Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987v2_Ni__MO_769632475533_000
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=3.524220451712608
cohesive_energy=4.459348122777618
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018154903389818636
Energy: 0.01861719225322265
Energy: 0.018826571300285835
Energy: 0.018617192252562705
Energy: 0.01861719225322265
Energy: 0.8705116480414926
Energy: 0.018617192252562705
Energy: 0.8705116480414926
Energy: 0.018826571300285835
Energy: 0.01861719225322265
Energy: 0.018154903389818636
Energy: 0.01861719225322265
Energy: 0.01861719225322265
Energy: 0.8705116480414926
Energy: 0.01861719225322265
Energy: 0.8705116480414926

minimum gb energy = 0.018154903389818636 eV
minimum distance =  2.42656299966707 Angstroms
sigma value = 1


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

Energy: 1.2068705630625918
Energy: 1.3626197138386738
Energy: 1.2794559087368893
Energy: 1.3626197138354723
Energy: 1.2248683351537037
Energy: 1.4018707505735577
Energy: 1.2437484789235937
Energy: 1.4018707505767591
Energy: 1.166970923467754
Energy: 1.377738197009834
Energy: 1.2056502663623372
Energy: 1.3777381970090334
Energy: 1.1986198654948892
Energy: 1.3505220323747322
Energy: 1.2032492714225653
Energy: 1.3505220323747322
Energy: 1.199808556715
Energy: 1.4047791269991412
Energy: 1.1559933179459592
Energy: 1.4047791269991412
Energy: 1.1655260546204917
Energy: 1.2161760819132073
Energy: 1.1137876024466125
Energy: 1.216176081942821
Energy: 1.1955351370488836
Energy: 1.3935074831377763
Energy: 1.1567269005766116
Energy: 1.3935074831385768
Energy: 1.121370883974507
Energy: 1.3730476911189227
Energy: 1.1334270999262512
Energy: 1.3730476911181222
Energy: 1.1805637160573372
Energy: 1.3611371617726178
Energy: 1.2809342460898885
Energy: 1.3611371617718173
Energy: 1.1156589009036608
Energy: 1.4033328355813737
Energy: 1.1347610139218782
Energy: 1.4033328355789725
Energy: 1.276173632415397
Energy: 1.3875001841608006
Energy: 1.1801737438511206
Energy: 1.3875001841608006
Energy: 1.2741680779120552
Energy: 1.3727169887750654
Energy: 1.108909680694203
Energy: 1.372716988774265
Energy: 1.1947600655127895
Energy: 1.410912434595428
Energy: 1.2221764555327173
Energy: 1.410912434593827
Energy: 1.2001509553975724
Energy: 1.3226564328796655
Energy: 1.1553978906759406
Energy: 1.3226564328812664
Energy: 1.2165341273977097
Energy: 1.381875574145
Energy: 1.3663340524516723
Energy: 1.381875574145
Energy: 1.22661759305838
Energy: 1.4070647250550987
Energy: 1.320293810397902
Energy: 1.407064725055899
Energy: 1.194958167722118
Energy: 1.3793762795805948
Energy: 1.1499943473234444
Energy: 1.3793762795797944
Energy: 1.2420223718262622
Energy: 1.394117831770602
Energy: 1.2575343826036445
Energy: 1.394117831770602
Energy: 1.1984791394056877
Energy: 1.3878805078335157
Energy: 1.1073418694533816
Energy: 1.3878805078335157
Energy: 1.280500509532
Energy: 1.1995442248260184
Energy: 1.181810085638119
Energy: 1.199544224825218
Energy: 1.120514457451302
Energy: 1.3908388782505277
Energy: 1.1224042713659734
Energy: 1.3908388782529286
Energy: 1.1815467938656965
Energy: 1.3543571890306292
Energy: 1.2810086913188379
Energy: 1.3543571890322301
Energy: 1.1556490957083818
Energy: 1.3738313994843296
Energy: 1.1640438664784831
Energy: 1.373831399482729
Energy: 1.1162592485972955
Energy: 1.3978620572061657
Energy: 1.1626453376493124
Energy: 1.3978620572101677
Energy: 1.1612051712331222
Energy: 1.3393338072856091
Energy: 1.1961605972290426
Energy: 1.3393338072872099
Energy: 1.2358449761645327
Energy: 1.4235432134114823
Energy: 1.1947987809275256
Energy: 1.4235432134122825
Energy: 1.2285512758038468
Energy: 1.3956319625213984
Energy: 1.1913538225853513
Energy: 1.395631962520598
Energy: 1.1769443883070425
Energy: 1.4014253577609175
Energy: 1.2027159834894514
Energy: 1.4014253577609175
Energy: 1.2237820300928097
Energy: 1.4039798268014312
Energy: 1.192542968994507
Energy: 1.4039798268022317
Energy: 1.2086858230590203
Energy: 1.3862760168282282
Energy: 1.2625444070912797
Energy: 1.3862760168274277
Energy: 1.2843790802222657
Energy: 1.4058535571581086
Energy: 1.194387685723291
Energy: 1.4058535571557076
Energy: 1.1976755245416046
Energy: 1.3871163169243304
Energy: 1.2000538373152039
Energy: 1.3871163169235299
Energy: 1.199939511330073
Energy: 1.3201686608169547
Energy: 1.2022384747206116
Energy: 1.3201686608209566

minimum gb energy = 1.1073418694533816 eV
minimum distance =  2.25298726096843 Angstroms
sigma value = 1


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

Energy: 1.2838975427257437
Energy: 1.2737559085770143
Energy: 1.3324413189532538
Energy: 1.2737559085742767
Energy: 1.208886244514491
Energy: 1.4178041039992872
Energy: 1.337895797522194
Energy: 1.417804103992899
Energy: 1.2560352454238075
Energy: 1.2721062517652053
Energy: 1.2162613427469067
Energy: 1.2721062517697679
Energy: 1.164246306009836
Energy: 1.2201961759538482
Energy: 1.1825056263978422
Energy: 1.220196175956586
Energy: 1.1640292868724218
Energy: 1.4185661641216583
Energy: 1.1975351792449531
Energy: 1.4185661641216583
Energy: 1.3106947923896706
Energy: 1.390127950828415
Energy: 1.1669719272583912
Energy: 1.390127950832978
Energy: 1.1647407807164418
Energy: 1.2192906948715332
Energy: 1.22397552060536
Energy: 1.2192906948715332
Energy: 1.1675111046429463
Energy: 1.2738221000119951
Energy: 1.1634327301551202
Energy: 1.2738221000156453
Energy: 1.185455661973125
Energy: 1.4302930432833367
Energy: 1.3258465097252743
Energy: 1.4302930432833367
Energy: 1.159918988226662
Energy: 1.276015644646938
Energy: 1.3395067304963686
Energy: 1.2760156446442004
Energy: 1.206336186518854
Energy: 1.445086032663106
Energy: 1.257674624708551
Energy: 1.4450860326704065
Energy: 1.170630547049278
Energy: 1.368515085717128
Energy: 1.25481030513811
Energy: 1.368515085717128
Energy: 1.2729344484995662
Energy: 1.4547352695501015
Energy: 1.2572847948103567
Energy: 1.4547352695519264
Energy: 1.2728860553620447
Energy: 1.4547346046305463
Energy: 1.2431864740126917
Energy: 1.454734604635109
Energy: 1.170622666282341
Energy: 1.3684563409739652
Energy: 1.2148792135633684
Energy: 1.3684563409712274
Energy: 1.2066190907611891
Energy: 1.4447909615062848
Energy: 1.223401746574127
Energy: 1.4447909615144976
Energy: 1.1599034364034173
Energy: 1.2760989518907382
Energy: 1.24248949244556
Energy: 1.276098951901689
Energy: 1.18547488810104
Energy: 1.4298589113818703
Energy: 1.3259992769989795
Energy: 1.4298589113846083
Energy: 1.1674094883359865
Energy: 1.2738448999730545
Energy: 1.1748284473785602
Energy: 1.2738448999803549
Energy: 1.1645727213939703
Energy: 1.2247794851789773
Energy: 1.2261166978428448
Energy: 1.2247794851762395
Energy: 1.3108104583449138
Energy: 1.3902131271728964
Energy: 1.2284257464358184
Energy: 1.390213127175634
Energy: 1.1640093583188456
Energy: 1.4181545193437846
Energy: 1.2477179641206722
Energy: 1.4181545193392218
Energy: 1.1640909585251304
Energy: 1.2196866616609994
Energy: 1.2164454518991525
Energy: 1.2196866616646498
Energy: 1.2562651275746506
Energy: 1.2721208961178467
Energy: 1.2150393198249272
Energy: 1.2721208961123711
Energy: 1.2086449806987833
Energy: 1.4179273495514555
Energy: 1.3376556994921307
Energy: 1.417927349552368
Energy: 1.2838975427257437
Energy: 1.2737559085770143
Energy: 1.47984061827564
Energy: 1.2737559085770143
Energy: 1.208886244514491
Energy: 1.4178041039992872
Energy: 1.337895797522194
Energy: 1.4178041039938116
Energy: 1.2560352454247201
Energy: 1.2721062517670305
Energy: 1.2774182585506517
Energy: 1.2721062517688555
Energy: 1.164246306008011
Energy: 1.2201961759529356
Energy: 1.2476014711220218
Energy: 1.220196175956586

minimum gb energy = 1.1599034364034173 eV
minimum distance =  2.24693577890733 Angstroms
sigma value = 25


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

Energy: 1.2214666674529362
Energy: 1.4605237327421867
Energy: 1.3902007762191455
Energy: 1.460523732741126
Energy: 1.2123156485063677
Energy: 1.469308475485877
Energy: 1.2104426026314663
Energy: 1.469308475485877
Energy: 1.2505782294170678
Energy: 1.4848183419255694
Energy: 1.2110317634776895
Energy: 1.4848183419255694
Energy: 1.2280283498226499
Energy: 1.2265046434340174
Energy: 1.2133215651753178
Energy: 1.2265046434340174
Energy: 1.278776503706602
Energy: 1.4594249377112918
Energy: 1.2192211092501324
Energy: 1.4594249377112918
Energy: 1.3682375271254834
Energy: 1.4946183951495844
Energy: 1.214188756804755
Energy: 1.4946183951485237
Energy: 1.2116136742328951
Energy: 1.2219499440974313
Energy: 1.226805028630163
Energy: 1.221949944099553
Energy: 1.5399009899242015
Energy: 1.4813935346073541
Energy: 1.1845018394133227
Energy: 1.481393534606293
Energy: 1.2305846778634928
Energy: 1.468088663112163
Energy: 1.2101323661581198
Energy: 1.4680886631132235
Energy: 1.216668654462466
Energy: 1.4888888314750184
Energy: 1.2140053413180771
Energy: 1.4888888314728967
Energy: 1.2295299043301502
Energy: 1.4687627502784277
Energy: 1.4306319467717752
Energy: 1.4687627502805494
Energy: 1.2142655372115452
Energy: 1.4566249014910435
Energy: 1.418812000193926
Energy: 1.4566249014921044
Energy: 1.2110666832925923
Energy: 1.2895207147608632
Energy: 1.2156914408739339
Energy: 1.2895207147587415
Energy: 1.2316208355587392
Energy: 1.2224972899070865
Energy: 1.2095585852405382
Energy: 1.2224972899070865
Energy: 1.2955992269765375
Energy: 1.4563795358052576
Energy: 1.1807773265322756
Energy: 1.4563795358063185
Energy: 1.2109357363495084
Energy: 1.2216648107131778
Energy: 1.2138243140760183
Energy: 1.2216648107163603
Energy: 1.2066728272965486
Energy: 1.4712449575155757
Energy: 1.2096400125009927
Energy: 1.4712449575145146
Energy: 1.222005637139963
Energy: 1.221256414889328
Energy: 1.2291094501941078
Energy: 1.221256414888267
Energy: 1.2035510807773033
Energy: 1.2304668660317546
Energy: 1.2794328424980843
Energy: 1.2304668660338762
Energy: 1.2105961664044345
Energy: 1.4651322945726044
Energy: 1.2119052424464378
Energy: 1.4651322945736653
Energy: 1.2286215831109704
Energy: 1.371345385719057
Energy: 1.2113534478577306
Energy: 1.3713453857201177
Energy: 1.2242875505599229
Energy: 1.4805595396848406
Energy: 1.374903467495496
Energy: 1.4805595396848406
Energy: 1.2124360381549502
Energy: 1.4607074104782538
Energy: 1.2103821603668272
Energy: 1.4607074104782538
Energy: 1.2384445163993385
Energy: 1.460458152807529
Energy: 1.216633442958843
Energy: 1.460458152807529
Energy: 1.3713035522931352
Energy: 1.2265455119826119
Energy: 1.2159579060762102
Energy: 1.2265455119826119

minimum gb energy = 1.1807773265322756 eV
minimum distance =  2.27642574239385 Angstroms
sigma value = 9


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

Energy: 1.3332299868225246
Energy: 1.3330163535835935
Energy: 1.5738403216009529
Energy: 1.3330163535823278
Energy: 1.2470790904634241
Energy: 1.4999735941187207
Energy: 1.3469429337884624
Energy: 1.4999735941187207
Energy: 1.2560961250745886
Energy: 1.2702805165041697
Energy: 1.258463868353829
Energy: 1.2702805165067008
Energy: 1.2572714064103558
Energy: 1.404018880273391
Energy: 1.2206630464733756
Energy: 1.4040188802746565
Energy: 1.3430013444182178
Energy: 1.398405626844323
Energy: 1.2382774167413477
Energy: 1.3984056268506506
Energy: 1.2450414736665287
Energy: 1.259442616496471
Energy: 1.207557966275782
Energy: 1.2594426164977364
Energy: 1.2904918617414713
Energy: 1.3834644718562303
Energy: 1.2210361529733171
Energy: 1.3834644718587614
Energy: 1.3463629400619739
Energy: 1.259456155895491
Energy: 1.2350622434063474
Energy: 1.2594561558942257
Energy: 1.2684232450918913
Energy: 1.4665938552515059
Energy: 1.2601837385400017
Energy: 1.4665938552553022
Energy: 1.2565275595501806
Energy: 1.2799502084281582
Energy: 1.2205764078481727
Energy: 1.2799502084268926
Energy: 1.2704601557978727
Energy: 1.4343243472889464
Energy: 1.260035755109111
Energy: 1.4343243472889464
Energy: 1.256140085529368
Energy: 1.4595354949876747
Energy: 1.2664578786027425
Energy: 1.4595354949876747
Energy: 1.2458387356281904
Energy: 1.2622129846621983
Energy: 1.2333592388952304
Energy: 1.2622129846609327
Energy: 1.2439369576030987
Energy: 1.4248361599621227
Energy: 1.3151269573566131
Energy: 1.4248361599608572
Energy: 1.2457924430402143
Energy: 1.2619065339178421
Energy: 1.3468835128620404
Energy: 1.2619065339216389
Energy: 1.2582145347041456
Energy: 1.3228528766261833
Energy: 1.220365445580742
Energy: 1.3228528766249177
Energy: 1.3427651635974966
Energy: 1.4077152413565923
Energy: 1.2584021168405912
Energy: 1.4077152413527956
Energy: 1.3247389629700959
Energy: 1.3237121045535312
Energy: 1.2350507624358908
Energy: 1.323712104551
Energy: 1.4047981839417347
Energy: 1.3911487978438357
Energy: 1.2380518736709238
Energy: 1.3911487978451011
Energy: 1.445079855748945
Energy: 1.2595733354418643
Energy: 1.2347655961513657
Energy: 1.2595733354393335
Energy: 1.2565710248484112
Energy: 1.3715306610126092
Energy: 1.2213456276657326
Energy: 1.3715306610138747

minimum gb energy = 1.207557966275782 eV
minimum distance =  2.29516372249743 Angstroms
sigma value = 25


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

Energy: 1.214403650625749
Energy: 1.5274698065700776
Energy: 1.537896206686878
Energy: 1.5274698065716426
Energy: 1.217758155144747
Energy: 1.3984399571493935
Energy: 1.2275467804394753
Energy: 1.3984399571525234
Energy: 1.2279760952578758
Energy: 1.4252769422403415
Energy: 1.2253694913367137
Energy: 1.4252769422419063
Energy: 1.214781499698359
Energy: 1.5328663705155368
Energy: 1.4621502769585353
Energy: 1.532866370517102
Energy: 1.4558306583224199
Energy: 1.4050537267432694
Energy: 1.2605777274335588
Energy: 1.4050537267432694
Energy: 1.2269117450004534
Energy: 1.4263205599325195
Energy: 1.2251766091117855
Energy: 1.4263205599309543
Energy: 1.2609189377508696
Energy: 1.354095076918737
Energy: 1.2263151751887094
Energy: 1.3540950769171718
Energy: 1.453598444726263
Energy: 1.5302132257801784
Energy: 1.2129875059671598
Energy: 1.5302132257786134
Energy: 1.2259761597884091
Energy: 1.390557975691892
Energy: 1.2146985766139138
Energy: 1.390557975693457
Energy: 1.4699550087435116
Energy: 1.2538529871337931
Energy: 1.2262633891070722
Energy: 1.2538529871150128
Energy: 1.3071289551802392
Energy: 1.2674330060845356
Energy: 1.6700248530537884
Energy: 1.2674330060782752
Energy: 1.2268368076360927
Energy: 1.2534168025090946
Energy: 1.4624791005296183
Energy: 1.2534168025059647
Energy: 1.466165366253446
Energy: 1.532938875380486
Energy: 1.227923948924716
Energy: 1.532938875380486
Energy: 1.2260887786632373
Energy: 1.3555902609530714
Energy: 1.2139412121971924
Energy: 1.3555902609546362
Energy: 1.2591638818112252
Energy: 1.443017376576093
Energy: 1.4442447986513547
Energy: 1.443017376577658
Energy: 1.2209813199871513
Energy: 1.5340648701819155
Energy: 1.2269085812260867
Energy: 1.5340648701819155
Energy: 1.226865418669585
Energy: 1.3519584148966508
Energy: 1.4605929616409041
Energy: 1.3519584148950856

minimum gb energy = 1.2129875059671598 eV
minimum distance =  2.33734897322827 Angstroms
sigma value = 17


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

Energy: 1.2683466568629023
Energy: 1.2711389916891043
Energy: 1.7331251793914255
Energy: 1.271138991690877
Energy: 1.4715059366871517
Energy: 1.3262269087403904
Energy: 1.2371874438328723
Energy: 1.3262269087395042
Energy: 1.455987319774254
Energy: 1.3809597201862611
Energy: 1.2230957575323926
Energy: 1.3809597201853747
Energy: 1.2269040257792454
Energy: 1.361759025356083
Energy: 1.354243778380055
Energy: 1.3617590253551966
Energy: 1.474395934128227
Energy: 1.3317958146380073
Energy: 1.256948340735675
Energy: 1.3317958146380073
Energy: 1.220276508419848
Energy: 1.2719741880783029
Energy: 1.4781285981263335
Energy: 1.2719741880800757
Energy: 1.223412838196154
Energy: 1.34392511159895
Energy: 1.237133698737965
Energy: 1.34392511159895
Energy: 1.4796316617819176
Energy: 1.2352070399700434
Energy: 1.2167838595123117
Energy: 1.2352070399647253
Energy: 1.2236238279378697
Energy: 1.3243102203086055
Energy: 1.480556323444465
Energy: 1.3243102203094919
Energy: 1.612328939360044
Energy: 1.251502781664435
Energy: 1.2253688717268407
Energy: 1.2515027816635487
Energy: 1.2292573717653386
Energy: 1.362368009961773
Energy: 1.4577566921042635
Energy: 1.3623680099626592
Energy: 1.2255578211128193
Energy: 1.337254833643788
Energy: 1.225504975220603
Energy: 1.3372548336446741
Energy: 1.460048933648389
Energy: 1.2722607867702593
Energy: 1.2725324863286267
Energy: 1.2722607867711457
Energy: 1.22646334552384
Energy: 1.3229783072801233
Energy: 1.4746559129175727
Energy: 1.3229783072783505
Energy: 1.339702337451684
Energy: 1.346713213623359
Energy: 1.223792024502359
Energy: 1.346713213623359
Energy: 1.4499185335174265
Energy: 1.2405006146317081
Energy: 1.4809756018703517
Energy: 1.240500614633481
Energy: 1.2355499361472797
Energy: 1.3547291834258348
Energy: 1.481643895461909
Energy: 1.3547291834258348
Energy: 1.4691731097196215
Energy: 1.278867410817746
Energy: 1.219888127364054
Energy: 1.2788674108159732
Energy: 1.232484197288714
Energy: 1.323822150089924
Energy: 1.3226712378273886
Energy: 1.3238221500934697
Energy: 1.2439941126725123
Energy: 1.3753064817195202
Energy: 1.2222033266307006
Energy: 1.3753064817195202
Energy: 1.340933464060771
Energy: 1.2814302423430068
Energy: 1.4540740096350602
Energy: 1.2814302423438932
Energy: 1.2254684188383063
Energy: 1.5298569249166265
Energy: 1.5916797040524517
Energy: 1.5298569249201721
Energy: 1.4977796162311756
Energy: 1.2698055395847272
Energy: 1.223578141322953
Energy: 1.2698055395856136
Energy: 1.2367684586454601
Energy: 1.3501949896033123
Energy: 1.4672200255342593
Energy: 1.3501949895988803
Energy: 1.2438824971245654
Energy: 1.3792731375391403
Energy: 1.46852064065922
Energy: 1.3792731375444585
Energy: 1.4942850805151382
Energy: 1.2704580036823996
Energy: 1.2265514574362149
Energy: 1.2704580036823996
Energy: 1.249869300518885
Energy: 1.5299871745887283
Energy: 1.6243529324670325
Energy: 1.5299871745896152
Energy: 1.4796501098212582
Energy: 1.2397725607809404
Energy: 1.4574762818662153
Energy: 1.2397725607818266
Energy: 1.6149182158999211
Energy: 1.375525090071347
Energy: 1.2235067638332413
Energy: 1.3755250900678018
Energy: 1.2169930098310517
Energy: 1.3245315680073146
Energy: 1.4749619636207112
Energy: 1.324531568008201

minimum gb energy = 1.2167838595123117 eV
minimum distance =  2.30418189750244 Angstroms
sigma value = 53


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

Energy: 1.0741870927487327
Energy: 1.076300272458196
Energy: 1.3996212597069324
Energy: 1.076300272462277
Energy: 1.4157419725323923
Energy: 1.2099587307596091
Energy: 1.0544767851170662
Energy: 1.2099587307596091
Energy: 1.0753887134718632
Energy: 1.0574257708660504
Energy: 1.3989608791547925
Energy: 1.0574257708660504
Energy: 1.0756695957269693
Energy: 1.0575382292468474
Energy: 1.0542358606388151
Energy: 1.0575382292509286
Energy: 1.4157458203197857
Energy: 1.2102131230606867
Energy: 1.0544118877836024
Energy: 1.2102131230606867
Energy: 1.074187092746692
Energy: 1.076300272458196
Energy: 1.399621259704892
Energy: 1.076300272462277
Energy: 1.4157419725323923
Energy: 1.2099587307596091
Energy: 1.0544767851191068
Energy: 1.2099587307596091
Energy: 1.0753887134718632
Energy: 1.0574257708680908
Energy: 1.3989608791547925
Energy: 1.0574257708680908
Energy: 1.0756695957269693
Energy: 1.0575382292448066
Energy: 1.0542358606388151
Energy: 1.0575382292488877
Energy: 1.4157458203218265
Energy: 1.2102131230606867
Energy: 1.0544118877836024
Energy: 1.2102131230606867
Energy: 1.0741870927487327
Energy: 1.076300272458196
Energy: 1.3996212597069324
Energy: 1.076300272462277
Energy: 1.4157419725303517
Energy: 1.2099587307596091
Energy: 1.0544767851170662
Energy: 1.2099587307596091
Energy: 1.0753887134718632
Energy: 1.0574257708660504
Energy: 1.3989608791547925
Energy: 1.0574257708660504

minimum gb energy = 1.0542358606388151 eV
minimum distance =  2.34344511232769 Angstroms
sigma value = 9


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

Energy: 1.2277152540335836
Energy: 1.5942633536663962
Energy: 1.8590679401179329
Energy: 1.5942633536663962
Energy: 1.5387310914436452
Energy: 1.3068765738143115
Energy: 1.2195068758033258
Energy: 1.3068765738143115
Energy: 1.2474880078218755
Energy: 1.2117449782433292
Energy: 1.2239121861769666
Energy: 1.2117449782357768
Energy: 1.4630281735467752
Energy: 1.3530842779695824
Energy: 1.218159324306311
Energy: 1.3530842779710928
Energy: 1.5110980754007428
Energy: 1.3033819151109887
Energy: 1.2249829504623455
Energy: 1.3033819151109887
Energy: 1.2227314089102477
Energy: 1.2261210901286597
Energy: 1.4640467813395865
Energy: 1.2261210901286597
Energy: 1.7196882757091874
Energy: 1.2965271588203484
Energy: 1.2177762146934679
Energy: 1.2965271588211036
Energy: 1.2282095143161431
Energy: 1.4306936899245817
Energy: 1.4554960675611184
Energy: 1.430693689925337
Energy: 1.2263932241606212
Energy: 1.3618140051660257
Energy: 1.2082544216286084
Energy: 1.3618140051660257
Energy: 1.2299110890616092
Energy: 1.302361717438942
Energy: 1.2150888381853526
Energy: 1.3023617174404525
Energy: 1.2283997989008482
Energy: 1.4394467544276763
Energy: 1.749189323594251
Energy: 1.439446754426921
Energy: 1.4552905713235462
Energy: 1.6452712799004896
Energy: 1.2263137518348513
Energy: 1.645271279898979
Energy: 1.2352679242853157
Energy: 1.4306804856753386
Energy: 1.5754237222493663
Energy: 1.4306804856745836
Energy: 1.4995143460181686
Energy: 1.617734371865785
Energy: 1.2165013905934055
Energy: 1.617734371865785
Energy: 1.2221569422517624
Energy: 1.4050360520241478
Energy: 1.487931745554091
Energy: 1.4050360520256584
Energy: 1.2377943337280906
Energy: 1.6313279961507476
Energy: 1.4755173011030167
Energy: 1.631327996151503
Energy: 1.3501434416899212
Energy: 1.2366084590418973
Energy: 1.2216097456932995
Energy: 1.2366084590426525
Energy: 1.2393278285005174
Energy: 1.2967458806894612
Energy: 1.480535663881922
Energy: 1.2967458806902166
Energy: 1.4576884112407615
Energy: 1.4323448556043499
Energy: 1.2359582684630104
Energy: 1.4323448556043499
Energy: 1.2257667287768108
Energy: 1.308779772138334
Energy: 1.3595808975203765
Energy: 1.3087797721390895
Energy: 1.4373680130946105
Energy: 1.6373647972588834
Energy: 1.4709718044834246
Energy: 1.637364797260394
Energy: 1.3519654450270209
Energy: 1.4246053763704438
Energy: 1.231866458661734
Energy: 1.4246053763704438
Energy: 1.2084733788024096
Energy: 1.3980670438528393
Energy: 1.2225413818358124
Energy: 1.3980670438543497
Energy: 1.7328937113220604
Energy: 1.2331613097808116
Energy: 1.2298759314259762
Energy: 1.2331613097770355
Energy: 1.2174444606911186
Energy: 1.5427042805492226
Energy: 1.5867595653178632
Energy: 1.542704280550733
Energy: 1.3416974013373903
Energy: 1.2106127714861235
Energy: 1.2336421667167414
Energy: 1.2106127714868788
Energy: 1.4787843981056472
Energy: 1.4126788581706569
Energy: 1.4854268818934313
Energy: 1.412678858171412
Energy: 1.2141486990107662
Energy: 1.610396821228405
Energy: 1.4885907080197551
Energy: 1.6103968212291604
Energy: 1.3355440187236338
Energy: 1.2118247929649535
Energy: 1.2337998757748945
Energy: 1.211824792966464
Energy: 1.2183522754282108
Energy: 1.6956675213416905
Energy: 1.5886402997919555
Energy: 1.6956675213386698
Energy: 1.6910121079762015
Energy: 1.2314507502160261
Energy: 1.226104306383212
Energy: 1.231450750215271
Energy: 1.2077679161916057
Energy: 1.3075310210392221
Energy: 1.2221903725933767
Energy: 1.3075310210377116
Energy: 1.2102206239778304
Energy: 1.443959521571196
Energy: 1.2345928580737602
Energy: 1.4439595215696857
Energy: 1.437922753590276
Energy: 1.6289997370757152
Energy: 1.4672749227691646
Energy: 1.6289997370764706
Energy: 1.2322923172204987
Energy: 1.4818228328394625
Energy: 1.7185872615921995
Energy: 1.4818228328394625

minimum gb energy = 1.2077679161916057 eV
minimum distance =  2.25523249589964 Angstroms
sigma value = 73


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

Energy: 1.354357525028953
Energy: 1.4129481940008408
Energy: 1.8360804881446189
Energy: 1.4129481939996424
Energy: 1.3583719710398336
Energy: 1.5134818900632432
Energy: 1.2329269708171513
Energy: 1.5134818900632432
Energy: 1.2539443045932714
Energy: 1.3234792570720002
Energy: 1.2437467841322376
Energy: 1.3234792570731984
Energy: 1.2570198559502939
Energy: 1.4851120765513846
Energy: 1.245823560880108
Energy: 1.4851120765477897
Energy: 1.3512307665976842
Energy: 1.3739729019451414
Energy: 1.2436113607824661
Energy: 1.3739729019487361
Energy: 1.2643621827655558
Energy: 1.226135585982538
Energy: 1.6448343046984357
Energy: 1.2261355859837362
Energy: 1.647501274059445
Energy: 1.473843300459279
Energy: 1.237096779509335
Energy: 1.473843300459279
Energy: 1.2538891478451228
Energy: 1.4264068226328084
Energy: 1.568977017468641
Energy: 1.4264068226292137
Energy: 1.6844477877733197
Energy: 1.2218687420375232
Energy: 1.2226566431008563
Energy: 1.2218687420399197
Energy: 1.2382293664446988
Energy: 1.3774207097685884
Energy: 1.234283164500205
Energy: 1.3774207097685884
Energy: 1.2510066089438612
Energy: 1.3212476501744286
Energy: 1.567614505845995
Energy: 1.3212476501744286
Energy: 1.4501551805789423
Energy: 1.2527133410951576
Energy: 1.2582709276773287
Energy: 1.2527133410951576
Energy: 1.2447591767433037
Energy: 1.3636521086036553
Energy: 1.5436939393189384
Energy: 1.3636521086036553
Energy: 1.6894327191189702
Energy: 1.4235986125506002
Energy: 1.2537212136533915
Energy: 1.4235986125470053
Energy: 1.2272576543166498
Energy: 1.4484030690592802
Energy: 1.5676441997234551
Energy: 1.4484030690568834
Energy: 1.584826739477289
Energy: 1.4268269492333692
Energy: 1.260265594647429
Energy: 1.4268269492345673
Energy: 1.3363490125606543
Energy: 1.331481188766662
Energy: 1.2416338655759926
Energy: 1.331481188766662
Energy: 1.3532334415933691
Energy: 1.414189681853734
Energy: 1.2368930718499926
Energy: 1.4141896818525357
Energy: 1.25819597785808
Energy: 1.2229988668687897
Energy: 1.2593908887742538
Energy: 1.2229988668687897
Energy: 1.237634643727579
Energy: 1.3852097202017621
Energy: 1.6215754990096984
Energy: 1.3852097202017621
Energy: 1.7166476260807868
Energy: 1.2260499115280195
Energy: 1.2533611894211634
Energy: 1.2260499115244243
Energy: 1.2460336425175074
Energy: 1.3659688121142228
Energy: 1.481608031207198
Energy: 1.3659688121118263

minimum gb energy = 1.2218687420375232 eV
minimum distance =  2.25206603034792 Angstroms
sigma value = 7


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

Energy: 1.3042412927431626
Energy: 1.3034150858594944
Energy: 1.8409695431232775
Energy: 1.3034150858577997
Energy: 1.6775254228620182
Energy: 1.2821720230855003
Energy: 1.2676917761662667
Energy: 1.2821720230863478
Energy: 1.2594168424320276
Energy: 1.5093181139842073
Energy: 1.321356348555384
Energy: 1.5093181139892908
Energy: 1.3504585317585316
Energy: 1.422746405016555
Energy: 1.2556306981534149
Energy: 1.422746405022486
Energy: 1.2444087982438354
Energy: 1.3724815691826944
Energy: 1.29746470403368
Energy: 1.3724815691759162
Energy: 1.2579953486478077
Energy: 1.5169240560943456
Energy: 1.6287414506791869
Energy: 1.5169240560977348
Energy: 1.466437549307383
Energy: 1.553360719294868
Energy: 1.3004860728132863
Energy: 1.5533607192982573
Energy: 1.257490620710345
Energy: 1.5274186062561275
Energy: 1.685549553802955
Energy: 1.5274186062629058
Energy: 1.5289931657189941
Energy: 1.388902186876943
Energy: 1.2585560133349147
Energy: 1.3889021868760958
Energy: 1.273531151669669
Energy: 1.3942583513001763
Energy: 1.4313759446083163
Energy: 1.3942583513086493
Energy: 1.3380088931301488
Energy: 1.2948240444974997
Energy: 1.3160192178388144
Energy: 1.2948240445000414
Energy: 1.2977062459610438
Energy: 1.3734553703414791
Energy: 1.3142620343283151
Energy: 1.373455370333006
Energy: 1.2895090795041864
Energy: 1.2902772157910427
Energy: 1.3045363997734079
Energy: 1.2902772157901956
Energy: 1.3109549703483208
Energy: 1.52134808188597
Energy: 1.3118308095132754
Energy: 1.5213480818817335
Energy: 1.267769136175429
Energy: 1.579426969318605
Energy: 1.467163731392059
Energy: 1.579426969313521
Energy: 1.8410596779923563
Energy: 1.3063169046661347
Energy: 1.2581668757677908
Energy: 1.30631690466444
Energy: 1.2551108265062672
Energy: 1.416361431097466
Energy: 1.3469566456446107
Energy: 1.4163614311017025
Energy: 1.286990045170119
Energy: 1.3470933833739558
Energy: 1.321248431097161
Energy: 1.347093383381581
Energy: 1.2550889059198627
Energy: 1.5139597084563161
Energy: 1.3134844013413765
Energy: 1.513959708450385
Energy: 1.2653577718856692
Energy: 1.37076568156694
Energy: 1.3150500891695256
Energy: 1.3707656815779548
Energy: 1.3404608060580432
Energy: 1.4145699735278616
Energy: 1.2584184530698308
Energy: 1.4145699735227777
Energy: 1.257641077162274
Energy: 1.5289321339334254
Energy: 1.4703001539568368
Energy: 1.5289321339368145
Energy: 1.6114131340905684
Energy: 1.5247145669529938
Energy: 1.2816055728990006
Energy: 1.5247145669487572
Energy: 1.2949042404357372
Energy: 1.2906778714931735
Energy: 1.658463599646121
Energy: 1.290677871488937
Energy: 1.2847197969451671
Energy: 1.3710942548602287
Energy: 1.2803947161614468
Energy: 1.371094254867007
Energy: 1.3361742225779973
Energy: 1.5093093880249084
Energy: 1.312788841197684
Energy: 1.5093093880215191
Energy: 1.259611275091791
Energy: 1.4465612492326372
Energy: 1.268447362462098
Energy: 1.4465612492385682
Energy: 1.3413100616470335
Energy: 1.3679044076093745
Energy: 1.2556223638308812
Energy: 1.367904407606833
Energy: 1.2586945667947702
Energy: 1.519617090202904
Energy: 1.527914994125634
Energy: 1.5196170902062933
Energy: 1.4036925661768254
Energy: 1.264879758251016
Energy: 1.2667896480103442
Energy: 1.2648797582501687
Energy: 1.2585410260500336
Energy: 1.5197297094387587
Energy: 1.6852013085256703
Energy: 1.5197297094319806

minimum gb energy = 1.2444087982438354 eV
minimum distance =  2.23408115615318 Angstroms
sigma value = 29


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

Energy: 1.2811091509946912
Energy: 1.4738343393950948
Energy: 1.3947544995898462
Energy: 1.4738343393968327
Energy: 1.2916930685443517
Energy: 1.3594079679465847
Energy: 1.2847358877123847
Energy: 1.3594079679456992
Energy: 1.2668341729565558
Energy: 1.3575242543037245
Energy: 1.394615780134605
Energy: 1.3575242543043147
Energy: 1.285571392858146
Energy: 1.3826906995374855
Energy: 1.279973421653968
Energy: 1.3826906995374855
Energy: 1.2806815410271526
Energy: 1.3828639218146825
Energy: 1.394869000038135
Energy: 1.382863921815535
Energy: 1.3301836290606448
Energy: 1.4260185716508351
Energy: 1.330177844846066
Energy: 1.4260185716522782
Energy: 1.2667050367921129
Energy: 1.3833199880269562
Energy: 1.2806676553585437
Energy: 1.3833199880266611
Energy: 1.2798144394272428
Energy: 1.3827810290060174
Energy: 1.2842033997345847
Energy: 1.382781029005722
Energy: 1.39454984367227
Energy: 1.357515499879353
Energy: 1.2931078545671637
Energy: 1.3575154998790577

minimum gb energy = 1.2667050367921129 eV
minimum distance =  2.33582322441072 Angstroms
sigma value = 5


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

Energy: 1.3068156746890955
Energy: 1.3804090645453078
Energy: 1.5075014387846786
Energy: 1.3804090645453078
Energy: 1.361270782588733
Energy: 1.397324080519884
Energy: 1.299082854221308
Energy: 1.3973240805206844
Energy: 1.2673668669678801
Energy: 1.4203958242824593
Energy: 1.5236819185638741
Energy: 1.4203958242824593
Energy: 1.2873158837282774
Energy: 1.4278504046801308
Energy: 1.2834847909406752
Energy: 1.4278504046777298
Energy: 1.2901160713403856
Energy: 1.4339780471801078
Energy: 1.504711679256315
Energy: 1.4339780471801078
Energy: 1.3841808235533575
Energy: 1.4074828222275857
Energy: 1.279692624364945
Energy: 1.4074828222291864
Energy: 1.2859334911802323
Energy: 1.434725693292395
Energy: 1.29514775240837
Energy: 1.4347256932939958
Energy: 1.2826564537616276
Energy: 1.5134113377463374
Energy: 1.276605273183646
Energy: 1.5134113377463374
Energy: 1.2927498911483832
Energy: 1.4321158785948198
Energy: 1.2870973382446802
Energy: 1.4321158785964205
Energy: 1.2879226200758183
Energy: 1.4349538556212045
Energy: 1.294539871723084
Energy: 1.434953855624406
Energy: 1.3239191516799922
Energy: 1.5556167724078616
Energy: 1.2712862025614213
Energy: 1.555616772408662
Energy: 1.3044812287904028
Energy: 1.4765143677711747
Energy: 1.3801891704649145
Energy: 1.476514367765572
Energy: 1.4047972239906334
Energy: 1.3837951438991176
Energy: 1.3360251846601134
Energy: 1.3837951438983902
Energy: 1.276482452029416
Energy: 1.4229147845475154
Energy: 1.3133897416932754
Energy: 1.422914784545915
Energy: 1.3221546300247724
Energy: 1.428621490183721
Energy: 1.2710699784889254
Energy: 1.4286214901845216
Energy: 1.2850739426493443
Energy: 1.3761499714425625
Energy: 1.389163514285644
Energy: 1.3761499714417622
Energy: 1.4979056654107845
Energy: 1.5786646955920296
Energy: 1.2776221771719833
Energy: 1.5786646955928298
Energy: 1.2723451951645484
Energy: 1.4227522799508987
Energy: 1.4572666068080573
Energy: 1.422752279949298
Energy: 1.2755267821697807
Energy: 1.43686232007379
Energy: 1.2822750261116953
Energy: 1.4368623200745902
Energy: 1.2681200206640424
Energy: 1.49236930395559
Energy: 1.3404967162132808
Energy: 1.4923693039563903
Energy: 1.294903735271243
Energy: 1.3850356648893651
Energy: 1.2862020750258631
Energy: 1.3850356648909659
Energy: 1.3169462678328965
Energy: 1.43382112467616
Energy: 1.2934241916744924
Energy: 1.43382112467616
Energy: 1.2846267965164393
Energy: 1.4120824508903198
Energy: 1.294782173157821
Energy: 1.4120824508895193
Energy: 1.3809037165717426
Energy: 1.3539198442572702
Energy: 1.2911406230959797
Energy: 1.3539198442556692
Energy: 1.3754387586601395
Energy: 1.3368771202016845
Energy: 1.2677923475123332
Energy: 1.336877120200884
Energy: 1.3236722515180384
Energy: 1.4205125613444756
Energy: 1.2786197058263447
Energy: 1.420512561345276
Energy: 1.2944506372099363
Energy: 1.4264324932940728
Energy: 1.3310503623264514
Energy: 1.426432493292472
Energy: 1.423707136780771
Energy: 1.3858032296951452
Energy: 1.2853898678516498
Energy: 1.3858032296951452
Energy: 1.2768163483016417
Energy: 1.7057256203333824
Energy: 1.4988519708548798
Energy: 1.705725620334983
Energy: 1.4604560543805751
Energy: 1.4238310545210102
Energy: 1.272035796320565
Energy: 1.4238310545202097
Energy: 1.274981452789536
Energy: 1.33108801428188
Energy: 1.4613366447309046
Energy: 1.3310880142810797
Energy: 1.5026384363586414
Energy: 1.4988795563755197
Energy: 1.2765177032907358
Energy: 1.498879556374719
Energy: 1.2814036416144567
Energy: 1.3855441960389543
Energy: 1.2819290391706852
Energy: 1.3855441960389543

minimum gb energy = 1.2673668669678801 eV
minimum distance =  2.2521059460428 Angstroms
sigma value = 1


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

Energy: 1.3447805946189122
Energy: 1.3316051973687926
Energy: 1.4742680320869384
Energy: 1.331605197371006
Energy: 1.296411309383963
Energy: 1.4726059066681008
Energy: 1.2262832318759451
Energy: 1.4726059066658874
Energy: 1.2247360178198472
Energy: 1.40348045289465
Energy: 1.6406964593644782
Energy: 1.4034804528935434
Energy: 1.2568268138315941
Energy: 1.422237747101433
Energy: 1.2363636259650308
Energy: 1.4222377471036463
Energy: 1.225967672988274
Energy: 1.6026679967127035
Energy: 1.287789496552531
Energy: 1.60266799671049
Energy: 1.2329997737976313
Energy: 1.3436439857290117
Energy: 1.236348340849281
Energy: 1.343643985731225
Energy: 1.2350872620989737
Energy: 1.4731752592418068
Energy: 1.2774573459178118
Energy: 1.4731752592418068
Energy: 1.2352094430275185
Energy: 1.468895566171046
Energy: 1.293385851109341
Energy: 1.4688955661721528
Energy: 1.3121951776353256
Energy: 1.3041220372867517
Energy: 1.2831463067398108
Energy: 1.3041220372878581
Energy: 1.31247843572091
Energy: 1.3038046043136073
Energy: 1.2598696456944785
Energy: 1.3038046043180338
Energy: 1.2350486813169508
Energy: 1.4688185856379796
Energy: 1.2871242382837225
Energy: 1.4688185856390863
Energy: 1.2351221183831114
Energy: 1.4731547465834762
Energy: 1.259743871040917
Energy: 1.4731547465757295
Energy: 1.2334270671246568
Energy: 1.3437743158291273
Energy: 1.2360448461727074
Energy: 1.3437743158235944
Energy: 1.226198875654234
Energy: 1.602786214048097
Energy: 1.3215903441462962
Energy: 1.6027862140503102
Energy: 1.2767908417303528
Energy: 1.4222395339621028
Energy: 1.2364169453816707
Energy: 1.4222395339609963
Energy: 1.2247387723974088
Energy: 1.4033161028692556
Energy: 1.278281277790422
Energy: 1.403316102870362
Energy: 1.2966555450731385
Energy: 1.4725511975655075
Energy: 1.2262843787466928
Energy: 1.4725511975655075
Energy: 1.3447805946189122
Energy: 1.3316051973687926
Energy: 1.4742680083555266
Energy: 1.331605197371006
Energy: 1.2964113093850698
Energy: 1.4726059066692072
Energy: 1.2262832318759451
Energy: 1.472605906666994
Energy: 1.2247360178209539
Energy: 1.40348045289465
Energy: 1.6406964593644782
Energy: 1.4034804528935434
Energy: 1.2568268138327008
Energy: 1.422237747101433
Energy: 1.2363636259650308
Energy: 1.4222377471036463
Energy: 1.2259676729893807
Energy: 1.6026679967127035
Energy: 1.2877894965436778
Energy: 1.6026679967115967
Energy: 1.2329997737965246
Energy: 1.3436439857290117
Energy: 1.236348340849281
Energy: 1.343643985731225
Energy: 1.2350872621000804
Energy: 1.4731752592418068
Energy: 1.277457345916705
Energy: 1.4731752592429137

minimum gb energy = 1.2247360178198472 eV
minimum distance =  2.24082431961338 Angstroms
sigma value = 17


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

Energy: 1.3312693399898774
Energy: 1.3319991023759088
Energy: 1.530021871209732
Energy: 1.331999102377961
Energy: 1.3238180336473186
Energy: 1.5432514069669423
Energy: 1.2521035953585757
Energy: 1.5432514069662582
Energy: 1.2503915907394323
Energy: 1.3978103408600684
Energy: 1.418015745699933
Energy: 1.3978103408614362
Energy: 1.3376925081393238
Energy: 1.4556375516198194
Energy: 1.2389930784858845
Energy: 1.4556375516198194
Energy: 1.258962216024532
Energy: 1.4897953646970623
Energy: 1.2572366908676873
Energy: 1.4897953646936426
Energy: 1.2449938128319036
Energy: 1.6816532988074648
Energy: 1.2647133799177945
Energy: 1.681653298808833
Energy: 1.241829420604035
Energy: 1.402115741917279
Energy: 1.337991324571551
Energy: 1.402115741917279
Energy: 1.248163476137242
Energy: 1.3701354344832508
Energy: 1.2474190674023642
Energy: 1.3701354344832508
Energy: 1.3345373005637637
Energy: 1.4757153331605561
Energy: 1.2883739664606537
Energy: 1.475715333156452
Energy: 1.3278926241489686
Energy: 1.4992194004515222
Energy: 1.2469745141846875
Energy: 1.4992194004501544
Energy: 1.241980413832878
Energy: 1.4898791538993201
Energy: 1.25137061257849
Energy: 1.4898791538993201
Energy: 1.2453286817749152
Energy: 1.3704987470353651
Energy: 1.2448464129043144
Energy: 1.3704987470346812
Energy: 1.248397818608351
Energy: 1.483606648025169
Energy: 1.2572377672008614
Energy: 1.483606648025853
Energy: 1.2426317260036486
Energy: 1.4200809040087359
Energy: 1.3426515932462062
Energy: 1.4200809040087359
Energy: 1.2393476909568413
Energy: 1.4549732489446108
Energy: 1.3394473422721997
Energy: 1.4549732489459788
Energy: 1.2555976871689074
Energy: 1.3691235023514792
Energy: 1.26039686961769
Energy: 1.3691235023514792
Energy: 1.2934402849741082
Energy: 1.4603212338075533
Energy: 1.2535988431702794
Energy: 1.4603212338068694
Energy: 1.2398372659112826
Energy: 1.4047146994868724
Energy: 1.2858177548516119
Energy: 1.4047146994868724
Energy: 1.4459123340694098
Energy: 1.6306126912865109
Energy: 1.2529508112904602
Energy: 1.6306126912871948
Energy: 1.252044905241727
Energy: 1.303406613905357
Energy: 1.3523509001086613
Energy: 1.3034066139019371
Energy: 1.2531104521671328
Energy: 1.4516808122572298
Energy: 1.25341244612837
Energy: 1.4516808122551776
Energy: 1.2323177638167409
Energy: 1.3708314104553077
Energy: 1.2548989032078555
Energy: 1.3708314104566757
Energy: 1.365522952164646
Energy: 1.464831128216757
Energy: 1.2576202093351319
Energy: 1.464831128216757
Energy: 1.2567820730799577
Energy: 1.4987547510503054
Energy: 1.482794036955104
Energy: 1.4987547510523576
Energy: 1.3361069928505878
Energy: 1.4037584671157284
Energy: 1.2325409402692533
Energy: 1.4037584671157284
Energy: 1.256352845427777
Energy: 1.4227837721279981
Energy: 1.2936185698982225
Energy: 1.4227837721307344
Energy: 1.4302314677734407
Energy: 1.5222898368043434
Energy: 1.2624111852324413
Energy: 1.5222898368063953
Energy: 1.3420123655399188
Energy: 1.4620707421715144
Energy: 1.2429764744842067
Energy: 1.4620707421721986
Energy: 1.3362162906671142
Energy: 1.418888982260056
Energy: 1.2405241375907623
Energy: 1.418888982260056
Energy: 1.2561059232144578
Energy: 1.4783408186620564
Energy: 1.3390783749868673
Energy: 1.4783408186627403
Energy: 1.2509805991611527
Energy: 1.4194789076289671
Energy: 1.2482893765094467
Energy: 1.4194789076317034
Energy: 1.2368009419812147
Energy: 1.677793373964064
Energy: 1.2532502779662347
Energy: 1.6777933739668
Energy: 1.24284076309535
Energy: 1.499416077857368
Energy: 1.4736509037628278
Energy: 1.4994160778559997
Energy: 1.3281277687180133
Energy: 1.476747614541891
Energy: 1.2650379770655886
Energy: 1.476747614541891
Energy: 1.25793966493704
Energy: 1.3798612275442692
Energy: 1.3049967040152255
Energy: 1.379861227542217
Energy: 1.3205642627639136
Energy: 1.5077647157895564
Energy: 1.2537783351920846
Energy: 1.5077647157916085
Energy: 1.2581360665348318
Energy: 1.6792544003516887
Energy: 1.2472407866207733
Energy: 1.6792544003516887
Energy: 1.255557616227136
Energy: 1.507843853496938
Energy: 1.252287187703186
Energy: 1.507843853496938

minimum gb energy = 1.2323177638167409 eV
minimum distance =  2.23319007723161 Angstroms
sigma value = 89


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

Energy: 1.1800296464218327
Energy: 1.18110741159875
Energy: 1.2044969735706694
Energy: 1.18110741159875
Energy: 1.1386899644249504
Energy: 1.2155372985290764
Energy: 1.1999266222184057
Energy: 1.2155372985290764
Energy: 1.2083259847488457
Energy: 1.3950125761145713
Energy: 1.1622741325577506
Energy: 1.3950125761145713
Energy: 1.1758082266321528
Energy: 1.2157425086912221
Energy: 1.1743604694552627
Energy: 1.2157425086912221
Energy: 1.2025193984761409
Energy: 1.315446618805651
Energy: 1.1654877293057566
Energy: 1.3154466188092302
Energy: 1.164341582182482
Energy: 1.1824533927955418
Energy: 1.1862806712487985
Energy: 1.1824533927955418
Energy: 1.1740623340215832
Energy: 1.4252850604651714
Energy: 1.172422324804674
Energy: 1.4252850604651714
Energy: 1.2263869178562317
Energy: 1.4170287600008957
Energy: 1.1742330308714373
Energy: 1.4170287600205822
Energy: 1.2031836939466605
Energy: 1.324359877762483
Energy: 1.170587068470957
Energy: 1.324359877762483
Energy: 1.1941469161964142
Energy: 1.3503418307202706
Energy: 1.1576623408818092
Energy: 1.3503418307220603
Energy: 1.1729863314427873
Energy: 1.217269764859773
Energy: 1.1654578390132826
Energy: 1.217269764859773
Energy: 1.174698499252169
Energy: 1.4230029990919744
Energy: 1.1385036816092935
Energy: 1.4230029990919744
Energy: 1.2031631275910384
Energy: 1.3217958066579334
Energy: 1.1889952063333125
Energy: 1.321795806656144
Energy: 1.1638685784162446
Energy: 1.3215015490839552
Energy: 1.1635326804675061
Energy: 1.3215015490839552
Energy: 1.2318069231141338
Energy: 1.2997326981068482
Energy: 1.204629395897938
Energy: 1.2997326981050585

minimum gb energy = 1.1385036816092935 eV
minimum distance =  2.25065052346361 Angstroms
sigma value = 13


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

Energy: 1.1982738572186866
Energy: 1.5850891525048818
Energy: 1.572306427106924
Energy: 1.5850891525086324
Energy: 1.2100432201823024
Energy: 1.5783290620506771
Energy: 1.1318693796433503
Energy: 1.5783290620604289
Energy: 1.1564884349474926
Energy: 1.5268710262913339
Energy: 1.5261200297215138
Energy: 1.5268710262950844
Energy: 1.1073265116114426
Energy: 1.596749819659732
Energy: 1.1011804924047237
Energy: 1.5967498196567314
Energy: 1.1470764056022194
Energy: 1.6136243975432776
Energy: 1.1660028005000178
Energy: 1.6136243975440279
Energy: 1.1142996295031087
Energy: 1.3586009367213399
Energy: 1.1781898477386235
Energy: 1.358600936728091
Energy: 1.1417200826043779
Energy: 1.6759834486921392
Energy: 1.216224812578248
Energy: 1.6759834486913894
Energy: 1.1205935264499156
Energy: 1.5713573732480153
Energy: 1.1781726056205413
Energy: 1.571357373257767
Energy: 1.1416847731911486
Energy: 1.413065474097292
Energy: 1.2018282992870677
Energy: 1.4130654740942918
Energy: 1.321210396585015
Energy: 1.4518293960884847
Energy: 1.101147891021034
Energy: 1.451829396094486
Energy: 1.1212690829789984
Energy: 1.2801679803352346
Energy: 1.109767968888311
Energy: 1.2801679803307338
Energy: 1.1955456227861831
Energy: 1.3486866446417287
Energy: 1.139856310544808
Energy: 1.3486866447961858
Energy: 1.1837426758993481
Energy: 1.1557875009225025
Energy: 1.1561155380970598
Energy: 1.1557875009285032
Energy: 1.5547940844767665
Energy: 1.6465630990103919
Energy: 1.1058788020409431
Energy: 1.6465630990118918
Energy: 1.1209027957754945
Energy: 1.518857720633354
Energy: 1.157826676015367
Energy: 1.5188577206243523
Energy: 1.157116694749425
Energy: 1.4466107580394312
Energy: 1.1053712289064364
Energy: 1.446610758026679
Energy: 1.1677668638305194
Energy: 1.4408733330763546
Energy: 1.1049570738866101
Energy: 1.4408733330718537
Energy: 1.1731103919138355
Energy: 1.430036578212561
Energy: 1.1694617651173385
Energy: 1.430036578214061
Energy: 1.173533548820163
Energy: 1.2172101590790732
Energy: 1.1692808143745157
Energy: 1.217210159092507
Energy: 1.1736179617342328
Energy: 1.217652549840394
Energy: 1.169510315778942
Energy: 1.2176525498441448
Energy: 1.1730590981205749
Energy: 1.430194863803788
Energy: 1.1693622908934664
Energy: 1.4301948638007878
Energy: 1.1683544009606917
Energy: 1.4407300028901842
Energy: 1.1049642724222304
Energy: 1.4407300028984353
Energy: 1.1570486238972384
Energy: 1.446928365693243
Energy: 1.1058176371835011
Energy: 1.4469283657007443
Energy: 1.120426337936867
Energy: 1.5192624062385285
Energy: 1.1266270661543687
Energy: 1.5192624062415292
Energy: 1.5546576956935079
Energy: 1.6464652488702012
Energy: 1.1057917226169536
Energy: 1.6464652488687008
Energy: 1.1836004720566402
Energy: 1.154637317052333
Energy: 1.128032824224368
Energy: 1.154637317047082
Energy: 1.1959681248608942
Energy: 1.3613653610635552
Energy: 1.1148609000251204
Energy: 1.361365361081558
Energy: 1.12106874360514
Energy: 1.2798129469546253
Energy: 1.1192161336080972
Energy: 1.2798129469441233
Energy: 1.3248448986570318
Energy: 1.4513440172956376
Energy: 1.101496467871895
Energy: 1.451344017304639
Energy: 1.1416017561473184
Energy: 1.4132001874093207
Energy: 1.3566657040463763
Energy: 1.4132001874130713
Energy: 1.120493042153951
Energy: 1.5459255812999244
Energy: 1.1781790136382326
Energy: 1.5459255813104262
Energy: 1.1418304832892425
Energy: 1.6760101291416392
Energy: 1.544442714747219
Energy: 1.67601012914839
Energy: 1.1139746441859308
Energy: 1.358328278182347
Energy: 1.1781690595034429
Energy: 1.358328278188348
Energy: 1.1469413027273159
Energy: 1.6097274129433283
Energy: 1.4126492854647634
Energy: 1.6097274129485792
Energy: 1.119596568640808
Energy: 1.5963115476042435
Energy: 1.1008596188398116
Energy: 1.5963115476124268

minimum gb energy = 1.1008596188398116 eV
minimum distance =  2.20606509134053 Angstroms
sigma value = 37


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

Energy: 1.286710505843371
Energy: 1.2606028574889168
Energy: 1.4565998303524104
Energy: 1.2606028574876262
Energy: 1.2916213625547783
Energy: 1.462402848573821
Energy: 1.0775783360890807
Energy: 1.4624028485725304
Energy: 1.1010231202131973
Energy: 1.7588483969223299
Energy: 1.4563990624342364
Energy: 1.7588483969236204
Energy: 1.1951305634783502
Energy: 1.2399746002877579
Energy: 1.0893597761564644
Energy: 1.2399746002864676
Energy: 1.058536420155155
Energy: 1.4232763878100414
Energy: 1.1219131266340652
Energy: 1.4232763878100414
Energy: 1.0816069772957655
Energy: 1.4669339311609426
Energy: 1.1836777014787243
Energy: 1.4669339311583616
Energy: 1.058752755012379
Energy: 1.7535065541203847
Energy: 1.2407057840363538
Energy: 1.7535065541190942
Energy: 1.025624079923481
Energy: 1.103766528558572
Energy: 1.1155572116331807
Energy: 1.1037665285572815
Energy: 1.0526707771186832
Energy: 1.3310107091659555
Energy: 1.0772885384470978
Energy: 1.3310107091646648
Energy: 1.3915812337898308
Energy: 1.7552521393150475
Energy: 1.1840553711763961
Energy: 1.7552521393137568
Energy: 1.1003932833028687
Energy: 1.6684121311495796
Energy: 1.1968390523416457
Energy: 1.6684121311469984
Energy: 1.4148374176939165
Energy: 1.4256039008648203
Energy: 1.0891870917511706
Energy: 1.4256039008635297
Energy: 1.2004170022861043
Energy: 1.3908265964156767
Energy: 1.2129398886108622
Energy: 1.3908265964156767
Energy: 1.2407649663629792
Energy: 1.7400688573969147
Energy: 1.0237949778598177
Energy: 1.7400688573956242
Energy: 1.2874753978598161
Energy: 1.2898567140157815
Energy: 1.0236872032386966
Energy: 1.2898567140144912
Energy: 1.2626886620350426
Energy: 1.2433502706530206
Energy: 1.0140125908654147
Energy: 1.2433502706530206
Energy: 1.2004235319244012
Energy: 1.7550704387424698
Energy: 1.0667002469216877
Energy: 1.7550704387424698
Energy: 1.1834510105687455
Energy: 1.3456309907804167
Energy: 1.051280388318619
Energy: 1.3456309907752544
Energy: 1.089688750247215
Energy: 1.4272020638658642
Energy: 1.0522818787104333
Energy: 1.4272020638658642
Energy: 1.0498530322932633
Energy: 1.458948947453387
Energy: 1.2011085060368072
Energy: 1.4589489474520962

minimum gb energy = 1.0140125908654147 eV
minimum distance =  2.21557304381065 Angstroms
sigma value = 25


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

Energy: 1.1683446366242587
Energy: 1.5373338200464275
Energy: 1.0984173862558917
Energy: 1.5373338200494506
Energy: 1.3028728389421176
Energy: 1.497271452462614
Energy: 0.9965592550741287
Energy: 1.4972714524616064
Energy: 1.118001078561968
Energy: 1.0758235122517772
Energy: 1.2959821870548835
Energy: 1.0758235122527848
Energy: 1.144785572279245
Energy: 1.3868639221154677
Energy: 0.9962188416879487
Energy: 1.3868639221144599
Energy: 1.0075831316193742
Energy: 1.4969308044658252
Energy: 1.0104715530493091
Energy: 1.4969308044638099
Energy: 1.0547657115562732
Energy: 1.4967993117071998
Energy: 1.0098322444087022
Energy: 1.496799311710223
Energy: 0.9920519420934837
Energy: 1.1980139251738267
Energy: 1.1475289790044907
Energy: 1.198013925171811
Energy: 0.9540222124007691
Energy: 1.389846386639816
Energy: 1.120180978843256
Energy: 1.3898463866418314
Energy: 0.9955905529881227
Energy: 1.4971712737460592
Energy: 1.4188651503804481
Energy: 1.4971712737440437
Energy: 0.9283393251170396
Energy: 1.1834805952174117
Energy: 1.0407131747174887
Energy: 1.1834805952184193
Energy: 0.9917583753359984
Energy: 1.2173754874269131
Energy: 1.24701750146648
Energy: 1.2173754874248974
Energy: 1.2959193436304752
Energy: 1.496132018325916
Energy: 1.1201965559280607
Energy: 1.4961320183289393
Energy: 0.9976060236541603
Energy: 1.389137472135321
Energy: 1.141412138972018
Energy: 1.389137472135321
Energy: 1.230997201734936
Energy: 1.4741055347275769
Energy: 1.0100243659906913
Energy: 1.4741055347275769
Energy: 1.0065915899956017
Energy: 1.0597947799677352
Energy: 1.0505544699425338
Energy: 1.0597947799707126
Energy: 1.1449218518242121
Energy: 1.596952222889068
Energy: 0.9358942060283243
Energy: 1.596952222889068
Energy: 1.1236638764079245
Energy: 1.3774896042172173
Energy: 1.1584193762723751
Energy: 1.3774896042162097
Energy: 1.1681703891232549
Energy: 1.4981464229711545
Energy: 0.995756983913288
Energy: 1.4981464229751853
Energy: 1.1748693207782477
Energy: 1.3142817305479906
Energy: 0.9288569731751907
Energy: 1.3142817305469827
Energy: 1.2765592001057635
Energy: 1.352884685120402
Energy: 0.9710075985832006
Energy: 1.3528846851193943
Energy: 1.1231547421349133
Energy: 1.4862618315448581
Energy: 0.9587577641997133
Energy: 1.4862618315448581
Energy: 1.0794332820347083
Energy: 1.388079743561568
Energy: 1.0000911610650585
Energy: 1.388079743558545
Energy: 1.0067151888252472
Energy: 1.4753031670478136
Energy: 1.2181468910349575
Energy: 1.4753031670488215
Energy: 1.0496718997708447
Energy: 1.5815548674794302
Energy: 0.9907680443724044
Energy: 1.5815548674814457
Energy: 0.9784179462951673
Energy: 1.5242567571825973
Energy: 1.1293496567164187
Energy: 1.5242567571785663
Energy: 0.9424113990037268
Energy: 1.1378507354019007
Energy: 1.126726752800893
Energy: 1.137850735404924

minimum gb energy = 0.9283393251170396 eV
minimum distance =  2.2773856254107 Angstroms
sigma value = 41


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

Energy: 1.2987389207041158
Energy: 1.3009349563241461
Energy: 1.4160980837027508
Energy: 1.3009349563233201
Energy: 1.4106174711343886
Energy: 1.2918404177707266
Energy: 0.9061283112139911
Energy: 1.291840417769074
Energy: 0.9252063139132948
Energy: 1.2884929294425782
Energy: 1.4165088330515092
Energy: 1.2884929294434044
Energy: 1.1314086883434131
Energy: 1.2915273671234937
Energy: 0.906406971812658
Energy: 1.29152736712432
Energy: 0.9004884120533813
Energy: 1.3139286135703998
Energy: 0.8521640848583507
Energy: 1.3139286135720523
Energy: 0.9318169620572532
Energy: 1.2914208703096683
Energy: 0.9057872419080597
Energy: 1.2914208703096683
Energy: 0.9051437775560931
Energy: 1.2913334336943367
Energy: 0.9287590846860542
Energy: 1.2913334336959892
Energy: 0.8496844134213758
Energy: 1.0881142727696314
Energy: 0.9015623596492377
Energy: 1.0881142727688051
Energy: 0.8540866386432574
Energy: 1.4682063467234143
Energy: 1.1315471595065547
Energy: 1.4682063467234143
Energy: 1.1736485557312972
Energy: 1.28832348785597
Energy: 0.9282697087446312
Energy: 1.288323487857622
Energy: 0.9056270606387691
Energy: 1.2771201612952883
Energy: 1.411372462553255
Energy: 1.2771201612952883
Energy: 0.8526117017153331
Energy: 1.3001327125009488
Energy: 1.2992402507174874
Energy: 1.3001327125009488
Energy: 0.9082740886036847
Energy: 1.3707715185995968
Energy: 1.411247360793364
Energy: 1.3707715185995968
Energy: 1.1757461856102955
Energy: 0.9196136685270743
Energy: 0.9282500932660773
Energy: 0.9196136681332041
Energy: 0.9057936266995027
Energy: 1.2918588599342373
Energy: 1.1638491215552977
Energy: 1.2918588599342373
Energy: 1.1760336825306514
Energy: 1.3080099329993282
Energy: 0.9016781516807051
Energy: 1.3080099329985022
Energy: 0.9078822347697134
Energy: 1.3917430457514908
Energy: 0.9364948581893575
Energy: 1.3917430457506645
Energy: 0.9251666292087877
Energy: 0.9203701665830224
Energy: 0.905776093629405
Energy: 0.9203701665846749
Energy: 0.9055238539278123
Energy: 1.0899870147699804
Energy: 0.849225450285751
Energy: 1.0899870147708066
Energy: 0.9451561089385219
Energy: 1.112063287408103
Energy: 0.8810864079475573
Energy: 1.112063287401493
Energy: 0.9320857876081596
Energy: 1.4143947550706597
Energy: 0.8640568412789841
Energy: 1.4143947550706597
Energy: 1.4158451327679555
Energy: 1.5054696779241554
Energy: 0.852404198175794
Energy: 1.5054696779258077
Energy: 1.2663910747582823
Energy: 1.270651653536628
Energy: 0.8529698424329852
Energy: 1.2706516535457162
Energy: 1.1763488351854379
Energy: 1.1182024888417448
Energy: 0.8833118084525973
Energy: 1.1182024888400923
Energy: 0.93208817276895
Energy: 1.1939713052890268
Energy: 0.882012904923346
Energy: 1.193971305290679
Energy: 1.1359910320686588
Energy: 0.9474935483016641
Energy: 0.853228164157989
Energy: 0.947493548300838
Energy: 0.9056232503286892
Energy: 1.3081774816110923
Energy: 1.1034397031366783
Energy: 1.3081774816110923
Energy: 0.8509295314896895
Energy: 1.390056357054061
Energy: 0.9053137048252827
Energy: 1.3900563570548872
Energy: 0.8825962092481601
Energy: 1.2233287896260587
Energy: 0.9260598693479477
Energy: 1.2233287896260587
Energy: 0.8484863675424021
Energy: 1.1595198733269256
Energy: 0.8504031527333136
Energy: 1.1595198733260994
Energy: 0.8536151971468388
Energy: 1.0979533176639809
Energy: 0.9446416104386599
Energy: 1.0979533176631546
Energy: 0.8524696266878512
Energy: 1.3953821057931575
Energy: 0.9369441516477981
Energy: 1.3953821057939837

minimum gb energy = 0.8484863675424021 eV
minimum distance =  2.25464703252787 Angstroms
sigma value = 15


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

Energy: 1.1907988311740039
Energy: 0.8052279064663393
Energy: 1.3455757727322117
Energy: 0.8052279064663393
Energy: 1.4417942975042863
Energy: 0.970225052717468
Energy: 0.8501042448108338
Energy: 0.9702250527195677
Energy: 0.8726330736463603
Energy: 1.1638321598189485
Energy: 1.3463287276473557
Energy: 1.1638321598189485
Energy: 1.2763611343424128
Energy: 0.9708090466875537
Energy: 0.8499077341197491
Energy: 0.970809046692453
Energy: 0.84572128602155
Energy: 1.1076190330068794
Energy: 1.0630693386241161
Energy: 1.107619033009679
Energy: 1.051576952983988
Energy: 0.970891009501823
Energy: 0.8501475502148481
Energy: 0.9708910095011231
Energy: 0.8488725440763943
Energy: 1.1719937556525468
Energy: 0.8580100635551823
Energy: 1.1719937556539468
Energy: 0.8602628703394987
Energy: 1.1753710457427575
Energy: 0.8496789457199294
Energy: 1.1753710457448572
Energy: 0.8519311139195208
Energy: 0.8625900740457467
Energy: 1.050836642562892
Energy: 0.8625900740436468
Energy: 0.7909560854735328
Energy: 0.9710689401887761
Energy: 0.8466510565579165
Energy: 0.9710689401684788
Energy: 0.8491107517103647
Energy: 0.9963540578686765
Energy: 1.2775412435688165
Energy: 0.9963540578693765
Energy: 1.0999275358753198
Energy: 1.1640130212139983
Energy: 0.8748137127196415
Energy: 1.1640130212118986
Energy: 0.8519276372431706
Energy: 0.8620362079982417
Energy: 1.4411570290989244
Energy: 0.8620362080010412
Energy: 0.7882833146277254
Energy: 0.8056062758983975
Energy: 1.1696917317826876
Energy: 0.8056062759095961
Energy: 0.8497078084635
Energy: 0.9702017609971848
Energy: 1.4421798762744722
Energy: 0.9702017609992846
Energy: 1.101237822945575
Energy: 1.164348331668242
Energy: 0.8749931679795016
Energy: 1.1643483316703416
Energy: 0.8515581788038796
Energy: 0.8607079992692916
Energy: 1.273639611713771
Energy: 0.8607079992678919
Energy: 1.1015360157099878
Energy: 1.1147317476346508
Energy: 0.8468820787203635
Energy: 1.1147317476360505
Energy: 0.8497585350886451
Energy: 0.9838538072126748
Energy: 1.0536443053871896
Energy: 0.9838538072098753
Energy: 0.8549884530971197
Energy: 1.172302978619932
Energy: 0.8496303925006041
Energy: 1.172302978618532
Energy: 0.8517079784268752
Energy: 1.016556198435117
Energy: 0.863434084278971
Energy: 1.0165561984372167
Energy: 0.8604683986538758
Energy: 0.8399362201797433
Energy: 0.8560870979475256
Energy: 0.8399362201825429
Energy: 0.8492411821192756
Energy: 0.8046011915130361
Energy: 0.7905492831021742
Energy: 0.804601191506737
Energy: 1.2707507399794469
Energy: 0.9838612221200339
Energy: 0.8510984165897195
Energy: 0.9838612221256331
Energy: 0.8771847680893172
Energy: 0.8749001502446359
Energy: 1.0976672699476655
Energy: 0.8749001502474354
Energy: 1.3382660152849433
Energy: 0.8396759934502716
Energy: 0.8549792016978858
Energy: 0.8396759934411727
Energy: 1.1970792838241298
Energy: 0.8345791857287441
Energy: 0.7927832951330576
Energy: 0.8345791857259444
Energy: 1.4445339824720544
Energy: 0.9704346088095459
Energy: 0.8511948241764888
Energy: 0.9704346088151452
Energy: 0.8774388770464735
Energy: 1.1285236072919964
Energy: 0.8047235608289673
Energy: 1.1285236073059943
Energy: 1.0439213162199277
Energy: 0.8593047085421063
Energy: 0.8550543118050358
Energy: 0.8593047085421063
Energy: 0.8498228957407953
Energy: 1.1051690110703105
Energy: 0.9925955025065177
Energy: 1.1051690110710106
Energy: 1.0372554439529216
Energy: 0.9836334750908727
Energy: 0.8516719909847774
Energy: 0.9836334750929725
Energy: 0.8514902722876898
Energy: 1.43286919239641
Energy: 0.8569512323019124
Energy: 1.4328691923971097
Energy: 0.8038296825766206
Energy: 1.0277768798259108
Energy: 0.8552525027851674
Energy: 1.0277768798266105
Energy: 0.8459086044270513
Energy: 1.1034921069495742
Energy: 0.8621326927893387
Energy: 1.1034921069516739
Energy: 0.7903918318210311
Energy: 0.8049261857663143
Energy: 0.8539037374033859
Energy: 0.8049261857677139
Energy: 0.853611292274548
Energy: 1.151651413794145
Energy: 1.2696913177761016
Energy: 1.151651413795545

minimum gb energy = 0.7882833146277254 eV
minimum distance =  2.28514763128628 Angstroms
sigma value = 85


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

Energy: 1.191205391674708
Energy: 0.9671907332514971
Energy: 0.8455490653410854
Energy: 0.96719073325089
Energy: 1.4784378498453348
Energy: 0.9398009848431221
Energy: 0.7753930997198928
Energy: 0.9398009848461573
Energy: 1.1502800302902343
Energy: 1.016543084904642
Energy: 0.8732830853956323
Energy: 1.0165430849028207
Energy: 1.3997599245277124
Energy: 0.9388965125500327
Energy: 0.7765153987814255
Energy: 0.9388965125482392
Energy: 0.8846052330246643
Energy: 0.9644763241484483
Energy: 0.8127536452076453
Energy: 0.9644763241448061
Energy: 1.2541817444337722
Energy: 1.01861335163134
Energy: 0.7754766351915869
Energy: 1.018613351626484
Energy: 0.8471801489103238
Energy: 1.0907850457731072
Energy: 0.9027042254469413
Energy: 1.0907850457718933
Energy: 1.0591529385445382
Energy: 0.9364431917039269
Energy: 0.7842470928527154
Energy: 0.9364431917021058
Energy: 0.7830183628394257
Energy: 1.0389472607274521
Energy: 1.0776142066715149
Energy: 1.0389472607292731
Energy: 0.9178797852918453
Energy: 1.080090825207069
Energy: 0.848151437546894
Energy: 1.080090825207069
Energy: 0.7777243378169575
Energy: 0.9235557255058665
Energy: 1.2284379858744952
Energy: 0.9235557255076877
Energy: 0.7926991326001055
Energy: 0.8736545240788122
Energy: 0.8848476390587362
Energy: 0.8736545240763841
Energy: 0.7770241696741526
Energy: 1.0513590206508197
Energy: 1.3929637504450008
Energy: 1.0513590206459633
Energy: 0.7332416099395995
Energy: 1.0103829167964062
Energy: 1.1528258299012155
Energy: 1.0103829167964062
Energy: 0.7773244222286084
Energy: 0.937165231155896
Energy: 1.4790747480067914
Energy: 0.9371652311546821
Energy: 0.7163027544632973
Energy: 0.8151741149046897
Energy: 1.1129005311328302
Energy: 0.8151741149040826
Energy: 0.7768712805163763
Energy: 1.0287753842785512
Energy: 1.4315291377305301
Energy: 1.028775384274909
Energy: 0.8761168235611531
Energy: 1.010480792073039
Energy: 1.153150017296932
Energy: 1.0104807920736463
Energy: 0.7772281090963341
Energy: 0.9365466399801986
Energy: 1.3984345984075173
Energy: 0.9365466399723074
Energy: 0.8964583274844293
Energy: 1.135745536145214
Energy: 0.8850268472162196
Energy: 1.135745536145821
Energy: 0.7777233186184195
Energy: 0.9964652884056792
Energy: 1.2544916688717167
Energy: 0.9964652884008232
Energy: 0.9019445111254221
Energy: 1.070610761644738
Energy: 0.8481545962891759
Energy: 1.070610761640489
Energy: 0.786283132880893
Energy: 0.8732414746723002
Energy: 1.0611657564580483
Energy: 0.8732414746716931
Energy: 0.9269231888859322
Energy: 0.8350836442338931
Energy: 0.7843201853896586
Energy: 0.8350836442369284
Energy: 0.8521341745383645
Energy: 1.0049583528957629
Energy: 0.9014963376067859
Energy: 1.0049583528939419
Energy: 1.2287356364726485
Energy: 0.9365979192037757
Energy: 0.7768219283302622
Energy: 0.9365979191989194
Energy: 0.8868758803722465
Energy: 0.8075533125903768
Energy: 0.7932591969412583
Energy: 0.8075533125885557
Energy: 1.2354399455420253
Energy: 0.8350678500704132
Energy: 0.7774628335335378
Energy: 0.8350678500673782
Energy: 1.1545648292000903
Energy: 1.0097451160190047
Energy: 1.0031411823135319
Energy: 1.0097451160165767
Energy: 1.480481738480097
Energy: 0.9366218126355641
Energy: 0.7755445043553209
Energy: 0.9366218126379922
Energy: 1.1919490814446594
Energy: 0.8207307995675932
Energy: 0.7161446995240499
Energy: 0.8207308001415659
Energy: 1.39951344724218
Energy: 0.8311016870522456
Energy: 0.777411512736674
Energy: 0.8311016870546738
Energy: 1.1545736034448786
Energy: 1.0093522250244849
Energy: 0.7354578263710992
Energy: 1.0093522250232707
Energy: 1.4003940657891585
Energy: 0.9365703122041509
Energy: 0.7801167043511377
Energy: 0.936570312205365
Energy: 0.8868840392527586
Energy: 1.0664068557879312
Energy: 0.8958022450783235
Energy: 1.0664068557891453
Energy: 1.0886986089903927
Energy: 0.9081730853156165
Energy: 0.7798966869571196
Energy: 0.9081730853174376
Energy: 0.8521006622180224
Energy: 1.0904739646988078
Energy: 0.9005278174744796
Energy: 1.0904739646951658
Energy: 1.0433982696592237
Energy: 0.8729819996912401
Energy: 0.7832879292677971
Energy: 0.8729819996912401
Energy: 0.7863464727935919
Energy: 1.06291220727377
Energy: 0.9273098777959082
Energy: 1.0629122072779917
Energy: 0.803197959161663
Energy: 0.9205611522500621
Energy: 0.8513271745632018
Energy: 0.9205611522543112
Energy: 0.7605968338342266
Energy: 0.9365387080116556
Energy: 1.2286639880042367
Energy: 0.9365387080116556
Energy: 0.7931978566841068
Energy: 0.8069423719861746
Energy: 0.8900063701089745
Energy: 0.8069423719837464
Energy: 0.7784460763002715
Energy: 1.063368240236319
Energy: 1.2359001218516892
Energy: 1.0633682402338913

minimum gb energy = 0.7161446995240499 eV
minimum distance =  2.28243711916451 Angstroms
sigma value = 113


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

Energy: 0.02053258459434267
Energy: 0.02113092260753129
Energy: 0.6148207001577122
Energy: 0.021130922607116485
Energy: 0.614426365704568
Energy: 0.47740944629067705
Energy: 0.4768834631532477
Energy: 0.47740944629067705
Energy: 0.02053258459434267
Energy: 0.021130922607997944
Energy: 0.6148207001586454
Energy: 0.021130922606183183
Energy: 0.614426365704568
Energy: 0.4774094462897956
Energy: 0.47688346211562166
Energy: 0.4774094462911437
Energy: 0.02053258459387602
Energy: 0.021130922607997944
Energy: 0.6148207001572454
Energy: 0.021130922607116485
Energy: 0.614426365704568
Energy: 0.4774094462902623
Energy: 0.4768834623313703
Energy: 0.47740944629067705

minimum gb energy = 0.02053258459387602 eV
minimum distance =  2.48906515099528 Angstroms
sigma value = 1