

Energy: 1.7144256433202179
Energy: 1.568708649067421
Energy: 1.683198682480227
Energy: 1.684344711686544
Energy: 1.4188730413036958
Energy: 1.3135331760893694
Energy: 1.7219854132852237
Energy: 1.3135331760908835
Energy: 1.3138179174701101
Energy: 1.3148618848970417
Energy: 1.598978625787606
Energy: 1.3148618848970417
Energy: 1.3157579420865924
Energy: 1.316247360813386
Energy: 1.7535436846139214
Energy: 1.316247360812629
Energy: 1.3163955203305875
Energy: 1.3148372212022499
Energy: 1.7194556113568555
Energy: 1.314837221201493
Energy: 1.3124121690280173
Energy: 1.3112314702977201
Energy: 1.727656347819742
Energy: 1.3112314703280024
Energy: 1.6417765590764555
Energy: 1.67331967504419
Energy: 1.6859807617900433
Energy: 1.67331967504419
Energy: 1.7223091078128616
Energy: 1.6323648132972026
Energy: 1.6612075675992735
Energy: 1.6323648133002306
Energy: 1.3875390182379999
Energy: 1.4703787108465731
Energy: 1.3837827277303314
Energy: 1.4703787108450592
Energy: 1.285713951677962
Energy: 1.3870624065720107
Energy: 1.6279692486683885
Energy: 1.3870624065712536
Energy: 1.429197548104788
Energy: 1.43765270544114
Energy: 1.5475593580427343
Energy: 1.4376527054456827
Energy: 1.43169663212702
Energy: 1.452153112360512
Energy: 1.716968340917098
Energy: 1.452153112360512
Energy: 1.7247243833478283
Energy: 1.4308280841569603
Energy: 1.4426750363824876
Energy: 1.4308280841562033
Energy: 1.6441436846135928
Energy: 1.4334376438087684
Energy: 1.4463992818380553
Energy: 1.4334376438087684
Energy: 1.6494264920507633
Energy: 1.3896356982160871
Energy: 1.3962263937261559
Energy: 1.3896356982153304
Energy: 1.4821412748497702
Energy: 1.4703548250527254
Energy: 1.3873260345579441
Energy: 1.4703548250474259
Energy: 1.6350075890029088
Energy: 1.4733642429725236
Energy: 1.44325627538779
Energy: 1.4733642429717666
Energy: 1.6815566668934627
Energy: 1.6829511785700435
Energy: 1.7144234944264067
Energy: 1.682951178573829
Energy: 1.6860522159238045
Energy: 1.3144456451152502
Energy: 1.4174600175517948
Energy: 1.3144456451182782
Energy: 1.5975917201894987
Energy: 1.3147272915294612
Energy: 1.314583749367644
Energy: 1.3147272915324892
Energy: 1.75747784055915
Energy: 1.3146834627359274
Energy: 1.3134229384616287
Energy: 1.3146834627366846
Energy: 1.7278144818266028
Energy: 1.3119409986502566
Energy: 1.3134224405860213
Energy: 1.311940998651771
Energy: 1.7207430415020724
Energy: 1.4179252980384345
Energy: 1.3114416452251627
Energy: 1.4179252980391917
Energy: 1.700710612893285
Energy: 1.6484361413379203
Energy: 1.6416134768215946
Energy: 1.6484361413386774
Energy: 1.6755751295446357
Energy: 1.6334325416540865
Energy: 1.642164481468415
Energy: 1.6334325416533297
Energy: 1.3876073520611651
Energy: 1.4720311343548518
Energy: 1.4393638915431117
Energy: 1.4720311343510666
Energy: 1.6271520060919153
Energy: 1.385967199316581
Energy: 1.2847401936209273
Energy: 1.38596719931431
Energy: 1.6488189704501095
Energy: 1.43323208357986
Energy: 1.4291279652889868
Energy: 1.4332320835821313
Energy: 1.7167620570637498
Energy: 1.449059196349269
Energy: 1.4450454633278143
Energy: 1.449059196349269
Energy: 1.4404895185584734
Energy: 1.433387228185586
Energy: 1.7237757308602553
Energy: 1.4333872281848286
Energy: 1.447591737590907
Energy: 1.4398837712006194
Energy: 1.599778677154127
Energy: 1.4398837712006194
Energy: 1.3871213680178185
Energy: 1.388888614257855
Energy: 1.649186353249494
Energy: 1.388888614244228
Energy: 1.3909446997154462
Energy: 1.4702445017386145
Energy: 1.485691189222051
Energy: 1.4702445017340722
Energy: 1.441508620814959
Energy: 1.4673697278024715
Energy: 1.5170106093042917
Energy: 1.4673697278032285
Energy: 1.7145132342918177
Energy: 1.6795388466236012
Energy: 1.6800540539660127
Energy: 1.6795388466243582

minimum gb energy = 1.2847401936209273 eV
minimum distance =  2.24364987324114 Angstroms
sigma value = 73


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

Energy: 1.625554228883287
Energy: 1.3012058801068493
Energy: 1.5513446511808284
Energy: 1.591089196133841
Energy: 1.484603889780307
Energy: 1.3363738354104862
Energy: 1.5034764028549057
Energy: 1.3363738354104862
Energy: 1.334788287438246
Energy: 1.335591775155029
Energy: 1.4567845365511907
Energy: 1.335591775155029
Energy: 1.336041451213587
Energy: 1.3206432386637277
Energy: 1.7159049174797083
Energy: 1.3206432386625262
Energy: 1.3335782467925892
Energy: 1.3331952546500712
Energy: 1.6392361524400167
Energy: 1.3331952546500712
Energy: 1.3340991851545776
Energy: 1.6123001337418799
Energy: 1.6432600420339765
Energy: 1.6123001337418799
Energy: 1.7116243140949936
Energy: 1.5709695946702287
Energy: 1.5360800875562357
Energy: 1.5709695946690276
Energy: 1.4885643518490113
Energy: 1.525569346311668
Energy: 1.5648853358225907
Energy: 1.525569346311668
Energy: 1.4757873897026326
Energy: 1.4193391444460903
Energy: 1.4649246091368606
Energy: 1.4193391444472914
Energy: 1.2877730410451935
Energy: 1.4181696631361602
Energy: 1.4783407895655756
Energy: 1.4181696631361602
Energy: 1.531749138515734
Energy: 1.5205925431329255
Energy: 1.4871371276752137
Energy: 1.5205925431329255
Energy: 1.552847573540111
Energy: 1.5038732470026341
Energy: 1.6289828772731343
Energy: 1.5038732470026341
Energy: 1.4637052782099504
Energy: 1.3345767818266807
Energy: 1.333888601411221
Energy: 1.3345767818254795
Energy: 1.4621598262885034
Energy: 1.3334948012347962
Energy: 1.3346882837445437
Energy: 1.333494801235997
Energy: 1.7158116433392394
Energy: 1.3209767582632919
Energy: 1.3224649090903753
Energy: 1.320976758264493
Energy: 1.633935768444688
Energy: 1.3343397632208478
Energy: 1.335570350309818
Energy: 1.3343397632208478
Energy: 1.6679846714967927
Energy: 1.3344993843108461
Energy: 1.3336264317633635
Energy: 1.3344993843108461
Energy: 1.5549235081709898
Energy: 1.5548835774578573
Energy: 1.7111318110793545
Energy: 1.5548835774578573
Energy: 1.5274399453451302
Energy: 1.52293029136166
Energy: 1.4923761029106788
Energy: 1.52293029136166
Energy: 1.462892708014198
Energy: 1.418682915626838
Energy: 1.47579027016232
Energy: 1.418682915626838
Energy: 1.531022569196399
Energy: 1.470387479789671
Energy: 1.2889454075919762
Energy: 1.470387479789671
Energy: 1.6372022605772074
Energy: 1.5307649101609981
Energy: 1.5687065675701453
Energy: 1.5307649101609981

minimum gb energy = 1.2877730410451935 eV
minimum distance =  2.20240512563686 Angstroms
sigma value = 7


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

Energy: 2.023630740717682
Energy: 1.3312134799494135
Energy: 1.5701724002760613
Energy: 1.5717403095696174
Energy: 1.4759236533150133
Energy: 1.454555206419196
Energy: 1.6370499737204462
Energy: 1.4545552064124012
Energy: 1.3426964320209565
Energy: 1.341595741520674
Energy: 1.4450751268609157
Energy: 1.3415957415223727
Energy: 1.3379374394699464
Energy: 1.3416576920354648
Energy: 1.6490683464427212
Energy: 1.3416576920354648
Energy: 1.3594420183514584
Energy: 1.3909336374005712
Energy: 1.5753730348955528
Energy: 1.3909336373988723
Energy: 1.34133286672997
Energy: 1.3824618744855783
Energy: 1.5793285763149818
Energy: 1.3824618744838795
Energy: 1.6389118538826255
Energy: 1.3581411672878558
Energy: 1.342026963439905
Energy: 1.358141167288705
Energy: 1.636845262289674
Energy: 1.3603477191182007
Energy: 1.3878913424576789
Energy: 1.3603477191198996
Energy: 1.638529954266978
Energy: 1.3432901402278328
Energy: 1.3416291871929886
Energy: 1.343290140228682
Energy: 1.5665239799242343
Energy: 1.343292414978468
Energy: 1.3472876794125495
Energy: 1.3432924149767693
Energy: 1.6486438962628316
Energy: 1.45879269695778
Energy: 1.637572909057819
Energy: 1.45879269695778
Energy: 1.5282195993993721
Energy: 1.5305847496653906
Energy: 1.6398368194605917
Energy: 1.5305847498496172
Energy: 1.4552013490789346
Energy: 1.4652734952118585
Energy: 1.4542134151451942
Energy: 1.4652734952152555
Energy: 1.4530463323886584
Energy: 1.4161000099280354
Energy: 1.323911116331251
Energy: 1.4161000099280354
Energy: 1.5149916718351213
Energy: 1.4627766968407268
Energy: 1.325816389657208
Energy: 1.462776696841576
Energy: 1.6606547235249756
Energy: 1.507760894082093
Energy: 1.5287715748074568
Energy: 1.5077608940829423
Energy: 1.6603898679053433
Energy: 1.4592289271430132
Energy: 1.651343339019599
Energy: 1.4592289271549037
Energy: 1.3471866401954302
Energy: 1.441290044955844
Energy: 1.4437842038078434
Energy: 1.4412900449592414
Energy: 1.338034546678668
Energy: 1.3432554734585038
Energy: 1.6386016858874044
Energy: 1.3432554734593534
Energy: 1.4107703508428535
Energy: 1.3609895629782576
Energy: 1.6612802494709964
Energy: 1.3609895629757096
Energy: 1.3411100133411151
Energy: 1.3491836655993417
Energy: 1.5687498416518546
Energy: 1.3491836655984926
Energy: 1.635616907253608
Energy: 1.3838175558673012
Energy: 1.3415400459164963
Energy: 1.3838175558681503
Energy: 1.6362898720321541
Energy: 1.387377698391059
Energy: 1.3595777738604549
Energy: 1.387377698391059
Energy: 1.6426908033131051
Energy: 1.340993174843392
Energy: 1.3398245104153208
Energy: 1.340993174842543
Energy: 1.5693364401476175
Energy: 1.3418025096253752
Energy: 1.341516311972942
Energy: 1.3418025096262243
Energy: 1.579347859969988
Energy: 1.4545386465288215
Energy: 1.3578971665006758
Energy: 1.4545385459256734
Energy: 1.5699060786186942
Energy: 1.5695886358973465
Energy: 1.7898030568106487
Energy: 1.5695886358947984
Energy: 1.4622578516428157
Energy: 1.4595143379557611
Energy: 1.5318289788467452
Energy: 1.4595143379608573
Energy: 1.4502636155455373
Energy: 1.4185996556867924
Energy: 1.453244963865279
Energy: 1.4185996556842446
Energy: 1.4568802263835285
Energy: 1.4496783946102387
Energy: 1.3313289483713266
Energy: 1.4496783946110883
Energy: 1.6601994418921562
Energy: 1.4567145921130422
Energy: 1.506103844603043
Energy: 1.4567147191778937

minimum gb energy = 1.323911116331251 eV
minimum distance =  2.19878273779544 Angstroms
sigma value = 29


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

Energy: 1.2019175704187963
Energy: 1.2035914977313062
Energy: 1.23618746599661
Energy: 1.5671848318055193
Energy: 1.2052722628906107
Energy: 1.3721374509247701
Energy: 1.3279130314726786
Energy: 1.3721374509244741
Energy: 1.2380706836520432
Energy: 1.3791371587953254
Energy: 1.2085296011281925
Energy: 1.3791371587953254
Energy: 1.2550270857706076
Energy: 1.2264927850925396
Energy: 1.2371877095294628
Energy: 1.2264927850951366
Energy: 1.2270012457480413
Energy: 1.2349206363012533
Energy: 1.2054180261012188
Energy: 1.2349206363029954
Energy: 1.2373891436208
Energy: 1.3738644397243116
Energy: 1.2055299568010482
Energy: 1.3738644397061008
Energy: 1.2110618824285626
Energy: 1.3289371564154555
Energy: 1.2368327812003832
Energy: 1.328937156416606
Energy: 1.3334911598621821
Energy: 1.234559944159281
Energy: 1.2523036278859585
Energy: 1.2345599441578345
Energy: 1.2052054099531582
Energy: 1.2296189578386538
Energy: 1.2374262853081772
Energy: 1.2296189578389498

minimum gb energy = 1.2019175704187963 eV
minimum distance =  2.25748329568501 Angstroms
sigma value = 5


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

Energy: 1.7125712288981945
Energy: 1.292387068701365
Energy: 1.5389885354226516
Energy: 1.3422758281991785
Energy: 1.548154500782479
Energy: 1.2734427812676619
Energy: 1.4654778282900403
Energy: 1.273442781268464
Energy: 1.4646912813460315
Energy: 1.3838259706430631
Energy: 1.459314784530998
Energy: 1.3838259706422604
Energy: 1.3693021257312423
Energy: 1.2715518545892526
Energy: 1.5461523446960401
Energy: 1.2715518545884505
Energy: 1.507200081318283
Energy: 1.3766398873345387
Energy: 1.3820455724236362
Energy: 1.376639886936748
Energy: 1.349623987789212
Energy: 1.292523063490068
Energy: 1.3837050449914658
Energy: 1.292523063492475
Energy: 1.2705521229113734
Energy: 1.2700325651075193
Energy: 1.578003309741427
Energy: 1.2700325651075193
Energy: 1.272906954232256
Energy: 1.2747198307109098
Energy: 1.5365250785953684
Energy: 1.2747198307117122
Energy: 1.5607758120130077
Energy: 1.341045515214604
Energy: 1.5466875147408954
Energy: 1.341045515214604
Energy: 1.520320582542732
Energy: 1.2561264289035936
Energy: 1.265892284132377
Energy: 1.2561264289027911
Energy: 1.6081681593649004
Energy: 1.254417423629153
Energy: 1.2597673063233683
Energy: 1.254417423629955
Energy: 1.538897408963427
Energy: 1.2587988758563835
Energy: 1.2770358673231024
Energy: 1.2587988758668134
Energy: 1.5364522067374164
Energy: 1.2929405958254911
Energy: 1.4920982146993846
Energy: 1.2929405958270956
Energy: 1.5505793690408864
Energy: 1.3468599288988325
Energy: 1.5329494931730152
Energy: 1.346859928897228
Energy: 1.3323066617627226
Energy: 1.2405536897182534
Energy: 1.5340964677289446
Energy: 1.2405536897086262
Energy: 1.337227851277569
Energy: 1.2388750082816886
Energy: 1.2872786381838461
Energy: 1.2388750082808864
Energy: 1.3346392217982141
Energy: 1.32947745064452
Energy: 1.2902272838179885
Energy: 1.3294774506485312
Energy: 1.524220055296462
Energy: 1.2408280873326392
Energy: 1.504235153824303
Energy: 1.2408280873326392
Energy: 1.5180160683447723
Energy: 1.359687040975222
Energy: 1.287737916834018
Energy: 1.359687040980838
Energy: 1.534160636551612
Energy: 1.277466791371549
Energy: 1.3656213046179426
Energy: 1.2774667913771651
Energy: 1.385027163668398
Energy: 1.2838522613573533
Energy: 1.4626910653146523
Energy: 1.2838522613581558
Energy: 1.3833521157506778
Energy: 1.369759347924588
Energy: 1.3633880403637404
Energy: 1.369759347924588
Energy: 1.5978724481196562
Energy: 1.277006811439452
Energy: 1.2796038831853787
Energy: 1.2770068114386497
Energy: 1.5383897287164259
Energy: 1.292164913193772
Energy: 1.2791464353100044
Energy: 1.2921649131921673
Energy: 1.5424083154791264
Energy: 1.2479361521171137
Energy: 1.4954806323012722
Energy: 1.2479361521163115
Energy: 1.2505382393360347
Energy: 1.2520718112571372
Energy: 1.52015267797802
Energy: 1.2520718112579394
Energy: 1.2541269048822032
Energy: 1.2500571990631826
Energy: 1.4262928444674505
Energy: 1.2500571990647873
Energy: 1.2490907357434
Energy: 1.2498830021625336
Energy: 1.2764650966714857
Energy: 1.2498830021641383
Energy: 1.5387878948076674
Energy: 1.5568582768542132
Energy: 1.5349183395950914
Energy: 1.5568582768574222
Energy: 1.5327961898329237
Energy: 1.3382596679786753
Energy: 1.5630293040966887
Energy: 1.3382596679786753
Energy: 1.5324707736341958
Energy: 1.2722498241475064
Energy: 1.2765213077650766
Energy: 1.2722498241450995
Energy: 1.4700848888832125
Energy: 1.2710461419070094
Energy: 1.2759817642786893
Energy: 1.2710461419054049
Energy: 1.3854987311049967
Energy: 1.3737082610402362
Energy: 1.3396115111126359
Energy: 1.3737082610410385

minimum gb energy = 1.2388750082808864 eV
minimum distance =  2.23870181630136 Angstroms
sigma value = 1


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

Energy: 1.6804958236798548
Energy: 1.2132599646864008
Energy: 1.2946343867658041
Energy: 1.2911463746927132
Energy: 1.5546056795530925
Energy: 1.2243208406609427
Energy: 1.4685555535527504
Energy: 1.2243208406598334
Energy: 1.469816444257454
Energy: 1.3666202162100873
Energy: 1.4657506612404378
Energy: 1.3666202162089782
Energy: 1.2420660598714595
Energy: 1.2206589122174925
Energy: 1.6213654092714354
Energy: 1.2206589122163831
Energy: 1.532953347396969
Energy: 1.2862205519455423
Energy: 1.4633797180512562
Energy: 1.2862205519433234
Energy: 1.28675478382667
Energy: 1.2360449747747542
Energy: 1.4624547745346392
Energy: 1.236044974773645
Energy: 1.2183802598210987
Energy: 1.2198520030712157
Energy: 1.6187534678035258
Energy: 1.2198520030712157
Energy: 1.224544557424355
Energy: 1.2265028377685947
Energy: 1.6899918333475774
Energy: 1.2265028377685947
Energy: 1.4713179242438514
Energy: 1.3149524835197175
Energy: 1.6668208481679259
Energy: 1.3149524835174988
Energy: 1.4607550993869798
Energy: 1.2229094943878063
Energy: 1.2234730091477477
Energy: 1.222909494390025
Energy: 1.6232172978702402
Energy: 1.2203380944476698
Energy: 1.2187227407570254
Energy: 1.2203380944476698
Energy: 1.659520924309686
Energy: 1.22313344476828
Energy: 1.285421047538379
Energy: 1.2231334447693893
Energy: 1.6821413188218624
Energy: 1.4656658158891833
Energy: 1.2424696329004152
Energy: 1.4656658158902927
Energy: 1.6269544008973216
Energy: 1.2209771531187177
Energy: 1.4643479828687462
Energy: 1.220977153116499
Energy: 1.2425620392877554
Energy: 1.3653257396515381
Energy: 1.4674833869557877
Energy: 1.3653257396515381
Energy: 1.2420677829220725
Energy: 1.222712750639058
Energy: 1.6295573745599436
Energy: 1.2227127506379487
Energy: 1.3251281887722748
Energy: 1.2357142089719777
Energy: 1.4592029745700457
Energy: 1.2357142089730873
Energy: 1.2340210231423367
Energy: 1.2266127181436348
Energy: 1.6102144036323294
Energy: 1.2266127181491813
Energy: 1.2191989911748906
Energy: 1.2217420095621276
Energy: 1.6677771916745694
Energy: 1.2217420095610185
Energy: 1.2240109787865943
Energy: 1.5076287024144162
Energy: 1.6876121588245518
Energy: 1.5076287024155255
Energy: 1.4586904543732229
Energy: 1.3175773877898052
Energy: 1.623385324649389
Energy: 1.3175773877898052
Energy: 1.4568165622550733
Energy: 1.2237062325507522
Energy: 1.2242278102443813
Energy: 1.2237062325496433
Energy: 1.627233711063359
Energy: 1.2205363187994296
Energy: 1.221081774547286
Energy: 1.2205363187994296
Energy: 1.6822850154323312
Energy: 1.2213785147782026
Energy: 1.220720150149105
Energy: 1.2213785147737655

minimum gb energy = 1.2132599646864008 eV
minimum distance =  2.23846051744938 Angstroms
sigma value = 17


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

Energy: 1.7798919232506658
Energy: 1.2074472079568968
Energy: 1.5136174236811317
Energy: 1.2698502988693963
Energy: 1.2300765726447858
Energy: 1.2171543908962033
Energy: 1.3789590413415072
Energy: 1.2171543908962033
Energy: 1.5125069652983
Energy: 1.2136598835792547
Energy: 1.3749878513039022
Energy: 1.2136598835778833
Energy: 1.5023526234942308
Energy: 1.195783737414558
Energy: 1.29768861561269
Energy: 1.1957837374159292
Energy: 1.3922918844866847
Energy: 1.201952927147852
Energy: 1.621056672156245
Energy: 1.2019529271464806
Energy: 1.2207236013329743
Energy: 1.2177076916829104
Energy: 1.618024758991224
Energy: 1.2177076916815393
Energy: 1.1975348716219223
Energy: 1.1962793646557432
Energy: 1.2960557425963861
Energy: 1.1962793646578005
Energy: 1.2089966603705573
Energy: 1.198726841140339
Energy: 1.74230322788113
Energy: 1.1987268411382819
Energy: 1.626042572985345
Energy: 1.1991715807783259
Energy: 1.6302316914942871
Energy: 1.199171580776269
Energy: 1.3602746472875658
Energy: 1.2963626057815747
Energy: 1.375474076403512
Energy: 1.2963626057760897
Energy: 1.623565453884163
Energy: 1.2145617856829816
Energy: 1.2279932194973107
Energy: 1.2145617856816102
Energy: 1.678735678767337
Energy: 1.21978814512655
Energy: 1.4275265982975753
Energy: 1.2197881451292925
Energy: 1.6176254149013376
Energy: 1.2661099020986142
Energy: 1.264426093191302
Energy: 1.2661099020986142
Energy: 1.2283428361916466
Energy: 1.2148849833452147
Energy: 1.217680898580644
Energy: 1.2148849833445292
Energy: 1.5033538084423705
Energy: 1.217354696728146
Energy: 1.2217545200257518
Energy: 1.2173546967274604
Energy: 1.7326880584929762
Energy: 1.2744939213679893
Energy: 1.5051659068220107
Energy: 1.2744939213679893
Energy: 1.21551229317833
Energy: 1.2222238888653443
Energy: 1.6379700203582548
Energy: 1.2222238888633497
Energy: 1.2190347210652472
Energy: 1.215345658080939
Energy: 1.6796531796741454
Energy: 1.215345658080253
Energy: 1.230781041938867
Energy: 1.217891995843946
Energy: 1.6271656757502764
Energy: 1.2178919958446315
Energy: 1.226622919099542
Energy: 1.3803726261935547
Energy: 1.7796350304450017
Energy: 1.3803726252271815
Energy: 1.3767611864598812
Energy: 1.217001011778444
Energy: 1.2149040791979648
Energy: 1.2170010117770726
Energy: 1.3748188355511435
Energy: 1.2147716312869015
Energy: 1.5096429574041659
Energy: 1.214771631262904
Energy: 1.2946461867244599
Energy: 1.1959152085144769
Energy: 1.5057148651785337
Energy: 1.1959152085151623
Energy: 1.6179458104509692
Energy: 1.4911943941117642
Energy: 1.3879337288927807
Energy: 1.4911943941076504
Energy: 1.6190043433122432
Energy: 1.2022166525984577
Energy: 1.2174115501383445
Energy: 1.2022166525970863
Energy: 1.301565118482708
Energy: 1.197257591358828
Energy: 1.2022641543870107
Energy: 1.1972575913574568
Energy: 1.7817165370700137
Energy: 1.2003562040803826
Energy: 1.2065785840252599
Energy: 1.2003562040824394
Energy: 1.6263441873977245
Energy: 1.1985984932919973
Energy: 1.6220749890999777
Energy: 1.1985984932919973
Energy: 1.3827214805682708
Energy: 1.297145341459168
Energy: 1.363250539758515
Energy: 1.297145341459168
Energy: 1.2306867344207157
Energy: 1.2132403010184725
Energy: 1.672612486024654
Energy: 1.2132403010171011
Energy: 1.4335461258841897
Energy: 1.2640991397305275
Energy: 1.616860058389246
Energy: 1.2640991397318988
Energy: 1.2692817923994915
Energy: 1.281042987663433
Energy: 1.6162756123690198
Energy: 1.2810429876641187
Energy: 1.214489605712147
Energy: 1.2134540959512043
Energy: 1.2183321454020197
Energy: 1.2134540959505191
Energy: 1.22675658585431
Energy: 1.2168672650516759
Energy: 1.4977920027887872
Energy: 1.2168672650509904
Energy: 1.6761963016704182
Energy: 1.2724488423578284
Energy: 1.7288414962568686
Energy: 1.2724488423578284
Energy: 1.6372963398447058
Energy: 1.2199871268957878
Energy: 1.215675304052603
Energy: 1.2199871268944165
Energy: 1.6772632923604134
Energy: 1.2146828391870927
Energy: 1.2155774168824325
Energy: 1.2146828391864073
Energy: 1.5108094703202146
Energy: 1.2196162905163792
Energy: 1.2846140062395606
Energy: 1.2196162905163792

minimum gb energy = 1.195783737414558 eV
minimum distance =  2.23996776902847 Angstroms
sigma value = 89


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

Energy: 1.8510597087214378
Energy: 1.1752618013420473
Energy: 1.1239565002923289
Energy: 1.1278664980665327
Energy: 1.112427315777003
Energy: 1.124744528418294
Energy: 1.2205622912793495
Energy: 1.124744528418294
Energy: 1.1124973984772835
Energy: 1.252626026517559
Energy: 1.2205611669669585
Energy: 1.2526260265157652
Energy: 1.114804027638287
Energy: 1.254154485644368
Energy: 1.2198312989594176
Energy: 1.254154485644368
Energy: 1.2172925893121158
Energy: 1.125748364015907
Energy: 1.4199780209165123
Energy: 1.125748364017701
Energy: 1.1256171937204713
Energy: 1.1251107256325035
Energy: 1.4176193915085356
Energy: 1.1251107256325035
Energy: 1.122536144624141
Energy: 1.1220088465518518
Energy: 1.2211082147696108
Energy: 1.1220088465518518
Energy: 1.1267532280964887
Energy: 1.1272842722114194
Energy: 1.1121718176250233
Energy: 1.1272842722132133
Energy: 1.1549490590038884
Energy: 1.2527028259726576
Energy: 1.1109083428342623
Energy: 1.2527028259708637
Energy: 1.2238703554589907
Energy: 1.2539488153642795
Energy: 1.219974636826612
Energy: 1.2539488153642795
Energy: 1.2236097133698138
Energy: 1.2528639055617803
Energy: 1.1104512603352872
Energy: 1.2528639055617803
Energy: 1.4173979805108152
Energy: 1.1263275552230108
Energy: 1.2210795255047984
Energy: 1.1263275552230108
Energy: 1.4211619043058483
Energy: 1.1252089664966722
Energy: 1.126100766059084
Energy: 1.1252089664966722
Energy: 1.2187448661897917
Energy: 1.1217943424149022
Energy: 1.1209052411229428
Energy: 1.121794342416655
Energy: 1.1120614935600939
Energy: 1.1256878046902894
Energy: 1.1254971668837934
Energy: 1.1256878046902894

minimum gb energy = 1.1104512603352872 eV
minimum distance =  2.26349028662121 Angstroms
sigma value = 13


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

Energy: 1.6604155793245685
Energy: 1.0974332352071527
Energy: 1.4269466304035605
Energy: 1.0774914396331878
Energy: 1.6156136846803282
Energy: 1.074813654600085
Energy: 1.2317981422984625
Energy: 1.0748136546015892
Energy: 1.6173038021016808
Energy: 1.0738938595607033
Energy: 1.2260380789911391
Energy: 1.0738938595629592
Energy: 1.3496116314833149
Energy: 1.4906074350174174
Energy: 1.4527072220546806
Energy: 1.4906074350497502
Energy: 1.5207903936694906
Energy: 1.2824139664445635
Energy: 1.4908224159623324
Energy: 1.2824139664460674
Energy: 1.2368507042587298
Energy: 1.0755328023503319
Energy: 1.5020804572892157
Energy: 1.0755328023488282
Energy: 1.2226374954170594
Energy: 1.0747985185098956
Energy: 1.50470058986389
Energy: 1.0747985185113995
Energy: 1.2405015001599753
Energy: 1.2397331837022965
Energy: 1.5168766587537597
Energy: 1.2397331837015444
Energy: 1.0841384661800648
Energy: 1.077464443202391
Energy: 1.5215621580512404
Energy: 1.0774644432017075
Energy: 1.0749561570897619
Energy: 1.0747609914345706
Energy: 1.5259043924333768
Energy: 1.0747609914383303
Energy: 1.0740199626933038
Energy: 1.0848416041523914
Energy: 1.6600732576499742
Energy: 1.0848416041531432
Energy: 1.5034673358039887
Energy: 1.0754211642521818
Energy: 1.5255598146274851
Energy: 1.075421164250678
Energy: 1.4943850888475658
Energy: 1.1483391869647257
Energy: 1.5056397352041655
Energy: 1.1483391869654778
Energy: 1.499734338964095
Energy: 1.0735264572286298
Energy: 1.3540272871030403
Energy: 1.073526457227878
Energy: 1.517026310231491
Energy: 1.078957829609765
Energy: 1.4534257208466128
Energy: 1.0789578296105171
Energy: 1.5208922286169795
Energy: 1.0769268240633574
Energy: 1.0744929266501944
Energy: 1.0769268240633574
Energy: 1.509738971133712
Energy: 1.0750536759729266
Energy: 1.0748332575985553
Energy: 1.075053675975934
Energy: 1.6578490769897722
Energy: 1.0763701740447478
Energy: 1.0838484581137144
Energy: 1.0763701740402363
Energy: 1.3642501734259307
Energy: 1.0766562451440647
Energy: 1.2592020635101404
Energy: 1.0766562451448165
Energy: 1.526027467389621
Energy: 1.0731827952754016
Energy: 1.2174366655002686
Energy: 1.0731827952738977
Energy: 1.34517037481578
Energy: 1.0818068626840827
Energy: 1.2697435670574737
Energy: 1.0818068626810748
Energy: 1.5245303308225897
Energy: 1.164017355335729
Energy: 1.4913245022526096
Energy: 1.1640173553319693
Energy: 1.2415144532924909
Energy: 1.0762581051834257
Energy: 1.4910293791223068
Energy: 1.076258105187937
Energy: 1.0806968899842637
Energy: 1.0729209627716176
Energy: 1.5133356677673322
Energy: 1.0729209627716176
Energy: 1.2443030570991769
Energy: 1.098820618713775
Energy: 1.513669538177939
Energy: 1.0988206187190386
Energy: 1.1010485628598852
Energy: 1.0814487521547531
Energy: 1.5083110099045518
Energy: 1.0814487521532494
Energy: 1.0742284091702317
Energy: 1.0728136432107274
Energy: 1.5213873568072602
Energy: 1.0728136432092235
Energy: 1.074166366474307
Energy: 1.0793670636402377
Energy: 1.615831071716168
Energy: 1.0793670636394856
Energy: 1.5036990839238205
Energy: 1.0760526569372058
Energy: 1.3686398404814875
Energy: 1.0760526569372058
Energy: 1.21398184874031
Energy: 1.1534357880636177
Energy: 1.5100188083507056
Energy: 1.1534357880628656
Energy: 1.508524282321799
Energy: 1.1601784520075888
Energy: 1.3479974787435112
Energy: 1.1601784520075888
Energy: 1.519145181781667
Energy: 1.0759456248340986
Energy: 1.5064495423029758
Energy: 1.0759456248340986
Energy: 1.518608616821387
Energy: 1.0808194880572919
Energy: 1.0746235503334185
Energy: 1.080819488054284
Energy: 1.5166266878852568
Energy: 1.0728250624327569
Energy: 1.074490275423297
Energy: 1.0728250624320048
Energy: 1.3520858062821701
Energy: 1.1019694222109941
Energy: 1.0798851810032166
Energy: 1.1019694222132501

minimum gb energy = 1.0728136432092235 eV
minimum distance =  2.25167401573567 Angstroms
sigma value = 37


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

Energy: 1.4530944785322453
Energy: 1.0581634762550076
Energy: 0.9893933186296786
Energy: 0.9888904178496914
Energy: 1.460292632309687
Energy: 0.9875866036736737
Energy: 1.2367986390484018
Energy: 0.9875866036736737
Energy: 1.4715306803919268
Energy: 0.9859315941100875
Energy: 1.2342043821712383
Energy: 0.9859315941100875
Energy: 1.4652103649188228
Energy: 1.122612869612846
Energy: 1.2404866819817737
Energy: 1.122612869612846
Energy: 1.4794208175456733
Energy: 1.1238506930791328
Energy: 1.2223442206935415
Energy: 1.1238506930791328
Energy: 1.242250475464126
Energy: 0.9860114711960035
Energy: 1.2643403906043014
Energy: 0.9860114711972972
Energy: 0.979453373802634
Energy: 0.9851953199038316
Energy: 1.4895997104402572
Energy: 0.9851953199038316
Energy: 1.03767458051444
Energy: 0.9860270759187323
Energy: 1.4934346441801787
Energy: 0.9860270759174385
Energy: 0.9874348153572244
Energy: 0.9909203936799025
Energy: 1.4764622133515302
Energy: 0.9909203936811962
Energy: 0.9872021512561049
Energy: 0.9878817261124277
Energy: 1.488562638645779
Energy: 0.9878817261124277
Energy: 0.9893933195180382
Energy: 0.9888904169897923
Energy: 1.4530944785309516
Energy: 1.0581634762550076
Energy: 1.2367986390484018
Energy: 0.9875866036749672
Energy: 1.4602926323083933
Energy: 0.9875866036736737
Energy: 1.2342043821699447
Energy: 0.9859315941113811
Energy: 1.4715306803919268
Energy: 0.9859315941113811
Energy: 1.2404866819817737
Energy: 1.1226128696115523
Energy: 1.4652103649188228
Energy: 1.1226128696115523
Energy: 1.2223442206948352
Energy: 1.1238506930791328
Energy: 1.4794208175456733
Energy: 1.1238506930791328
Energy: 1.2643403904931056
Energy: 0.9860114711985908
Energy: 1.2422504754654193
Energy: 0.9860114711960035
Energy: 1.4895997104415508
Energy: 0.9851953199038316
Energy: 0.9794533738039276
Energy: 0.9851953199051252
Energy: 1.4934346441814725
Energy: 0.9860270759187323
Energy: 1.03767458051444
Energy: 0.9860270759174385
Energy: 1.476462213336036
Energy: 0.9909203936811962
Energy: 0.9874348153585181
Energy: 0.9909203936824899
Energy: 1.488562638645779
Energy: 0.9878817261137215
Energy: 0.9872021512561049
Energy: 0.9878817261124277

minimum gb energy = 0.979453373802634 eV
minimum distance =  2.26239248581898 Angstroms
sigma value = 25


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

Energy: 1.7076146293254852
Energy: 0.9519759270854772
Energy: 0.8868825177712326
Energy: 0.8862773875020714
Energy: 1.6011386442041846
Energy: 0.8868923900435488
Energy: 1.0647691213038994
Energy: 0.8868923900445591
Energy: 1.6123112257583552
Energy: 0.8854738348825603
Energy: 1.071115923606582
Energy: 0.8854738348825603
Energy: 1.2378098262035109
Energy: 0.8910979820013665
Energy: 1.284641208631122
Energy: 0.8910979820013665
Energy: 1.6104598261898837
Energy: 0.9940918401057784
Energy: 1.438739466509022
Energy: 0.9940918401077988
Energy: 1.2777976234831974
Energy: 0.9931017768955754
Energy: 1.4509557501533987
Energy: 0.9931017768955754
Energy: 1.2469574886087933
Energy: 0.9943447789354345
Energy: 1.6114673851257886
Energy: 0.9943447789354345
Energy: 1.2839269013738321
Energy: 1.089487381052658
Energy: 1.4350116340839576
Energy: 1.0894873810516477
Energy: 1.0772264263021494
Energy: 0.8853539679016185
Energy: 1.6195260547194212
Energy: 0.8853539679016185
Energy: 1.0633911684220327
Energy: 0.8864390471315722
Energy: 1.6160635333770748
Energy: 0.8864390471325823
Energy: 0.8846147635103487
Energy: 0.8851119053129772
Energy: 1.4697477479804268
Energy: 0.8851119053099468
Energy: 0.8921432361462377
Energy: 0.886367919736363
Energy: 1.6162177078161637
Energy: 0.886367919736363
Energy: 0.8858660503405849
Energy: 0.8889739774006687
Energy: 1.6022171079035537
Energy: 0.8889739774006687
Energy: 1.0724450796370046
Energy: 1.090266889902046
Energy: 1.5960437624331691
Energy: 1.0902668899040666
Energy: 1.068737403753784
Energy: 0.8848958570770749
Energy: 1.612700569024789
Energy: 0.8848958570770749
Energy: 1.0647637358391204
Energy: 0.8878776498634019
Energy: 1.6164194133150187
Energy: 0.8878776498634019
Energy: 1.4405238923623522
Energy: 0.8874424624278213
Energy: 1.6116186273285829
Energy: 0.8874424624288314
Energy: 1.0604935388357775
Energy: 0.9943462843417478
Energy: 1.4423119896331522
Energy: 0.9943462843417478
Energy: 1.439426128255908
Energy: 0.9947722496673483
Energy: 1.2487748600203867
Energy: 0.9947722496683584
Energy: 1.6185401001214461
Energy: 0.9929314637112505
Energy: 1.253033002673183
Energy: 0.9929314637183216
Energy: 1.4726419295988322
Energy: 0.8849698730644442
Energy: 1.080375195018461
Energy: 0.8849698730644442
Energy: 1.6210591791378608
Energy: 0.8844648936321765
Energy: 0.8861255821135725
Energy: 0.8844648936321765
Energy: 1.6062379351681388
Energy: 0.8891387206238872
Energy: 1.0795354794610927
Energy: 0.8891387206238872
Energy: 1.4356744137934283
Energy: 0.8853127058283652
Energy: 0.8859142226656098
Energy: 0.8853127058283652
Energy: 1.6125576736856932
Energy: 0.8845121181081238
Energy: 0.8861314311669334
Energy: 0.8845121181081238
Energy: 1.595912524045044
Energy: 0.8855584743358786
Energy: 0.8859929776792971
Energy: 0.8855584743368888

minimum gb energy = 0.8844648936321765 eV
minimum distance =  2.25605685835255 Angstroms
sigma value = 41


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

Energy: 1.8685417650222251
Energy: 0.867236702424327
Energy: 0.8153419491825653
Energy: 0.8080958427520176
Energy: 1.7120005425965032
Energy: 0.8090663254738246
Energy: 0.9598275978038109
Energy: 0.8090663254729965
Energy: 1.7047357769044988
Energy: 0.8088424594540775
Energy: 0.957072808529999
Energy: 0.8088424594540775
Energy: 1.4373677684810462
Energy: 0.8160981438154454
Energy: 1.2696528708232937
Energy: 0.8160981438154454
Energy: 1.7009667846809446
Energy: 0.8071599847247017
Energy: 1.2670330036058506
Energy: 0.8071599847247017
Energy: 1.4281771548578335
Energy: 0.8095721288486021
Energy: 1.2847125198281726
Energy: 0.8095721288502584
Energy: 1.4354610930416023
Energy: 0.902538625457747
Energy: 1.562385931224723
Energy: 0.9025386254569188
Energy: 1.4338450072552562
Energy: 0.9084522316681891
Energy: 1.2652791704458777
Energy: 0.9084522316690173
Energy: 1.0993159799872494
Energy: 0.8090009236426208
Energy: 1.5682659024571963
Energy: 0.809000923643449
Energy: 1.1014535184267737
Energy: 0.8076379333630157
Energy: 1.7085182451298149
Energy: 0.8076379333663284
Energy: 0.9618656298875569
Energy: 0.819942632190833
Energy: 1.56751876122343
Energy: 0.819942632190833
Energy: 0.9515265198091507
Energy: 0.8080600211989714
Energy: 1.7078582778081866
Energy: 0.8080600211989714
Energy: 0.9690521983769879
Energy: 0.811520355666633
Energy: 1.6991156955124196
Energy: 0.8115203556674613
Energy: 0.8096337982988357
Energy: 0.8088480018382187
Energy: 1.5618918106125235
Energy: 0.8088480018415314
Energy: 0.8115000618729895
Energy: 0.8091543760886534
Energy: 1.7023074325844252
Energy: 0.8091543760894815
Energy: 0.8178577821039865
Energy: 0.8148741016672368
Energy: 1.7047850639357183
Energy: 0.8148741016664086
Energy: 0.958258236294482
Energy: 0.8140977094893523
Energy: 1.6908867510152576
Energy: 0.8140977094901806
Energy: 0.9501746038393648
Energy: 0.8071733198484923
Energy: 1.7016034168595187
Energy: 0.8071733198484923
Energy: 0.9505723299475743
Energy: 0.812982608568049
Energy: 1.4310433201517305
Energy: 0.812982608568049
Energy: 1.2745374054840044
Energy: 0.8110249895391908
Energy: 1.428568183818828
Energy: 0.8110249895383627
Energy: 1.2769180259704236
Energy: 0.8081575778716815
Energy: 1.5643890398050146
Energy: 0.8081575778758224
Energy: 1.2724226853348486
Energy: 0.8997304654983561
Energy: 1.4368156767275697
Energy: 0.8997304654983561
Energy: 1.5682801461066598
Energy: 0.8970200499524993
Energy: 1.426990141492204
Energy: 0.897020049950843
Energy: 1.2648513521844036
Energy: 0.900695639466514
Energy: 1.2900703725145861
Energy: 0.9006956394673422
Energy: 1.5662340716577103
Energy: 0.8085329079600142
Energy: 1.0894353801039576
Energy: 0.8085329079608424
Energy: 1.5706735205379838
Energy: 0.8108403111637652
Energy: 1.2847845229086476
Energy: 0.8108403111637652
Energy: 1.5751186963216837
Energy: 0.8135492856103291
Energy: 0.9514864968839346
Energy: 0.8135492856095009
Energy: 1.7012757442307063
Energy: 0.80786825313609
Energy: 0.9553063030736522
Energy: 0.8078682531369182
Energy: 1.5705137361458288
Energy: 0.8180144333936707
Energy: 0.9618659142090439
Energy: 0.8180144333936707
Energy: 1.5657892975403185
Energy: 0.8151730837373643
Energy: 0.8087383405508947
Energy: 0.8151730837373643
Energy: 1.703444829329115
Energy: 0.8086904677223679
Energy: 0.8106536522585609
Energy: 0.808690467723196
Energy: 1.6978649510110129
Energy: 0.8169901690412085
Energy: 0.8092593929073386
Energy: 0.8169901690428648

minimum gb energy = 0.8071599847247017 eV
minimum distance =  2.25594968593129 Angstroms
sigma value = 15


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

Energy: 1.6212549281899127
Energy: 0.7997121635955283
Energy: 0.7559105375566949
Energy: 0.7563572011156314
Energy: 1.77110982366878
Energy: 0.7509613964601954
Energy: 0.8736205679107925
Energy: 0.750961396460897
Energy: 1.768262190298339
Energy: 0.7502882696227676
Energy: 0.8764959634400666
Energy: 0.7502882696213645
Energy: 1.5434151786747756
Energy: 0.7563939251867177
Energy: 1.1414155789796476
Energy: 0.7563939251649685
Energy: 1.7604300087791924
Energy: 0.7482162110720257
Energy: 1.1379862526415299
Energy: 0.7482162110720257
Energy: 1.5317205850122837
Energy: 0.7478851201624838
Energy: 1.1581391769209972
Energy: 0.7478851201982007
Energy: 1.2830933488797152
Energy: 0.7478921666734952
Energy: 1.4094602533978504
Energy: 0.7478921666720921
Energy: 1.5347024522682822
Energy: 0.8239771667199822
Energy: 1.1352229485586138
Energy: 0.8239771667129664
Energy: 1.2817953277930263
Energy: 0.8232028877836409
Energy: 1.4067510749550776
Energy: 0.8232028877829394
Energy: 1.283157776719837
Energy: 1.037483073130407
Energy: 1.6455509762100609
Energy: 1.0374830731283022
Energy: 1.1434567195835525
Energy: 0.7524089968138777
Energy: 1.454544968992911
Energy: 0.7524089968159824
Energy: 0.9856183168808723
Energy: 0.7464589087612795
Energy: 1.6467971530008727
Energy: 0.7464589087619811
Energy: 1.1397653349045793
Energy: 0.7502372880988932
Energy: 1.6475618565001313
Energy: 0.750237288099595
Energy: 0.8805530956025203
Energy: 0.7552803769640616
Energy: 1.415120472296772
Energy: 0.7552803769633598
Energy: 0.8672260798517488
Energy: 0.7477888351487779
Energy: 1.7612868820605123
Energy: 0.747788835150181
Energy: 0.8897671676446905
Energy: 0.752891928185775
Energy: 1.649253726832801
Energy: 0.7528919281850734
Energy: 0.7479555945366905
Energy: 0.7575876905270277
Energy: 1.6543803333482132
Energy: 0.7575876905256244
Energy: 0.7474049417615474
Energy: 0.7483760461855029
Energy: 1.7615372367267157
Energy: 0.7483760461869059
Energy: 0.7633227938906394
Energy: 0.7565288077567718
Energy: 1.5347649800051277
Energy: 0.7565288077588764
Energy: 0.8864329725285662
Energy: 0.7537881014260202
Energy: 1.7674262954544253
Energy: 0.7537881014287627
Energy: 0.8637329816063839
Energy: 0.7473567305061756
Energy: 1.7627821009768554
Energy: 0.7473567305047725
Energy: 0.8771621168993566
Energy: 0.7552093737703911
Energy: 1.5410358311787529
Energy: 0.7552093737703911
Energy: 1.1402253593078215
Energy: 0.7500377655576083
Energy: 1.527961588619394
Energy: 0.750037765559713
Energy: 1.1370709040118785
Energy: 0.7464826565866371
Energy: 1.6470789583337349
Energy: 0.7464826565859355
Energy: 1.154478560065425
Energy: 0.7519535695628635
Energy: 1.2882725560607886
Energy: 0.7519535695663714
Energy: 1.409079297512905
Energy: 1.036964775990347
Energy: 1.6474709553133366
Energy: 1.0369647759896452
Energy: 1.1366484272918211
Energy: 0.8240914541200481
Energy: 1.406714414051828
Energy: 0.8240914541207497
Energy: 1.4161066578817951
Energy: 0.8245516877324314
Energy: 1.2897713661681809
Energy: 0.824551687728222
Energy: 1.4106975936532096
Energy: 0.7486106346050564
Energy: 1.4096564272649688
Energy: 0.7486106346029517
Energy: 1.4085377974749256
Energy: 0.7481773607400498
Energy: 1.1392921450166593
Energy: 0.7481773607393483
Energy: 1.6545979218669413
Energy: 0.7484091132596858
Energy: 0.9857898320291448
Energy: 0.7484091132603873
Energy: 1.413425364260484
Energy: 0.7548544957628237
Energy: 1.1567186911078042
Energy: 0.7548544957621222
Energy: 1.6486724470603726
Energy: 0.7514982372901201
Energy: 0.8742746924664445
Energy: 0.7514982372908217
Energy: 1.7685364196420033
Energy: 0.7507517246663056
Energy: 0.8719668721754763
Energy: 0.7507517246663056
Energy: 1.6401053484356303
Energy: 0.8900307889041524
Energy: 0.8762208654719178
Energy: 0.8900307889104666
Energy: 1.765103767130459
Energy: 0.7500353265110817
Energy: 0.7544180196912627
Energy: 0.7500353265110817
Energy: 1.7620250120166405
Energy: 0.7506165273365499
Energy: 0.7559856018993608
Energy: 0.7506165273358483

minimum gb energy = 0.7464589087612795 eV
minimum distance =  2.26473323126011 Angstroms
sigma value = 85


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

Energy: 1.7223485862933243
Energy: 0.7635816632588923
Energy: 0.6780595945914893
Energy: 0.6784701137384832
Energy: 1.785880633228187
Energy: 0.680955366016284
Energy: 0.7799688083089609
Energy: 0.6809553660181095
Energy: 1.5849065191125546
Energy: 0.6806116382173493
Energy: 0.7798157551845417
Energy: 0.6806116382173493
Energy: 1.3682554441419328
Energy: 0.6784735767122284
Energy: 1.0266850973341923
Energy: 0.6784735767097946
Energy: 1.6892250880888928
Energy: 0.6781697071508378
Energy: 1.0192720274568783
Energy: 0.6781697071514462
Energy: 1.3672411439472234
Energy: 0.6788790277861593
Energy: 1.0236568299405286
Energy: 0.6788790277861593
Energy: 1.3721829469655102
Energy: 0.6790794523930036
Energy: 1.2630828629621444
Energy: 0.679079452393612
Energy: 1.481454909016842
Energy: 0.6795319253251533
Energy: 1.0121555745802668
Energy: 0.6795319253251533
Energy: 1.372717749905764
Energy: 0.6787972995437999
Energy: 1.2662160390831427
Energy: 0.6787972995559696
Energy: 1.3715845219901468
Energy: 0.8065973012105967
Energy: 1.4819240390556772
Energy: 0.8065973012105967
Energy: 1.2623397139696333
Energy: 0.8058236791265267
Energy: 1.286385657838006
Energy: 0.8058236791259182
Energy: 1.148265472183441
Energy: 0.6789149956150328
Energy: 1.4828531726774674
Energy: 0.6789149956132072
Energy: 1.263533955656766
Energy: 0.6790496252508077
Energy: 1.478861591389313
Energy: 0.6790496252520246
Energy: 1.02604043087731
Energy: 0.679839130711866
Energy: 1.2603818235513249
Energy: 0.6798391307130829
Energy: 0.8806189765226516
Energy: 0.678172281211815
Energy: 1.6901443255428743
Energy: 0.678172281211815
Energy: 1.0278860454551084
Energy: 0.6822702676001814
Energy: 1.478325795048721
Energy: 0.6822702676001814
Energy: 0.7902905795241064
Energy: 0.6784568438718862
Energy: 1.474933009820698
Energy: 0.6784568438712779
Energy: 0.7799027011961173
Energy: 0.6782106465437099
Energy: 1.792551992573425
Energy: 0.6782106465431015
Energy: 0.7900517465073382
Energy: 0.6787897385498298
Energy: 1.6839335957543164
Energy: 0.6787897385498298
Energy: 0.6787632474737776
Energy: 0.6788375534954122
Energy: 1.6814867665735713
Energy: 0.6788375534948037
Energy: 0.6797268831202274
Energy: 0.6789971998077373
Energy: 1.7944582701994987
Energy: 0.6789971998077373
Energy: 0.6787534177278748
Energy: 0.6790847725685238
Energy: 1.5819956929675465
Energy: 0.6790847725685238
Energy: 0.7807295632209826
Energy: 0.6786121993788516
Energy: 1.7808021894629105
Energy: 0.6786121993788516
Energy: 0.783379024173894
Energy: 0.6785405359414742
Energy: 1.7964379704771256
Energy: 0.6785405359414742
Energy: 0.7904844785923193
Energy: 0.6786980654928646
Energy: 1.3675230138554983
Energy: 0.678698065497124
Energy: 1.0250539904734457
Energy: 0.6791087579621147
Energy: 1.7941295263380557
Energy: 0.6791087579627231
Energy: 1.0205203173136461
Energy: 0.6780566885293482
Energy: 1.5871299242598165
Energy: 0.6780566885287398
Energy: 1.26415785988882
Energy: 0.6794281816058974
Energy: 1.3686219216969964
Energy: 0.6794281816052887
Energy: 1.2639292921603844
Energy: 0.6795576435424711
Energy: 1.5969516706673734
Energy: 0.6795576435424711
Energy: 1.2628152937161405
Energy: 0.6795416268916938
Energy: 1.3710306758176047
Energy: 0.6795416268910854
Energy: 1.4812382400345658
Energy: 0.8070259644507529
Energy: 1.143288330649535
Energy: 0.8070259644501444
Energy: 1.262366228514661
Energy: 0.8067753155801375
Energy: 1.4824396245347993
Energy: 0.8067753155801375
Energy: 1.4818534734941218
Energy: 0.6790044093936457
Energy: 1.1481847421883047
Energy: 0.6790044093899947
Energy: 1.6886180407759925
Energy: 0.6794586001819624
Energy: 1.1475880611461318
Energy: 0.6794586001807453
Energy: 1.281875522170353
Energy: 0.6801558297196174
Energy: 1.1820234500664564
Energy: 0.680155829720226
Energy: 1.6917337033993263
Energy: 0.6782431422293896
Energy: 1.0199277528951753
Energy: 0.6782431422287812
Energy: 1.6904964756305638
Energy: 0.6797500956580985
Energy: 1.023044504816053
Energy: 0.6797500956580985
Energy: 1.4825532781999748
Energy: 0.6785532152336589
Energy: 0.79026645980391
Energy: 0.6785532152330503
Energy: 1.7955356101295223
Energy: 0.6783746727830691
Energy: 0.7819406430638715
Energy: 0.6783746727830691
Energy: 1.681059517138911
Energy: 0.6788002367715004
Energy: 0.7895881394300182
Energy: 0.6788002367715004
Energy: 1.473020057272269
Energy: 0.6786208336469463
Energy: 0.6790879928379401
Energy: 0.6786208336475548
Energy: 1.7923879764419914
Energy: 0.6792586632676403
Energy: 0.6790616919304836
Energy: 0.6792586632682488
Energy: 1.5773097029354608
Energy: 0.6791534525490511
Energy: 0.6785699597219181
Energy: 0.6791534525484427

minimum gb energy = 0.6780566885287398 eV
minimum distance =  2.26091904294869 Angstroms
sigma value = 113


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

Energy: 0.02048221777649421
Energy: 0.02150231195084072
Energy: 1.3896189482716121
Energy: 0.6203576367927531
Energy: 0.02272509373412783
Energy: 0.1729252530590172
Energy: 0.9400618803910643
Energy: 0.17292525305854944
Energy: 0.021191895481240997
Energy: 0.1705808812737255
Energy: 0.9372727448839655
Energy: 0.1705808812737255
Energy: 0.023043349350086166
Energy: 0.1700175773612182
Energy: 0.9332320469541002
Energy: 0.1700175773612182
Energy: 0.9361196611623208
Energy: 0.171239937529087
Energy: 0.9379715922946464
Energy: 0.17123993752955477
Energy: 0.021094979323428246
Energy: 0.17011392851249654
Energy: 0.9365682572538014
Energy: 0.17011392851343213

minimum gb energy = 0.02048221777649421 eV
minimum distance =  2.4569441025962 Angstroms
sigma value = 1