Model name: model_name=MEAM_LAMMPS_LeeShimBaskes_2003_Pb__MO_019208265157_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Pb
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.9497474655508995
cohesive_energy=2.0401604561541418
mass=207.2
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=[5.63225969563092e-20, 9.06032488703634e-20, 1.197364276947024e-19, 1.45190848749714e-19, 1.6774789357979998e-19, 1.87901673458886e-19, 2.05990247656746e-19, 2.22266760081552e-19, 2.36923471929384e-19, 2.5011579433373995e-19, 2.61967094895438e-19, 2.72583117272322e-19, 2.82050379002628e-19, 2.90447386741422e-19, 2.9783982973069797e-19, 3.04282181976012e-19, 3.0982891748292e-19, 3.1452329502053997e-19, 3.1840857335798996e-19, 3.2151839820458395e-19, 3.2388801744626997e-19, 3.2554627026245995e-19, 3.2652359800919994e-19, 3.26844033336e-19, 3.2649636100642196e-19, 3.2536522430281796e-19, 3.2329841644495798e-19, 3.20111687119932e-19, 3.15587140305516e-19, 3.0945881468046595e-19, 3.0139986621144597e-19, 2.91016159446492e-19, 2.7782063268886794e-19, 2.6120606099428797e-19, 2.40424227874674e-19, 2.1452984911596596e-19, 1.82326098772566e-19, 1.422864229475988e-19, 9.244206699320519e-20, 3.02260235063904e-20, -4.77543165353406e-20, -1.4603423452985158e-19, -2.70774259852536e-19, -4.3049044196609397e-19, -6.37179238635264e-19, -9.08131340094174e-19, -1.268903065831758e-18, -1.75843692111402e-18, -2.4382244451538796e-18, -3.4096241383480796e-18, -4.84876327807224e-18, -7.0825820282604e-18, -1.0772555034025798e-17, -1.7421748282789198e-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: 0.0041972167816281035
Energy: 0.004900487817986689
Energy: 0.1683476476008087
Energy: 0.004900487817661426
Energy: 0.004900487817986689
Energy: 0.28253320211770133
Energy: 0.004900487817986689
Energy: 0.2825332244811995
Energy: 0.1683476473336756
Energy: 0.004900487817661426
Energy: 0.0041972167816281035
Energy: 0.004900487817661426
Energy: 0.004900487817661426
Energy: 0.2825331978908925
Energy: 0.004900487817661426
Energy: 0.2825332126898071

minimum gb energy = 0.0041972167816281035 eV
minimum distance =  3.3681305902424 Angstroms
sigma value = 1


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

Energy: 0.3353759249716078
Energy: 0.24278305872629335
Energy: 0.26257105135761727
Energy: 0.24278305872629335
Energy: 0.23423801338651387
Energy: 0.26801985853409727
Energy: 0.237865155521859
Energy: 0.268019858534503
Energy: 0.2628308787175359
Energy: 0.26268184749004386
Energy: 0.36505043715141605
Energy: 0.26268184749004386
Energy: 0.23919775113964575
Energy: 0.2379860022292164
Energy: 0.23809678960147812
Energy: 0.23798600408385082
Energy: 0.31250859739430314
Energy: 0.23804140452281428
Energy: 0.2388858688150138
Energy: 0.23804140452281428
Energy: 0.2491103343978255
Energy: 0.26077970282853147
Energy: 0.2377515627662911
Energy: 0.26077970282853147
Energy: 0.24546246166225388
Energy: 0.24981167839134136
Energy: 0.3122455001841285
Energy: 0.24981167839134136
Energy: 0.2525817421850623
Energy: 0.3059130225052393
Energy: 0.2619164930958714
Energy: 0.3059130225052393
Energy: 0.27162978654499537
Energy: 0.26009157391866206
Energy: 0.27283098604818906
Energy: 0.26009157391906784
Energy: 0.26302657445477634
Energy: 0.2996244872381429
Energy: 0.25477006992534107
Energy: 0.2996244872381429
Energy: 0.2891701649476281
Energy: 0.25997785525396233
Energy: 0.2720238882810683
Energy: 0.25997785525396233
Energy: 0.24616095204409422
Energy: 0.2694356467184362
Energy: 0.2619854296010652
Energy: 0.2694356467184362
Energy: 0.24454040641167576
Energy: 0.24950790952089652
Energy: 0.3358693271192507
Energy: 0.24950790952130222
Energy: 0.2490672684820497
Energy: 0.2494894695344231
Energy: 0.2492828726820608
Energy: 0.2494894695344231
Energy: 0.3355144282072009
Energy: 0.2377912945185581
Energy: 0.23802485028278422
Energy: 0.2377912945181523
Energy: 0.25081920071856634
Energy: 0.237971415227853
Energy: 0.23827582926216187
Energy: 0.237971415227853
Energy: 0.2626498093265543
Energy: 0.2626708846968062
Energy: 0.393937916278969
Energy: 0.26267088469721195
Energy: 0.23809698199010806
Energy: 0.23761238002764956
Energy: 0.2342032591074225
Energy: 0.2376123800308955
Energy: 0.3650378805977969
Energy: 0.26270808759619807
Energy: 0.2630515739881075
Energy: 0.26270808759619807
Energy: 0.24877816077599124
Energy: 0.2605383894707691
Energy: 0.23916139480598592
Energy: 0.26053838947117486
Energy: 0.2384046882222972
Energy: 0.2378604963346786
Energy: 0.31258392284011166
Energy: 0.2378604963346786
Energy: 0.23769250020715219
Energy: 0.26082535366508497
Energy: 0.24885959099510047
Energy: 0.2608253536654907
Energy: 0.3123562441189461
Energy: 0.2501482216409344
Energy: 0.2454077345316154
Energy: 0.2501482216409344
Energy: 0.2617423973897762
Energy: 0.24584425715032335
Energy: 0.25290664470193813
Energy: 0.24584425715032335
Energy: 0.25941645603206687
Energy: 0.2601399160844174
Energy: 0.27171018351288956
Energy: 0.2601399160844174
Energy: 0.25530569868122305
Energy: 0.26478159042998994
Energy: 0.2635730721792881
Energy: 0.26478159043039573
Energy: 0.2718334912080658
Energy: 0.260055608753144
Energy: 0.29081501637805146
Energy: 0.260055608753144
Energy: 0.26213998711636183
Energy: 0.26914544935110785
Energy: 0.24634313027286434
Energy: 0.2691454493515136
Energy: 0.23489968844301115
Energy: 0.2494129507464564
Energy: 0.2443663410554965
Energy: 0.2494129507464564
Energy: 0.24916519569735002
Energy: 0.2500697538325831
Energy: 0.24909951595995572
Energy: 0.25006975383298885
Energy: 0.23780394871152863
Energy: 0.2378844968023868
Energy: 0.33583250363610573
Energy: 0.2378844968023868
Energy: 0.2379799721386221
Energy: 0.237930978968899
Energy: 0.2508037421119793
Energy: 0.2379309789680875
Energy: 0.2599811797652612
Energy: 0.23896500491729253
Energy: 0.26292447972476113
Energy: 0.23896500489621234

minimum gb energy = 0.2342032591074225 eV
minimum distance =  3.12491801843321 Angstroms
sigma value = 1


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

Energy: 0.3814495001599403
Energy: 0.2513208015337791
Energy: 0.27477442702688665
Energy: 0.2513208015337791
Energy: 0.24408849389540305
Energy: 0.279093681547742
Energy: 0.2470634126734874
Energy: 0.2790936815482046
Energy: 0.2747155083070769
Energy: 0.2750346149940689
Energy: 0.3502156395134907
Energy: 0.2750346149940689
Energy: 0.24857828009530483
Energy: 0.24743374399441861
Energy: 0.24708956824944223
Energy: 0.24743374399349338
Energy: 0.3500659204753254
Energy: 0.2470716002166629
Energy: 0.24760521731005875
Energy: 0.2470716002166629
Energy: 0.26093055964477724
Energy: 0.2717284329022572
Energy: 0.24749154838996795
Energy: 0.2717284329022572
Energy: 0.2582148746168735
Energy: 0.2622551832819179
Energy: 0.2951662307884472
Energy: 0.2622551832828431
Energy: 0.26269062690820477
Energy: 0.25914608599985417
Energy: 0.2752302344556819
Energy: 0.25914608599985417
Energy: 0.2955315296275066
Energy: 0.27391202611363763
Energy: 0.272292729590783
Energy: 0.27391202611317506
Energy: 0.27465414413724304
Energy: 0.2826322712342613
Energy: 0.2634415534182414
Energy: 0.2826322712342613
Energy: 0.3190772126031341
Energy: 0.26197850067330436
Energy: 0.25817282210924863
Energy: 0.261978500673767
Energy: 0.2612152306269608
Energy: 0.26201506325926965
Energy: 0.26102013255511153
Energy: 0.2620150632597323
Energy: 0.2476381973099746
Energy: 0.2472259027202191
Energy: 0.3185653798864405
Energy: 0.2472259027206817
Energy: 0.2471083231351506
Energy: 0.24750922208195167
Energy: 0.2615316432581115
Energy: 0.24750922208241424
Energy: 0.3812146229615236
Energy: 0.2749608593619561
Energy: 0.2745376367103693
Energy: 0.27496085936241865
Energy: 0.2442144999548581
Energy: 0.24705135236148262
Energy: 0.247086252132701
Energy: 0.24705135236101997
Energy: 0.27531955489488424
Energy: 0.27497232205206545
Energy: 0.3503852619934659
Energy: 0.27497232205206545
Energy: 0.24847216099094244
Energy: 0.2583545416977538
Energy: 0.2607186820315584
Energy: 0.2583545416977538
Energy: 0.35024075049047076
Energy: 0.24716758393345262
Energy: 0.2473060694413211
Energy: 0.24716758393299001
Energy: 0.26082353879073306
Energy: 0.27117721797761074
Energy: 0.24712091358863253
Energy: 0.27117721797807337
Energy: 0.2583546168847564
Energy: 0.2628966466040954
Energy: 0.29517104539076694
Energy: 0.2628966466040954
Energy: 0.26240822556616594
Energy: 0.258886493607459
Energy: 0.2751059044443258
Energy: 0.25888649360838434
Energy: 0.2955976709164409
Energy: 0.27404611346480556
Energy: 0.27309743831951366
Energy: 0.27404611346480556
Energy: 0.2744113288033013
Energy: 0.27544173132912025
Energy: 0.25753061871786664
Energy: 0.27544173132912025
Energy: 0.24451858475732738
Energy: 0.2618513199613173
Energy: 0.25798755295700854
Energy: 0.261851319960392
Energy: 0.2678687456462367
Energy: 0.26259989055191635
Energy: 0.26099769929121386
Energy: 0.2625998905251055
Energy: 0.2472460805197938
Energy: 0.24718292055211297
Energy: 0.31962713888961264
Energy: 0.24718292055118773
Energy: 0.24715379856310418
Energy: 0.24736869292136499
Energy: 0.2615619864373795
Energy: 0.24736869292182764
Energy: 0.26160376914740774
Energy: 0.2483882898929383
Energy: 0.274816875099872
Energy: 0.24838828989386352

minimum gb energy = 0.24408849389540305 eV
minimum distance =  3.12298482786933 Angstroms
sigma value = 25


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

Energy: 0.3623871064547624
Energy: 0.2601479145476279
Energy: 0.2880804031917868
Energy: 0.2601479145476279
Energy: 0.25481208366567554
Energy: 0.2896786615844979
Energy: 0.2566520780759701
Energy: 0.2896786615844979
Energy: 0.28787496950871294
Energy: 0.28786818335648184
Energy: 0.32928588439611345
Energy: 0.28786818335701964
Energy: 0.2588478034022846
Energy: 0.2569679077608419
Energy: 0.25666492480456193
Energy: 0.2569679077608419
Energy: 0.32977171527937627
Energy: 0.25682783072040416
Energy: 0.2572162867794079
Energy: 0.25682783072040416
Energy: 0.27549711281869355
Energy: 0.28334199454231246
Energy: 0.25716275115319587
Energy: 0.28334199454231246
Energy: 0.276912733487224
Energy: 0.278178749455336
Energy: 0.27561408465219467
Energy: 0.278178749455336
Energy: 0.27254072232035703
Energy: 0.2752953418590808
Energy: 0.2880831361730083
Energy: 0.2752953418590808
Energy: 0.27571615162921553
Energy: 0.27782185608772997
Energy: 0.2977641699905686
Energy: 0.27782185608772997
Energy: 0.2755708828363368
Energy: 0.2867971426473743
Energy: 0.25710602109825603
Energy: 0.2867971426473743
Energy: 0.36351167474985646
Energy: 0.25670861042797355
Energy: 0.2566857422650504
Energy: 0.25670861042797355
Energy: 0.2728633650283104
Energy: 0.2571687405640593
Energy: 0.2565809184450256
Energy: 0.25716874056459704
Energy: 0.2876772685119009
Energy: 0.2878477413659379
Energy: 0.36267058708848
Energy: 0.2878477413659379
Energy: 0.25663624233587884
Energy: 0.25675529729845437
Energy: 0.2547754054714388
Energy: 0.25675529726566176
Energy: 0.32952232928762454
Energy: 0.28814751758373036
Energy: 0.288282767088705
Energy: 0.28814751758373036
Energy: 0.2753743248128971
Energy: 0.2565886262972664
Energy: 0.25879003191145994
Energy: 0.2565886262972664
Energy: 0.25672389965362225
Energy: 0.25677861695837934
Energy: 0.3299632679532155
Energy: 0.25677861695837934
Energy: 0.25673565612763016
Energy: 0.25673140493278646
Energy: 0.2755608017507029
Energy: 0.25673140493278646
Energy: 0.2753396159352359
Energy: 0.27920908303009423
Energy: 0.26948769833852587
Energy: 0.2792090830295565
Energy: 0.28878861960672564
Energy: 0.2754435895597717
Energy: 0.27355793626274805
Energy: 0.2754435895597717
Energy: 0.3007977553251884
Energy: 0.2776859771262924
Energy: 0.27554762174457015
Energy: 0.2776859771262924
Energy: 0.2710448195802544
Energy: 0.2849283112011844
Energy: 0.2754794207549317
Energy: 0.2849283112011844
Energy: 0.2562902584706064
Energy: 0.25673620259474783
Energy: 0.25839288082845113
Energy: 0.25673620259474783
Energy: 0.2566003530579587
Energy: 0.2568217836584371
Energy: 0.27292903153627956
Energy: 0.2568217836584371
Energy: 0.2579924097867633
Energy: 0.258779332412692
Energy: 0.28802821912319304
Energy: 0.25877933241215423

minimum gb energy = 0.2547754054714388 eV
minimum distance =  3.12888979566615 Angstroms
sigma value = 9


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

Energy: 0.3661654412815397
Energy: 0.28536839350933463
Energy: 0.3066638257475984
Energy: 0.28536839350933463
Energy: 0.2822917497291649
Energy: 0.30364476784752553
Energy: 0.273614397964755
Energy: 0.30364476784746
Energy: 0.307170667820008
Energy: 0.30698672599806676
Energy: 0.42915375518379145
Energy: 0.3069867259980011
Energy: 0.27925857412082067
Energy: 0.2734300347921937
Energy: 0.2736750419201826
Energy: 0.2734300347921937
Energy: 0.3188860728285382
Energy: 0.2736250573120088
Energy: 0.2734706957435974
Energy: 0.27362505731214
Energy: 0.3021455964811997
Energy: 0.3091961599491276
Energy: 0.28261056209057
Energy: 0.30919615994906197
Energy: 0.28768042717311054
Energy: 0.30251544948804715
Energy: 0.3158263563160528
Energy: 0.3025154494881055
Energy: 0.28689409002933547
Energy: 0.3002516940014241
Energy: 0.30278207649718875
Energy: 0.3002516940013585
Energy: 0.287301062327902
Energy: 0.287732829347337
Energy: 0.2715718558083409
Energy: 0.2877328293476578
Energy: 0.26973526120873037
Energy: 0.2700303109775905
Energy: 0.27150589374438994
Energy: 0.27003031097778735
Energy: 0.3346691642683495
Energy: 0.2698585695660582
Energy: 0.26957756962288215
Energy: 0.2698585695660582
Energy: 0.26970057424504623
Energy: 0.2628264480313078
Energy: 0.2696999449427195
Energy: 0.2628264480313734
Energy: 0.32007902905984065
Energy: 0.31996421464102953
Energy: 0.27992279304262724
Energy: 0.31996421464109515
Energy: 0.27525396376416733
Energy: 0.27547933303976646
Energy: 0.28719913121345786
Energy: 0.27547933303976646
Energy: 0.3190902043514884
Energy: 0.27970399671180474
Energy: 0.28086801799027306
Energy: 0.2797039967118703
Energy: 0.30122489928552226
Energy: 0.281807273887924
Energy: 0.28075473740571755
Energy: 0.28180727388785837
Energy: 0.2863937937125155
Energy: 0.2995782056157663
Energy: 0.30961845102873575
Energy: 0.2995782056157663
Energy: 0.2857482902559973
Energy: 0.30097438812543786
Energy: 0.29759768131017267
Energy: 0.3009743881253723
Energy: 0.27321024988656367
Energy: 0.2733995497453453
Energy: 0.2713029455607106
Energy: 0.27339954974554215
Energy: 0.2823006048109848
Energy: 0.2735989905228942
Energy: 0.27141917191971676
Energy: 0.2735989905228286
Energy: 0.2712387188683186
Energy: 0.29243599450751956
Energy: 0.3066610346786468
Energy: 0.29243599450757796

minimum gb energy = 0.2628264480313078 eV
minimum distance =  3.09926104560588 Angstroms
sigma value = 25


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

Energy: 0.2926586662881995
Energy: 0.2687820853895816
Energy: 0.31301194569547763
Energy: 0.2687820853895816
Energy: 0.26478472547691984
Energy: 0.2909953018481461
Energy: 0.2746997799761426
Energy: 0.29099530184806494
Energy: 0.3127927738171564
Energy: 0.31264679610559026
Energy: 0.3638568447724079
Energy: 0.31264679610559026
Energy: 0.2667814834658517
Energy: 0.2966015603032902
Energy: 0.2744966604000182
Energy: 0.29660156030344353
Energy: 0.27904659272177
Energy: 0.2809341392412417
Energy: 0.28067772444883077
Energy: 0.2809341392413228
Energy: 0.26660995834308515
Energy: 0.3025968847458693
Energy: 0.27427697877810914
Energy: 0.30259688474626606
Energy: 0.2947352494266198
Energy: 0.2813634299679638
Energy: 0.27998754953314947
Energy: 0.2813634299681261
Energy: 0.26480840369718833
Energy: 0.29669920805651767
Energy: 0.2747972876419207
Energy: 0.29669920805651767
Energy: 0.31233044016331823
Energy: 0.3129083252847701
Energy: 0.2659085603577431
Energy: 0.3129083252850045
Energy: 0.2748062186469673
Energy: 0.2968609085069183
Energy: 0.2646780269105239
Energy: 0.2968609085068372
Energy: 0.2828369511430379
Energy: 0.3130024667806747
Energy: 0.31284521579950514
Energy: 0.3130024667805936
Energy: 0.2659929284511845
Energy: 0.2913081608377446
Energy: 0.26666941725218885
Energy: 0.2913081608378257
Energy: 0.2751344629223986
Energy: 0.2855404804519724
Energy: 0.27894582518946853
Energy: 0.2855404804519724
Energy: 0.28403842938828444
Energy: 0.28081426284247796
Energy: 0.26675049875846324
Energy: 0.28081426284247796
Energy: 0.2795269980450326
Energy: 0.28216906201255937
Energy: 0.3008952957148862
Energy: 0.28216906201232494
Energy: 0.27432864355593745
Energy: 0.2967137320473934
Energy: 0.29983408565561076
Energy: 0.2967137320473934
Energy: 0.2655835476344177
Energy: 0.28487488583984744
Energy: 0.312789410714029
Energy: 0.2848748858399286

minimum gb energy = 0.2646780269105239 eV
minimum distance =  3.13559971749883 Angstroms
sigma value = 17


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

Energy: 0.42030195260872755
Energy: 0.32217639976553053
Energy: 0.3490673195661669
Energy: 0.32217639976553053
Energy: 0.26751667321341693
Energy: 0.28176436423364276
Energy: 0.281028364987274
Energy: 0.28176436423319345
Energy: 0.2957043292237659
Energy: 0.2952150239522234
Energy: 0.37934413429420266
Energy: 0.2952150239522234
Energy: 0.28157453159250667
Energy: 0.3017410795779313
Energy: 0.28104976397719617
Energy: 0.3017410795779313
Energy: 0.3119375969348616
Energy: 0.30250323380647254
Energy: 0.2856499819951925
Energy: 0.30250323380647254
Energy: 0.2818688088005961
Energy: 0.3036504704409213
Energy: 0.2966793748349495
Energy: 0.3036504704404822
Energy: 0.33906788722729647
Energy: 0.29622529653508756
Energy: 0.2946984873747023
Energy: 0.29622529653553686
Energy: 0.2941479783348785
Energy: 0.2813525092991936
Energy: 0.27475480046989376
Energy: 0.28135250929964295
Energy: 0.3500635873413168
Energy: 0.3497890114811346
Energy: 0.3198527970548259
Energy: 0.34978901148068525
Energy: 0.2945570743076979
Energy: 0.3020748320971531
Energy: 0.281078553476432
Energy: 0.3020748320971531
Energy: 0.31119153592151244
Energy: 0.27686683802272566
Energy: 0.2837892069213973
Energy: 0.27686683802272566
Energy: 0.2954161498695815
Energy: 0.2765053578746041
Energy: 0.2767371824066579
Energy: 0.2765053578746041
Energy: 0.2939579808417343
Energy: 0.2767404702489435
Energy: 0.27623904183011005
Energy: 0.27674047024939286
Energy: 0.29408371216279927
Energy: 0.2950227043814208
Energy: 0.27492807124386837
Energy: 0.2950227043814208
Energy: 0.3095409573819164
Energy: 0.31890110986278875
Energy: 0.29424031425772346
Energy: 0.31890110986278875
Energy: 0.350184589882343
Energy: 0.29487755708274505
Energy: 0.2948930465805438
Energy: 0.2948775570822957
Energy: 0.29441088804985366
Energy: 0.29930406225350803
Energy: 0.29527346119874365
Energy: 0.29930406225350803
Energy: 0.2944249901645532
Energy: 0.2812647651734063
Energy: 0.2954514514691406
Energy: 0.2812647651734063
Energy: 0.2821688782349393
Energy: 0.3055205514506846
Energy: 0.2965008907626452
Energy: 0.3055205514506846
Energy: 0.2836404006841791
Energy: 0.30275918754981146
Energy: 0.29564396891103
Energy: 0.30275918754981146
Energy: 0.28200914449236125
Energy: 0.28147572235981777
Energy: 0.293840095434712
Energy: 0.2814757223593684
Energy: 0.29516252289422196
Energy: 0.29511143886514973
Energy: 0.3372705929297514
Energy: 0.29511143886514973
Energy: 0.28091967383983124
Energy: 0.3015396425485237
Energy: 0.2810237527794237
Energy: 0.3015396425489731
Energy: 0.3793203165239006
Energy: 0.3516100934027257
Energy: 0.3489085674701113
Energy: 0.3516100934027257
Energy: 0.27468037281228885
Energy: 0.2818274137908703
Energy: 0.29542516410609543
Energy: 0.2818274137904209
Energy: 0.27660894008002157
Energy: 0.276512333492694
Energy: 0.3115043983728797
Energy: 0.276512333492694
Energy: 0.2835643683573215
Energy: 0.2909515355192565
Energy: 0.29476674120804364
Energy: 0.2909515355192565
Energy: 0.277241288016993
Energy: 0.27653760998084953
Energy: 0.33854301433045003
Energy: 0.27653760998084953
Energy: 0.27632479207451194
Energy: 0.28167869460860206
Energy: 0.2941015438269372
Energy: 0.28167869460815276
Energy: 0.4201459644897064
Energy: 0.34947410733746376
Energy: 0.34881419034916983
Energy: 0.34947410733746376

minimum gb energy = 0.26751667321341693 eV
minimum distance =  3.17598442893722 Angstroms
sigma value = 53


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

Energy: 0.3745230436201838
Energy: 0.25233892049094303
Energy: 0.3164047240902719
Energy: 0.25233892049083717
Energy: 0.33250710478135864
Energy: 0.2694730039890399
Energy: 0.29164148552956914
Energy: 0.2694730039890399
Energy: 0.3166545724254264
Energy: 0.3165423345230474
Energy: 0.3097666532319809
Energy: 0.3165423345231533
Energy: 0.29149571910992483
Energy: 0.269936307942629
Energy: 0.2908949722713865
Energy: 0.2699363079425232
Energy: 0.3121153107215544
Energy: 0.2695844462858157
Energy: 0.24695793325376794
Energy: 0.26958444628540423
Energy: 0.2904744011561744
Energy: 0.2701102067289913
Energy: 0.24697930178600175
Energy: 0.2701102067289913
Energy: 0.3324207782239033
Energy: 0.29153029497086813
Energy: 0.3162247606399062
Energy: 0.29153029497086813
Energy: 0.3320376995175893
Energy: 0.27012658310950305
Energy: 0.29085881276978737
Energy: 0.2701265831092915
Energy: 0.31657414985955074
Energy: 0.2706954163130482
Energy: 0.31015016458072375
Energy: 0.2706954163130482
Energy: 0.2907234667030365
Energy: 0.2703622408677112
Energy: 0.29170792853774485
Energy: 0.270362240867817
Energy: 0.3115512923341945
Energy: 0.2705809694712232
Energy: 0.24704146823706857
Energy: 0.2705809694712232
Energy: 0.29174714201270957
Energy: 0.27065894248414624
Energy: 0.247045558119445
Energy: 0.2706589424839464
Energy: 0.33205961762538105
Energy: 0.27042298255843783
Energy: 0.3260072037144448
Energy: 0.270422982558332

minimum gb energy = 0.24695793325376794 eV
minimum distance =  3.19899625822808 Angstroms
sigma value = 9


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

Energy: 0.3660133466856013
Energy: 0.3225202432068061
Energy: 0.35978625936102293
Energy: 0.3225202432071889
Energy: 0.2971821994836009
Energy: 0.27768558561465023
Energy: 0.3640411629595653
Energy: 0.27768558561541595
Energy: 0.27973214671835267
Energy: 0.2773789038671928
Energy: 0.3411201651615304
Energy: 0.2773789038675757
Energy: 0.2783435752342855
Energy: 0.27789493889726835
Energy: 0.36228925980596927
Energy: 0.27789493889726835
Energy: 0.27781513260992746
Energy: 0.2772111227467282
Energy: 0.36238029518408166
Energy: 0.2772111227463453
Energy: 0.2768240813524054
Energy: 0.2995931589503869
Energy: 0.36126698971005383
Energy: 0.2995931589427296
Energy: 0.3728545934294659
Energy: 0.34770609898000265
Energy: 0.35085607660299084
Energy: 0.3477060989803855
Energy: 0.36141634928231037
Energy: 0.3126422374736157
Energy: 0.3487055761018909
Energy: 0.3126422374736157
Energy: 0.30034294738196865
Energy: 0.31243718288799865
Energy: 0.29437574718372994
Energy: 0.31243718288799865
Energy: 0.27306057068078493
Energy: 0.29516520991570866
Energy: 0.3411345090747754
Energy: 0.29516520991532585
Energy: 0.3047371590006677
Energy: 0.30048964011324036
Energy: 0.361811689408455
Energy: 0.30048964011324036
Energy: 0.3004070881309909
Energy: 0.30119649923895403
Energy: 0.3672494290792758
Energy: 0.30119649923895403
Energy: 0.36151153431440536
Energy: 0.30022999679987283
Energy: 0.31345019485594966
Energy: 0.30022999680025575
Energy: 0.3615621188583569
Energy: 0.30043613555182486
Energy: 0.3052651976194763
Energy: 0.300436135551442
Energy: 0.34027122450591124
Energy: 0.29558033626218944
Energy: 0.29916090701340897
Energy: 0.29558033626218944
Energy: 0.3154297737511341
Energy: 0.31156980489138925
Energy: 0.29660294776767737
Energy: 0.31156980489138925
Energy: 0.3408706483490067
Energy: 0.3124443807662243
Energy: 0.30436981479077013
Energy: 0.3124443807662243
Energy: 0.3594929301371775
Energy: 0.3431031495619741
Energy: 0.36599231844662067
Energy: 0.34310314956848276
Energy: 0.3633537764301138
Energy: 0.2773672949860245
Energy: 0.2971715683058637
Energy: 0.2773672949860245
Energy: 0.3408279802305293
Energy: 0.27736170520933706
Energy: 0.2775239677253564
Energy: 0.27736170520933706
Energy: 0.36626597725337734
Energy: 0.27774616217565024
Energy: 0.277417876785663
Energy: 0.2777461621752673
Energy: 0.3614216021505705
Energy: 0.27703111527560276
Energy: 0.27716328545295604
Energy: 0.2770311152759857
Energy: 0.3621497769110774
Energy: 0.29695875899686813
Energy: 0.27683029875916665
Energy: 0.29695875899686813
Energy: 0.351608134415831
Energy: 0.34116232078208697
Energy: 0.36130234930560146
Energy: 0.3411623207817041
Energy: 0.35167469939175816
Energy: 0.3123287274889207
Energy: 0.3612444649030272
Energy: 0.3123287274889207
Energy: 0.2948486910578294
Energy: 0.31257913363720485
Energy: 0.299992686651099
Energy: 0.31257913363720485
Energy: 0.3413593192920253
Energy: 0.29503831291610116
Energy: 0.27280329001548087
Energy: 0.29503831291610116
Energy: 0.36084513068474927
Energy: 0.3005111441281708
Energy: 0.3050977321687727
Energy: 0.3005111441281708
Energy: 0.36668572467817184
Energy: 0.30100724856455024
Energy: 0.30313975790775793
Energy: 0.30100724856455024
Energy: 0.31363514668753273
Energy: 0.30171904177075554
Energy: 0.36166178081786815
Energy: 0.30171904177113845
Energy: 0.3060212470043918
Energy: 0.3005148356965212
Energy: 0.34158183633915046
Energy: 0.3005148356965212
Energy: 0.30214053759242204
Energy: 0.2962925985701223
Energy: 0.34074679169525446
Energy: 0.2962925985701223
Energy: 0.29546467819048283
Energy: 0.31329893299371
Energy: 0.316482350433472
Energy: 0.3132989329940929
Energy: 0.3003841838739004
Energy: 0.31221030902718244
Energy: 0.32129080822718625
Energy: 0.31221030902718244
Energy: 0.36635603271062117
Energy: 0.3417720986503528
Energy: 0.3593517613011398
Energy: 0.34177209865188424

minimum gb energy = 0.27280329001548087 eV
minimum distance =  3.09825352814081 Angstroms
sigma value = 73


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

Energy: 0.3795743219969046
Energy: 0.3137279278218049
Energy: 0.34701545250146576
Energy: 0.31372792782222597
Energy: 0.2996007268209678
Energy: 0.28472753410392393
Energy: 0.36391214746581463
Energy: 0.2847275341048351
Energy: 0.2845990593000419
Energy: 0.28477082580503094
Energy: 0.32879827800231354
Energy: 0.28477082580515517
Energy: 0.28471325052796753
Energy: 0.28513928333470945
Energy: 0.3616047719567495
Energy: 0.2851392833344057
Energy: 0.2875804771024295
Energy: 0.28645029688171775
Energy: 0.3624884502662668
Energy: 0.28645029688183515
Energy: 0.30286270918118313
Energy: 0.28663574256076
Energy: 0.36147874848750317
Energy: 0.28663574255863394
Energy: 0.35845894198843203
Energy: 0.34373094179271674
Energy: 0.3499976973657966
Energy: 0.34373094179284097
Energy: 0.358335320741128
Energy: 0.3359461769385754
Energy: 0.34019127877692357
Energy: 0.33594617693863754
Energy: 0.30461766413480057
Energy: 0.3191216239065122
Energy: 0.33144970637108556
Energy: 0.31912162390669163
Energy: 0.2923955217883194
Energy: 0.31761529254882503
Energy: 0.3348531289046143
Energy: 0.31761529254888715
Energy: 0.30292503341730903
Energy: 0.28469306585328374
Energy: 0.3541697721088494
Energy: 0.28469306585352533
Energy: 0.3005416565329602
Energy: 0.300648651383543
Energy: 0.34696703220832703
Energy: 0.30064865138366725
Energy: 0.3353998017783114
Energy: 0.31130146619240273
Energy: 0.29544005792494926
Energy: 0.3113014661923475
Energy: 0.330265323980264
Energy: 0.3005188400189437
Energy: 0.3004786733569063
Energy: 0.30051884001881946
Energy: 0.3383141538653627
Energy: 0.29607478182007235
Energy: 0.29577807307261256
Energy: 0.2960747818201276
Energy: 0.3631159562240549
Energy: 0.2948605075498176
Energy: 0.2955172456104409
Energy: 0.2948605075498797
Energy: 0.3615554350375505
Energy: 0.31005223745511
Energy: 0.3088843591211745
Energy: 0.3100522374549857
Energy: 0.34705535769589674
Energy: 0.3413248251183091
Energy: 0.43454774658124545
Energy: 0.3413248251183091
Energy: 0.32753713914558424
Energy: 0.3093361167718542
Energy: 0.32045152461522286
Energy: 0.30933611677172995
Energy: 0.31542326103445084
Energy: 0.30470994679365493
Energy: 0.3188099275843548
Energy: 0.3047099467938413
Energy: 0.32661973071753925
Energy: 0.3051557135714443
Energy: 0.292959664308928
Energy: 0.3051557135714443
Energy: 0.36145834111685676
Energy: 0.3247038362182457
Energy: 0.3259900101210005
Energy: 0.32470383621812143

minimum gb energy = 0.2845990593000419 eV
minimum distance =  3.08934476020129 Angstroms
sigma value = 7


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

Energy: 0.4290591093158816
Energy: 0.28209210377778754
Energy: 0.33912502527498384
Energy: 0.28209210153147934
Energy: 0.31389301345249165
Energy: 0.3112528513763551
Energy: 0.3592511669529967
Energy: 0.31125285137678466
Energy: 0.28342733874847736
Energy: 0.2838246505695551
Energy: 0.3070672307596311
Energy: 0.2838246505695551
Energy: 0.2838204318316812
Energy: 0.28384393082259746
Energy: 0.34860802536375274
Energy: 0.2838439308213088
Energy: 0.2927069754482733
Energy: 0.29268870757952786
Energy: 0.33414066277732585
Energy: 0.29268870757952786
Energy: 0.3171450139600973
Energy: 0.294748432005018
Energy: 0.33819217217396563
Energy: 0.294748432005018
Energy: 0.357171472319845
Energy: 0.29259224808037587
Energy: 0.2833541669431962
Energy: 0.29259224808080536
Energy: 0.35816565692593993
Energy: 0.2929816429286075
Energy: 0.2942895658065939
Energy: 0.2929816429290371
Energy: 0.34718803103754514
Energy: 0.2830389623712935
Energy: 0.2826755867261911
Energy: 0.28303896237086396
Energy: 0.33285878245024775
Energy: 0.28739208774296415
Energy: 0.2835112850952004
Energy: 0.2873920877433937
Energy: 0.34824208139460955
Energy: 0.32325676772914075
Energy: 0.3471476643502563
Energy: 0.3232567677282817
Energy: 0.3313626689107283
Energy: 0.3298282195748182
Energy: 0.3572803903492327
Energy: 0.3298282195748182
Energy: 0.3131721120760709
Energy: 0.3105706071152854
Energy: 0.3219902578729252
Energy: 0.3105706071152854
Energy: 0.30878215163715195
Energy: 0.3000249425212069
Energy: 0.28215527301061
Energy: 0.3000249425216365
Energy: 0.32518337386917184
Energy: 0.3105352662311041
Energy: 0.281417350192412
Energy: 0.3105352662306746
Energy: 0.34904233414262287
Energy: 0.3196695650760602
Energy: 0.330314383729987
Energy: 0.31966956507820793
Energy: 0.3500946351814009
Energy: 0.3232022537422642
Energy: 0.34872345160938645
Energy: 0.3232022537422642
Energy: 0.28371171982246773
Energy: 0.2862741283747071
Energy: 0.306622200719327
Energy: 0.28627412837513666
Energy: 0.2821694317737831
Energy: 0.2831115782681505
Energy: 0.35945375416673997
Energy: 0.283111578267721
Energy: 0.29469012997386024
Energy: 0.29294415067724855
Energy: 0.3495038866028805
Energy: 0.2929441506776781
Energy: 0.2833102780647366
Energy: 0.2925959915746435
Energy: 0.33351838941471057
Energy: 0.2925959915729254
Energy: 0.35892745811694327
Energy: 0.2927438272769469
Energy: 0.3171684135038777
Energy: 0.29274382727737647
Energy: 0.3564938950098765
Energy: 0.2926045591815908
Energy: 0.2925142457480689
Energy: 0.2926045591820203
Energy: 0.34771507368076143
Energy: 0.28377912897164764
Energy: 0.28380693400498813
Energy: 0.2837791289720772
Energy: 0.33327784330681504
Energy: 0.28374903584398015
Energy: 0.28364560606812844
Energy: 0.28374903584398015
Energy: 0.3423396167588914
Energy: 0.31065361684418213
Energy: 0.3230324689861863
Energy: 0.31065361693778076
Energy: 0.34754661186725305
Energy: 0.33958170100882423
Energy: 0.379886726758277
Energy: 0.3395817010092538
Energy: 0.32148335157530816
Energy: 0.3101914798624379
Energy: 0.32996612426704447
Energy: 0.31019147986286744
Energy: 0.3077704352234559
Energy: 0.3007799794980424
Energy: 0.31305596832450633
Energy: 0.30077997949761287
Energy: 0.3218609233259083
Energy: 0.283359823953352
Energy: 0.2819695629152464
Energy: 0.2833598239546406
Energy: 0.34907962807116155
Energy: 0.32445698067848466
Energy: 0.3243754256952071
Energy: 0.32445698067934375

minimum gb energy = 0.281417350192412 eV
minimum distance =  3.1002111078327 Angstroms
sigma value = 29


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

Energy: 0.2533190668838989
Energy: 0.2540877021604867
Energy: 0.31427396458884577
Energy: 0.2540877021604867
Energy: 0.25481384597537204
Energy: 0.288449473047738
Energy: 0.2791321890827433
Energy: 0.2884494730475967
Energy: 0.2601786162433902
Energy: 0.28078849514318743
Energy: 0.254304387800288
Energy: 0.2807884951433287
Energy: 0.2548088890923625
Energy: 0.2607693967830016
Energy: 0.26218933993901916
Energy: 0.26076939678314287
Energy: 0.2597578730789873
Energy: 0.26269494924440007
Energy: 0.2546671807192808
Energy: 0.26269494925244613
Energy: 0.26225898662745084
Energy: 0.28212722658484124
Energy: 0.2545874090746186
Energy: 0.28212722658498257
Energy: 0.2548544124281067
Energy: 0.281532127995042
Energy: 0.26032472424383873
Energy: 0.281532127995042
Energy: 0.27947440853588545
Energy: 0.2618595827243339
Energy: 0.26282475134459754
Energy: 0.2618595827243339
Energy: 0.2547495913464917
Energy: 0.26119420304779156
Energy: 0.2616461608420914
Energy: 0.26119420304779156

minimum gb energy = 0.2533190668838989 eV
minimum distance =  3.16341612929527 Angstroms
sigma value = 5


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

Energy: 0.3347941542230522
Energy: 0.2632068687285707
Energy: 0.3280263294059981
Energy: 0.2632068687289764
Energy: 0.27268309853821227
Energy: 0.268214907678667
Energy: 0.30869636509696374
Energy: 0.268214907678667
Energy: 0.3084119024311062
Energy: 0.2914272708161281
Energy: 0.3056883491333036
Energy: 0.2914272708161281
Energy: 0.2733536330256153
Energy: 0.26742769411752276
Energy: 0.3269558273769476
Energy: 0.267427694117117
Energy: 0.3183796895736681
Energy: 0.276258503410034
Energy: 0.36161440224155017
Energy: 0.27625850340881686
Energy: 0.2795017665794264
Energy: 0.27146196265800937
Energy: 0.36103403623820685
Energy: 0.27146196265719785
Energy: 0.2674722385026303
Energy: 0.26768105786210605
Energy: 0.32672232095760423
Energy: 0.26768105786210605
Energy: 0.27090203834135906
Energy: 0.2686112842801368
Energy: 0.33699155379230267
Energy: 0.2686112842801368
Energy: 0.2988080857054875
Energy: 0.28042280088911636
Energy: 0.3443107097604101
Energy: 0.2804228008895221
Energy: 0.30347056801916555
Energy: 0.2624200651897238
Energy: 0.2638688891609972
Energy: 0.26242006518931804
Energy: 0.29141033309743825
Energy: 0.2620259193777327
Energy: 0.2623221309606887
Energy: 0.2620259193777327
Energy: 0.3384332162511312
Energy: 0.2631585934032037
Energy: 0.26169384417501473
Energy: 0.2631585934032037
Energy: 0.33865969647002386
Energy: 0.26338914322053997
Energy: 0.32693691806341985
Energy: 0.26338914322094575
Energy: 0.314340902688775
Energy: 0.2815455210206607
Energy: 0.30671031959708006
Energy: 0.2815455210210665
Energy: 0.26774353686055974
Energy: 0.2678194065904299
Energy: 0.3070453654326866
Energy: 0.2678194065908357
Energy: 0.2694976128051434
Energy: 0.26774098379758776
Energy: 0.30999609765150454
Energy: 0.26774098379758776
Energy: 0.2683485824078361
Energy: 0.26764316918534287
Energy: 0.2603373421779529
Energy: 0.2676431691849371
Energy: 0.3091790055416262
Energy: 0.2685980965472806
Energy: 0.2727705060595077
Energy: 0.26859809654768635
Energy: 0.30510294894363965
Energy: 0.2920419486501792
Energy: 0.3092571883590784
Energy: 0.2920419486497734
Energy: 0.3190039005565847
Energy: 0.2675980732914706
Energy: 0.2724877313501528
Energy: 0.2675980732910649
Energy: 0.36075811593841817
Energy: 0.2696768387470976
Energy: 0.31849097500756196
Energy: 0.2696768387470976
Energy: 0.36220089831489016
Energy: 0.2679984602106029
Energy: 0.2800719052678444
Energy: 0.2679984602106029
Energy: 0.32738707405431766
Energy: 0.2677732499261138
Energy: 0.26723581992126044
Energy: 0.2677732499261138
Energy: 0.3397923602159688
Energy: 0.26832788247311995
Energy: 0.26968148296373173
Energy: 0.2683278824727142
Energy: 0.3392017185221568
Energy: 0.2805660327983888
Energy: 0.2986060476061571
Energy: 0.2805660327983888
Energy: 0.26328043557842096
Energy: 0.2629549710555729
Energy: 0.3034237992869723
Energy: 0.2629549710559786
Energy: 0.2629707365364022
Energy: 0.26209001693716877
Energy: 0.29062633931960996
Energy: 0.26209001693716877
Energy: 0.263410757442356
Energy: 0.26263031666873515
Energy: 0.2730990134002132
Energy: 0.26263031666873515
Energy: 0.2632561819395163
Energy: 0.26211073380414496
Energy: 0.33606846488939535
Energy: 0.26211073380414496
Energy: 0.3071849487460946
Energy: 0.28110890758987855
Energy: 0.31487750285737687
Energy: 0.2811089075894728
Energy: 0.3063858753755395
Energy: 0.26802023597756464
Energy: 0.268422207131239
Energy: 0.2680202359771589
Energy: 0.3110904000831351
Energy: 0.26747074306454005
Energy: 0.26828217848953656
Energy: 0.26747074306454005
Energy: 0.38634089288143375
Energy: 0.26754332857480895
Energy: 0.26782065785796527
Energy: 0.2675433285861698

minimum gb energy = 0.2603373421779529 eV
minimum distance =  3.14120949532191 Angstroms
sigma value = 1


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

Energy: 0.38182933647716416
Energy: 0.25757021748324127
Energy: 0.3257346798557025
Energy: 0.2575702176862367
Energy: 0.3014345935864012
Energy: 0.26161344790029156
Energy: 0.31338926875979833
Energy: 0.26161344790029156
Energy: 0.31166456492865546
Energy: 0.2918919155656135
Energy: 0.3138069793142183
Energy: 0.2918919155656135
Energy: 0.2856134893264994
Energy: 0.2628404999420612
Energy: 0.3138525353279116
Energy: 0.2628404999420612
Energy: 0.3200549402437023
Energy: 0.28120739212043083
Energy: 0.29131673578721795
Energy: 0.2812073921209791
Energy: 0.2822834364802746
Energy: 0.26365711097366973
Energy: 0.3086182418902571
Energy: 0.26365711097366973
Energy: 0.2624691453439067
Energy: 0.2627064693303971
Energy: 0.32332763169677087
Energy: 0.2627064693303971
Energy: 0.2633835758340186
Energy: 0.26405974670950055
Energy: 0.3359077304300842
Energy: 0.26405974670950055
Energy: 0.2636198858039591
Energy: 0.28083655971897376
Energy: 0.3405480477658469
Energy: 0.28083655971897376
Energy: 0.329285794735484
Energy: 0.25068270686546806
Energy: 0.27662444738874226
Energy: 0.25068270686490707
Energy: 0.2634498121915158
Energy: 0.2520777086736875
Energy: 0.2764450178368511
Energy: 0.25207770867424856
Energy: 0.35016742470444323
Energy: 0.2513797806160847
Energy: 0.27602087064097747
Energy: 0.2513797806160847
Energy: 0.35378220875187943
Energy: 0.2515529380866838
Energy: 0.27511085402637825
Energy: 0.25155293808724477
Energy: 0.26358930495647726
Energy: 0.2495967076779122
Energy: 0.3275721312605795
Energy: 0.2495967076779122
Energy: 0.28649662222853894
Energy: 0.2796957831916695
Energy: 0.32674330173296956
Energy: 0.2796957831916695
Energy: 0.28950513579583204
Energy: 0.26317365492495975
Energy: 0.32743734017926074
Energy: 0.26317365492439876
Energy: 0.2685233848197353
Energy: 0.2722650097775774
Energy: 0.3015815792345735
Energy: 0.27226500977869944
Energy: 0.2671538097381234
Energy: 0.264140873751034
Energy: 0.3015138978392057
Energy: 0.264140873751034
Energy: 0.26355134611293146
Energy: 0.2633363918282997
Energy: 0.34061880181262194
Energy: 0.2633363918282997
Energy: 0.26355810273096264
Energy: 0.26434292983043606
Energy: 0.3354590006401837
Energy: 0.2643429298012764
Energy: 0.33148135470494533
Energy: 0.28144228998804965
Energy: 0.32767069482694255
Energy: 0.28144228998861065
Energy: 0.33038908380842785
Energy: 0.26132507921003634
Energy: 0.26140555445239816
Energy: 0.26132507921003634
Energy: 0.3370172782026222
Energy: 0.2607949536054167
Energy: 0.2611165863069424
Energy: 0.2607949536054167
Energy: 0.365663519375097
Energy: 0.2613224865375141
Energy: 0.260820665338024
Energy: 0.2613224865375141

minimum gb energy = 0.2495967076779122 eV
minimum distance =  3.13752646594279 Angstroms
sigma value = 17


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

Energy: 0.3715676931766909
Energy: 0.25434181811270984
Energy: 0.323854488921289
Energy: 0.25434181811236306
Energy: 0.2611138112194264
Energy: 0.25720890959139536
Energy: 0.29171705792558705
Energy: 0.25720890959174214
Energy: 0.31920075273429427
Energy: 0.2967801996556828
Energy: 0.289448362410338
Energy: 0.2967801996556828
Energy: 0.3148062176590747
Energy: 0.2520038474665213
Energy: 0.27378153955497575
Energy: 0.2520038474665213
Energy: 0.28292679999520437
Energy: 0.2537727189261733
Energy: 0.34043601078838615
Energy: 0.2537727189261733
Energy: 0.25246554239036423
Energy: 0.25661002648262105
Energy: 0.3160972862971688
Energy: 0.25661002648262105
Energy: 0.25255387652067307
Energy: 0.25226480801301754
Energy: 0.27208225893705906
Energy: 0.2522648080123398
Energy: 0.2538718471777381
Energy: 0.252983832576648
Energy: 0.3725949100619653
Energy: 0.25298383257630125
Energy: 0.34066127481892683
Energy: 0.25271025811773296
Energy: 0.3195962930714414
Energy: 0.2527102581173862
Energy: 0.2867566540900543
Energy: 0.25832276086201467
Energy: 0.293502988966636
Energy: 0.2583227608623614
Energy: 0.3387526009846546
Energy: 0.25734820343663023
Energy: 0.2601654482472756
Energy: 0.257348203436977
Energy: 0.3159449785532235
Energy: 0.2580302125238866
Energy: 0.2940201312486001
Energy: 0.25803021252423336
Energy: 0.32433172485609657
Energy: 0.25656009392516566
Energy: 0.2568176369919324
Energy: 0.2565600939255124
Energy: 0.2569612305345653
Energy: 0.2568548105672156
Energy: 0.25749318477578137
Energy: 0.2568548105675623
Energy: 0.3173434842689617
Energy: 0.25732652842722753
Energy: 0.2582786684340027
Energy: 0.2573265284268808
Energy: 0.36263376456321444
Energy: 0.2681460814722883
Energy: 0.25976295759463774
Energy: 0.2681460814719416
Energy: 0.25714760279027427
Energy: 0.25870762057021834
Energy: 0.34288194750894635
Energy: 0.2587076204818451
Energy: 0.2576946273070906
Energy: 0.2569099938173946
Energy: 0.3508488636502063
Energy: 0.2569099938173946
Energy: 0.2601871027251248
Energy: 0.2573169328188156
Energy: 0.26070489605479796
Energy: 0.25731693281846885
Energy: 0.258988423200151
Energy: 0.28314739751391915
Energy: 0.3717476877525877
Energy: 0.28314739751461265
Energy: 0.29179677967528755
Energy: 0.25762727422242937
Energy: 0.2570129439624863
Energy: 0.25762727422242937
Energy: 0.29095023764189415
Energy: 0.29691122697228706
Energy: 0.3182730504200364
Energy: 0.29691122697228706
Energy: 0.27178973737050155
Energy: 0.2520997794072101
Energy: 0.31794471194437235
Energy: 0.2520997794079036
Energy: 0.33902810307574205
Energy: 0.25259101023355623
Energy: 0.2826405810702798
Energy: 0.25259101025503883
Energy: 0.3163876425155414
Energy: 0.25324905374041995
Energy: 0.2570676194079976
Energy: 0.25324905374041995
Energy: 0.27359253032281156
Energy: 0.2526744858779368
Energy: 0.25353123419916274
Energy: 0.2526744858782835
Energy: 0.3718544887347546
Energy: 0.2530243154654338
Energy: 0.25492261219780415
Energy: 0.253024315465087
Energy: 0.34052951892606353
Energy: 0.2525211777365385
Energy: 0.3409100633477412
Energy: 0.2525211777365385
Energy: 0.2926246834829301
Energy: 0.2581011712440928
Energy: 0.28739487841361855
Energy: 0.2581011712440928
Energy: 0.2604747467598234
Energy: 0.25633304055079026
Energy: 0.35111464218286204
Energy: 0.25633304055079026
Energy: 0.2920187374682263
Energy: 0.25813642914144275
Energy: 0.31571142813298175
Energy: 0.25813642914144275
Energy: 0.26614407385915834
Energy: 0.265539523868041
Energy: 0.3156546958129669
Energy: 0.26553952386908125
Energy: 0.2568820793333296
Energy: 0.2566353912804579
Energy: 0.2573457864083045
Energy: 0.2566353912804579
Energy: 0.2594542358252109
Energy: 0.2574348096434931
Energy: 0.3142167623764437
Energy: 0.2574348096441866
Energy: 0.35213745802244606
Energy: 0.267728468990419
Energy: 0.3615807194760324
Energy: 0.267728468990419
Energy: 0.3427099871547048
Energy: 0.25815211538138083
Energy: 0.2570181780502386
Energy: 0.2581521153817276
Energy: 0.351757032801093
Energy: 0.2567254836968403
Energy: 0.25702039854627956
Energy: 0.2567254836968403
Energy: 0.2600208894270325
Energy: 0.25768872864668785
Energy: 0.272277238424384
Energy: 0.2576887286463412

minimum gb energy = 0.2520038474665213 eV
minimum distance =  3.14716906351701 Angstroms
sigma value = 89


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

Energy: 0.3847826671677362
Energy: 0.24511188079062474
Energy: 0.2385647357046955
Energy: 0.24511188079034635
Energy: 0.23449988311141368
Energy: 0.2378060630398117
Energy: 0.25472040765338155
Energy: 0.23780606303863638
Energy: 0.23440722340730252
Energy: 0.2629598043436966
Energy: 0.25362833752478425
Energy: 0.2629598043437894
Energy: 0.23466782485735088
Energy: 0.23802806000743185
Energy: 0.253212632370474
Energy: 0.23802806000761745
Energy: 0.2427356272644536
Energy: 0.23810268209572835
Energy: 0.2504607582085103
Energy: 0.23810268209563556
Energy: 0.23680174340254506
Energy: 0.2374628986822502
Energy: 0.250404749169199
Energy: 0.23746289868234305
Energy: 0.23653071910450843
Energy: 0.23654386640402206
Energy: 0.2534929476234561
Energy: 0.23654386640393957
Energy: 0.2378981480673637
Energy: 0.23808423898498796
Energy: 0.2345896158468337
Energy: 0.23808423898498796
Energy: 0.24276123338601036
Energy: 0.23793076134876143
Energy: 0.23409290153485596
Energy: 0.23793076134866867
Energy: 0.31156466677898703
Energy: 0.26282848535292247
Energy: 0.2539514643726231
Energy: 0.26282848535292247
Energy: 0.25387310440895394
Energy: 0.26353836996867047
Energy: 0.23367702116715638
Energy: 0.2635383699683097
Energy: 0.2503430659084062
Energy: 0.2377038055581111
Energy: 0.25347099609470736
Energy: 0.2377038055581111
Energy: 0.2505334352280936
Energy: 0.23747580534700166
Energy: 0.23770655504850693
Energy: 0.23747580534726973
Energy: 0.25290188775332034
Energy: 0.23640113244153768
Energy: 0.23609233334226787
Energy: 0.2364011324416305
Energy: 0.23447099150974812
Energy: 0.23717830131395629
Energy: 0.2374387657078429
Energy: 0.23717830131367793

minimum gb energy = 0.23367702116715638 eV
minimum distance =  3.17681341001043 Angstroms
sigma value = 13


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

Energy: 0.3423933684282401
Energy: 0.2309596054128687
Energy: 0.3036395478379834
Energy: 0.23095960541020683
Energy: 0.34952274298826436
Energy: 0.22878601535009455
Energy: 0.25736006921680193
Energy: 0.22878601535009455
Energy: 0.3352256156556628
Energy: 0.22775341564173326
Energy: 0.2559118910971919
Energy: 0.22775341564249382
Energy: 0.2797388408736431
Energy: 0.24647203803501755
Energy: 0.26015610097719377
Energy: 0.24647203803463724
Energy: 0.25490245897799363
Energy: 0.24649051548342565
Energy: 0.3091543085658268
Energy: 0.24649051548342565
Energy: 0.25738905030842907
Energy: 0.22835545834962356
Energy: 0.3094386669552822
Energy: 0.2283554583492433
Energy: 0.2563391242154782
Energy: 0.2281085461409602
Energy: 0.32180439822018
Energy: 0.2281085461413405
Energy: 0.25721865244676695
Energy: 0.22860530455081005
Energy: 0.32542051873509603
Energy: 0.22860530455004952
Energy: 0.23016377764790516
Energy: 0.2287412357907124
Energy: 0.31639907821631996
Energy: 0.2287412357895716
Energy: 0.2285541669170764
Energy: 0.22863562014808758
Energy: 0.3167045661398851
Energy: 0.2286356201484679
Energy: 0.22824386702711522
Energy: 0.2303935091340415
Energy: 0.34291847578268786
Energy: 0.23039350913366127
Energy: 0.31347944895606983
Energy: 0.22773364100258103
Energy: 0.31703917952983907
Energy: 0.22773364100220078
Energy: 0.3097832673329593
Energy: 0.24358139772206694
Energy: 0.31325520137626084
Energy: 0.2435813977228275
Energy: 0.32298139151255933
Energy: 0.22786574501949525
Energy: 0.2802510290213036
Energy: 0.2278657450191149
Energy: 0.3115682197273036
Energy: 0.2288087720379768
Energy: 0.30022112316479577
Energy: 0.22880877203721622
Energy: 0.31168516816081676
Energy: 0.22843989421396096
Energy: 0.2292521731368524
Energy: 0.22843989421396096
Energy: 0.32187112732875633
Energy: 0.22845215544373162
Energy: 0.22919995545969243
Energy: 0.22845215544297112
Energy: 0.343128338412974
Energy: 0.22856568920252188
Energy: 0.23015467993671915
Energy: 0.22856568920176132
Energy: 0.2796780355116991
Energy: 0.22907653685691926
Energy: 0.26512554374027697
Energy: 0.22907653685729956
Energy: 0.31731913524458205
Energy: 0.2278448756828784
Energy: 0.25480854633619565
Energy: 0.22784487568325865
Energy: 0.2789643241363763
Energy: 0.23005088994540596
Energy: 0.2566103923996868
Energy: 0.23005088994654677
Energy: 0.3168463473818588
Energy: 0.24569393247278568
Energy: 0.3094990114337393
Energy: 0.24569393247278568
Energy: 0.26117408824184035
Energy: 0.22895442350834566
Energy: 0.3092881664777511
Energy: 0.22895442350834566
Energy: 0.2292337390025615
Energy: 0.22764698601063169
Energy: 0.3161013675534032
Energy: 0.2276469860102514
Energy: 0.2558481360464698
Energy: 0.22828901779571667
Energy: 0.31218673814405346
Energy: 0.2282890177979983
Energy: 0.2337528176200805
Energy: 0.23328586676030857
Energy: 0.31200858694356964
Energy: 0.233285866759548
Energy: 0.22812198873395573
Energy: 0.2278852595625483
Energy: 0.31438586107873717
Energy: 0.2278852595625483
Energy: 0.23176053277923178
Energy: 0.22932432301009445
Energy: 0.3438294195590913
Energy: 0.22932432301085495
Energy: 0.31276934945087764
Energy: 0.228202496878411
Energy: 0.28080541631037764
Energy: 0.22820249687803068
Energy: 0.25429722022179346
Energy: 0.24430915880758436
Energy: 0.31305670770973176
Energy: 0.24430915880834492
Energy: 0.3146219806638169
Energy: 0.24549330877666456
Energy: 0.27947906987969534
Energy: 0.24549330877704487
Energy: 0.311801464017011
Energy: 0.22865384588277776
Energy: 0.3137650140809097
Energy: 0.22865384588353826
Energy: 0.31153224187862766
Energy: 0.2286509913557553
Energy: 0.23079356007302354
Energy: 0.2286509913546145
Energy: 0.3229815497654527
Energy: 0.22785375037074326
Energy: 0.2282185177586696
Energy: 0.22785375036998273
Energy: 0.2803388121886637
Energy: 0.22841888569715904
Energy: 0.22964688853558426
Energy: 0.22841888569715904

minimum gb energy = 0.2276469860102514 eV
minimum distance =  3.16671393693943 Angstroms
sigma value = 37


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

Energy: 0.3333525748442334
Energy: 0.22086445249185876
Energy: 0.21489866237199276
Energy: 0.22086445248466213
Energy: 0.2837194682246714
Energy: 0.21520298575004224
Energy: 0.26447788043182946
Energy: 0.21520298574991586
Energy: 0.3250209268609935
Energy: 0.24243582954579349
Energy: 0.2641017173497579
Energy: 0.24243582954605364
Energy: 0.32533058683859406
Energy: 0.2616993097132122
Energy: 0.2666749562368464
Energy: 0.2616993097132122
Energy: 0.3174739705524985
Energy: 0.24349896050393796
Energy: 0.2770632792541985
Energy: 0.24349896050400488
Energy: 0.23104769321102833
Energy: 0.2423493821495599
Energy: 0.2897286864567976
Energy: 0.2423493821495599
Energy: 0.23224629417933856
Energy: 0.21147398792082955
Energy: 0.3068894554742426
Energy: 0.21147398792082955
Energy: 0.25691832709338436
Energy: 0.20911031488979687
Energy: 0.2806460514230995
Energy: 0.2091103148907782
Energy: 0.23167082751187448
Energy: 0.21261554587733883
Energy: 0.28060446082716173
Energy: 0.2126155458774057
Energy: 0.23250750724545835
Energy: 0.20821958730549492
Energy: 0.30509201290729215
Energy: 0.20821958730523474
Energy: 0.23272858531951263
Energy: 0.232581448523429
Energy: 0.29755893240211884
Energy: 0.23258144852421705
Energy: 0.2809062032089438
Energy: 0.20801550308177863
Energy: 0.30493505672168536
Energy: 0.20801550308197939
Energy: 0.2824173474976217
Energy: 0.23934877999837803
Energy: 0.32499067629466444
Energy: 0.23934877999844498
Energy: 0.30758307014805547
Energy: 0.23605130542699349
Energy: 0.3259034245164939
Energy: 0.23605130542666636
Energy: 0.2770632792541985
Energy: 0.23959654038214886
Energy: 0.3069264491059837
Energy: 0.23959654038202244
Energy: 0.2897286864568645
Energy: 0.21492895136637766
Energy: 0.23101772843156637
Energy: 0.21492895136644452
Energy: 0.31726766545769
Energy: 0.21476300487518965
Energy: 0.23224551866300197
Energy: 0.21476300487512276
Energy: 0.28064604501176343
Energy: 0.23614410946702297
Energy: 0.21170301174665385
Energy: 0.23614410946721626
Energy: 0.2806044608599853
Energy: 0.21587472221393367
Energy: 0.21516842539197034
Energy: 0.21587472221393367
Energy: 0.28379529794747854
Energy: 0.21521198455162568
Energy: 0.21499345443672524
Energy: 0.21521198455149182

minimum gb energy = 0.20801550308177863 eV
minimum distance =  3.16794327851308 Angstroms
sigma value = 25


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

Energy: 0.35226861552759775
Energy: 0.19768532958297494
Energy: 0.1880595803412057
Energy: 0.19768532958297494
Energy: 0.2549002400345781
Energy: 0.18816008351334115
Energy: 0.2230752492910736
Energy: 0.18816008351334115
Energy: 0.33172014174959674
Energy: 0.1878893932976015
Energy: 0.22308741366902127
Energy: 0.18788939329811238
Energy: 0.2538645412844526
Energy: 0.21041103694996624
Energy: 0.2711330708956954
Energy: 0.2104110369504771
Energy: 0.2727562306606699
Energy: 0.18821745767025802
Energy: 0.29511689242629285
Energy: 0.18821745766158474
Energy: 0.25615212740340043
Energy: 0.20984064173935404
Energy: 0.2995770985870873
Energy: 0.20984064173935404
Energy: 0.25573084816422187
Energy: 0.1881250350500812
Energy: 0.2715150447970792
Energy: 0.1881250350500812
Energy: 0.27015959924680255
Energy: 0.18990054815401486
Energy: 0.3039646039423684
Energy: 0.18990054815401486
Energy: 0.22257358990526074
Energy: 0.1878859266063754
Energy: 0.30066982254728614
Energy: 0.1878859266063754
Energy: 0.22798128254132202
Energy: 0.1881261605379078
Energy: 0.30055621200546195
Energy: 0.1881261605373969
Energy: 0.1879038155199405
Energy: 0.18782752735031089
Energy: 0.3025663815238024
Energy: 0.18782752732477867
Energy: 0.18920575223064098
Energy: 0.18817657040631325
Energy: 0.30079733533091174
Energy: 0.18817657040682415
Energy: 0.18867065417236548
Energy: 0.18898433919072447
Energy: 0.2558670321563483
Energy: 0.18898433919072447
Energy: 0.2262309924792409
Energy: 0.18935417571528684
Energy: 0.35350251403180005
Energy: 0.18935417569333074
Energy: 0.22250487975848646
Energy: 0.1876725423252311
Energy: 0.3019684298008708
Energy: 0.1876725423252311
Energy: 0.2216047947896864
Energy: 0.18851694803027508
Energy: 0.3327653277898377
Energy: 0.18851694803027508
Energy: 0.30162292094963267
Energy: 0.2102525076725811
Energy: 0.334380005157089
Energy: 0.2102525076725811
Energy: 0.22050162141341484
Energy: 0.18769921353409563
Energy: 0.2724315131230438
Energy: 0.18769921353460653
Energy: 0.29956366298437886
Energy: 0.2101378580280473
Energy: 0.2561601067675179
Energy: 0.2101378580280473
Energy: 0.3008905395105419
Energy: 0.20985634189538055
Energy: 0.2560474431958993
Energy: 0.20985634189538055
Energy: 0.30334155302330956
Energy: 0.188095103984675
Energy: 0.2216085007694386
Energy: 0.18809510398568519
Energy: 0.30083034931214103
Energy: 0.18758421579941223
Energy: 0.1879246319489514
Energy: 0.18758421579941223
Energy: 0.29992830031587314
Energy: 0.18891794084158456
Energy: 0.2299477246614245
Energy: 0.1889179408410737
Energy: 0.3032514830590542
Energy: 0.19037979383359782
Energy: 0.18795222151163074
Energy: 0.19037979383308692
Energy: 0.3017498284705864
Energy: 0.18770118762818128
Energy: 0.18792056398977314
Energy: 0.18770118762818128
Energy: 0.33221882378131073
Energy: 0.18857472455740637
Energy: 0.18985040336042
Energy: 0.18857472455740637

minimum gb energy = 0.18758421579941223 eV
minimum distance =  3.1740505158445 Angstroms
sigma value = 41


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

Energy: 0.3871002233533569
Energy: 0.1795671988965939
Energy: 0.17321977513336348
Energy: 0.17956719889701273
Energy: 0.29674461324227613
Energy: 0.17171768698597295
Energy: 0.19996354682053827
Energy: 0.17171768698597295
Energy: 0.3490277241541341
Energy: 0.17165064498368302
Energy: 0.19930191072358663
Energy: 0.17165064498368302
Energy: 0.30168123699913946
Energy: 0.173697517172894
Energy: 0.2373814227751533
Energy: 0.17369751719759574
Energy: 0.298187746985231
Energy: 0.17115305938413725
Energy: 0.2609953618246812
Energy: 0.17115305938413725
Energy: 0.2951778892259477
Energy: 0.17168265483480574
Energy: 0.26141797791632526
Energy: 0.1716826499809913
Energy: 0.29648632157525023
Energy: 0.19047216086170254
Energy: 0.299209037311561
Energy: 0.19047216086170254
Energy: 0.2665352670869996
Energy: 0.19175427243466767
Energy: 0.2628500589410572
Energy: 0.19175427243466767
Energy: 0.22546236900713745
Energy: 0.18935652735934527
Energy: 0.32237114465081873
Energy: 0.18935652735892644
Energy: 0.22614582503266267
Energy: 0.17129812241818967
Energy: 0.3231044202907263
Energy: 0.17129812242571918
Energy: 0.20277268134291293
Energy: 0.1741504107111783
Energy: 0.34444710433034054
Energy: 0.17415041071034063
Energy: 0.19806038543043508
Energy: 0.1711419545007429
Energy: 0.3224918679894068
Energy: 0.17114195450116174
Energy: 0.2000026680951068
Energy: 0.1721439179752506
Energy: 0.32208754789714633
Energy: 0.17214391797566944
Energy: 0.1718768093747608
Energy: 0.17379138659119228
Energy: 0.32695097655364924
Energy: 0.17379138659119228
Energy: 0.1716283698222136
Energy: 0.1716092873531119
Energy: 0.298470650414877
Energy: 0.1716092873531119
Energy: 0.17325144331394615
Energy: 0.17203131411430989
Energy: 0.34938543518049514
Energy: 0.17203131411430989
Energy: 0.2045324342434686
Energy: 0.17284370028505516
Energy: 0.3505690517219624
Energy: 0.172843700285474
Energy: 0.1978016267844612
Energy: 0.17150161824853186
Energy: 0.34836354670717157
Energy: 0.17150161824895066
Energy: 0.20163915658596965
Energy: 0.17287504520353283
Energy: 0.29599173816230245
Energy: 0.1728750452052082
Energy: 0.2683772830267317
Energy: 0.17207988859509457
Energy: 0.29528931712934897
Energy: 0.1720798885955134
Energy: 0.2630027942925192
Energy: 0.17122961105167503
Energy: 0.3228049202964246
Energy: 0.17122961104958087
Energy: 0.2628842743534582
Energy: 0.18975692224712515
Energy: 0.2974094735973478
Energy: 0.18975692223874843
Energy: 0.32240738637342004
Energy: 0.1894021368849822
Energy: 0.2950513549161502
Energy: 0.18940213688456337
Energy: 0.26295854470472013
Energy: 0.1902585207361366
Energy: 0.2623863900711126
Energy: 0.19025852073655544
Energy: 0.32329148278733966
Energy: 0.17119765282001007
Energy: 0.22375649220603328
Energy: 0.17119765282001007
Energy: 0.3227811240061464
Energy: 0.1720911389025898
Energy: 0.2648586669205561
Energy: 0.1720911389025898
Energy: 0.3238392716503266
Energy: 0.17275847163429248
Energy: 0.1980095115086433
Energy: 0.17275847163429248
Energy: 0.29857749098289343
Energy: 0.17122025743248367
Energy: 0.1972744285260509
Energy: 0.17122025743290253
Energy: 0.3235337174644007
Energy: 0.17265731556522967
Energy: 0.20431892387908085
Energy: 0.17265731553006655
Energy: 0.3224549359027636
Energy: 0.1721396640451312
Energy: 0.17505960058931325
Energy: 0.17213966404472192
Energy: 0.3488685907058221
Energy: 0.1713399702413924
Energy: 0.17153104901895136
Energy: 0.1713399702413924
Energy: 0.35187090216668615
Energy: 0.17353148369186583
Energy: 0.17569884132598648
Energy: 0.1735314836922847

minimum gb energy = 0.1711419545007429 eV
minimum distance =  3.17307554733411 Angstroms
sigma value = 15


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

Energy: 0.35370436006041484
Energy: 0.2052559969521181
Energy: 0.16097048297824734
Energy: 0.2052559969521181
Energy: 0.32635580856969515
Energy: 0.1598666084063222
Energy: 0.18330285143434713
Energy: 0.15986660840525774
Energy: 0.34956084573193635
Energy: 0.15973116559771405
Energy: 0.1830298379582311
Energy: 0.15973116559735928
Energy: 0.32926151154359823
Energy: 0.16112812080053118
Energy: 0.24233636160893893
Energy: 0.16112812080053118
Energy: 0.31825803917677514
Energy: 0.15905604000333332
Energy: 0.23545199290722366
Energy: 0.15905603998772155
Energy: 0.3270884158844429
Energy: 0.15930689780369633
Energy: 0.23662806184592294
Energy: 0.15930689780298674
Energy: 0.27883431624587657
Energy: 0.16065537640327157
Energy: 0.29268472416930724
Energy: 0.1606553762092699
Energy: 0.2941660568983091
Energy: 0.17523258495288127
Energy: 0.24978270894690935
Energy: 0.17523258495217164
Energy: 0.2786403021156473
Energy: 0.17484898181343456
Energy: 0.2910887439543766
Energy: 0.17484898181272493
Energy: 0.278174928359516
Energy: 0.15866237051586052
Energy: 0.3376526970613557
Energy: 0.15866237051727977
Energy: 0.23821717461059083
Energy: 0.16012012373392867
Energy: 0.31812913655006475
Energy: 0.1601201234874309
Energy: 0.21978597810452138
Energy: 0.15879627477122554
Energy: 0.33759707835896713
Energy: 0.15879627477866048
Energy: 0.23548932952715657
Energy: 0.1591050266295122
Energy: 0.34941888529500753
Energy: 0.15910502662986703
Energy: 0.1916843487000584
Energy: 0.1612008465163302
Energy: 0.30456462641222287
Energy: 0.16120084651562058
Energy: 0.18537457934866974
Energy: 0.158792679369806
Energy: 0.315454583330418
Energy: 0.15879267937051564
Energy: 0.19055008618431213
Energy: 0.15887071235541408
Energy: 0.35012126782462794
Energy: 0.15887071235399486
Energy: 0.1732319484312044
Energy: 0.1599888177639324
Energy: 0.35175123203415404
Energy: 0.1599888177639324
Energy: 0.16913227507550121
Energy: 0.15879859500443183
Energy: 0.35893501460229343
Energy: 0.15879859500407703
Energy: 0.17438577213213272
Energy: 0.15971656587305152
Energy: 0.31540733182405684
Energy: 0.15971656587269673
Energy: 0.19896655095786098
Energy: 0.1607121262130948
Energy: 0.3614984894871294
Energy: 0.1607121262130948
Energy: 0.19116452461930825
Energy: 0.15854022542097665
Energy: 0.3590336195511483
Energy: 0.15854022542097665
Energy: 0.19628013488586504
Energy: 0.15969611895008162
Energy: 0.3292073930953074
Energy: 0.15969611894937202
Energy: 0.24197129934811004
Energy: 0.15943014390256516
Energy: 0.3261416828133433
Energy: 0.15943014390256516
Energy: 0.24100511719948864
Energy: 0.15888729444153074
Energy: 0.3148015356370549
Energy: 0.15888729444117594
Energy: 0.24455519793193722
Energy: 0.1608406875554848
Energy: 0.28290063371611973
Energy: 0.16084068755406558
Energy: 0.29021984057073164
Energy: 0.1746089317650305
Energy: 0.31416270275730174
Energy: 0.17460893260982238
Energy: 0.25145239474823317
Energy: 0.17478720910092949
Energy: 0.2909385018774629
Energy: 0.17478720910234874
Energy: 0.29390209513742555
Energy: 0.17679047446076235
Energy: 0.28363442790837107
Energy: 0.17679047445969792
Energy: 0.3037852150327155
Energy: 0.17650919572056983
Energy: 0.2672218917517315
Energy: 0.17650919572056983
Energy: 0.302808158770533
Energy: 0.15928595451872285
Energy: 0.23700446481682547
Energy: 0.15928595451872285
Energy: 0.3183937208112921
Energy: 0.15900426931724532
Energy: 0.21972317265339483
Energy: 0.15900426931795494
Energy: 0.30474041858449896
Energy: 0.16101762538882058
Energy: 0.2419560484408222
Energy: 0.16101762538811096
Energy: 0.34977179949374543
Energy: 0.1598809314102069
Energy: 0.18364203391701567
Energy: 0.15988093140985207
Energy: 0.3384539202421822
Energy: 0.1595984977677242
Energy: 0.1829441118875765
Energy: 0.159598497773756
Energy: 0.39152589596484705
Energy: 0.18503201795257476
Energy: 0.1844244207889862
Energy: 0.18503201795257476
Energy: 0.3262647530725764
Energy: 0.16010507617324243
Energy: 0.1610865412030588
Energy: 0.16010507617324243
Energy: 0.37020279944877854
Energy: 0.16042955236707832
Energy: 0.16127454667119281
Energy: 0.1604295523667235

minimum gb energy = 0.15854022542097665 eV
minimum distance =  3.17636255262877 Angstroms
sigma value = 85


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

Energy: 0.3736184513301191
Energy: 0.20916720968469113
Energy: 0.15337209762395063
Energy: 0.20916720974190076
Energy: 0.3344842034482774
Energy: 0.14369299670080257
Energy: 0.16246306336267116
Energy: 0.14369299670141802
Energy: 0.3344492996838977
Energy: 0.14366186757873445
Energy: 0.16435085370306896
Energy: 0.14366186757873445
Energy: 0.2996507564846278
Energy: 0.14324558234817103
Energy: 0.2132188743299595
Energy: 0.14324558234817103
Energy: 0.32694701477925875
Energy: 0.1431061495226067
Energy: 0.210971459890668
Energy: 0.1431061495226067
Energy: 0.2921330248620408
Energy: 0.14335527996666877
Energy: 0.21211726969262085
Energy: 0.14335527996636105
Energy: 0.2935527173717296
Energy: 0.14360534432672087
Energy: 0.26282533956449833
Energy: 0.14360534432364358
Energy: 0.30400479155867516
Energy: 0.14303619756687952
Energy: 0.22146109862392227
Energy: 0.14303619777327495
Energy: 0.29344230796704257
Energy: 0.1434307720650052
Energy: 0.2613835515442094
Energy: 0.14343077204870255
Energy: 0.29313963506002516
Energy: 0.17084821174599468
Energy: 0.30381046229205416
Energy: 0.1708482117463024
Energy: 0.26084714318739005
Energy: 0.1433810561983988
Energy: 0.2800778558192061
Energy: 0.1433810569123238
Energy: 0.25007027943296917
Energy: 0.14273913976189045
Energy: 0.3039831939831167
Energy: 0.142739139761275
Energy: 0.26101604135910333
Energy: 0.14293507054888885
Energy: 0.31350554530478425
Energy: 0.1429350705522739
Energy: 0.209176470837058
Energy: 0.14424114577049066
Energy: 0.27235134177952736
Energy: 0.14424114577049066
Energy: 0.19417995500712468
Energy: 0.14279585788279736
Energy: 0.34390131994533696
Energy: 0.14279585788279736
Energy: 0.20938950359870348
Energy: 0.14327549485995614
Energy: 0.3140424961134035
Energy: 0.14327549486888028
Energy: 0.1678183293171103
Energy: 0.144044185077974
Energy: 0.31536696746619
Energy: 0.14404418506874211
Energy: 0.1659406901686887
Energy: 0.14275872264780315
Energy: 0.3262802795341587
Energy: 0.14275872262596134
Energy: 0.1667319367406574
Energy: 0.14348539924711173
Energy: 0.35334703778243726
Energy: 0.14348539924649625
Energy: 0.15225845134013113
Energy: 0.14332478292726908
Energy: 0.35337118412605023
Energy: 0.14332478292726908
Energy: 0.15206191397112495
Energy: 0.14229243587853474
Energy: 0.32577079983676077
Energy: 0.14229243587884247
Energy: 0.15336830699163945
Energy: 0.14222019405090486
Energy: 0.3234159217513346
Energy: 0.14222019405182804
Energy: 0.17141669332926515
Energy: 0.14302771869605277
Energy: 0.32456221722819734
Energy: 0.1430277186963605
Energy: 0.17224963660749365
Energy: 0.1427465864866988
Energy: 0.3633818049367721
Energy: 0.1427465864866988
Energy: 0.17197207904625628
Energy: 0.14245209555836816
Energy: 0.3094681154996519
Energy: 0.14245209555836816
Energy: 0.2160496283760812
Energy: 0.14295897164670482
Energy: 0.3546310626094443
Energy: 0.14295897164670482
Energy: 0.2155543286864429
Energy: 0.14265316915389115
Energy: 0.33412440941734195
Energy: 0.1426531691575839
Energy: 0.24262861743114125
Energy: 0.14404331161716938
Energy: 0.31072380540181405
Energy: 0.14404331161470754
Energy: 0.2594726039801553
Energy: 0.14256981891568873
Energy: 0.32452127193477287
Energy: 0.1425698190061192
Energy: 0.2594172534144859
Energy: 0.14267148134180727
Energy: 0.2924239513176392
Energy: 0.14267148134273044
Energy: 0.30534550139530703
Energy: 0.1709774394444261
Energy: 0.24895413773099287
Energy: 0.17097743944473381
Energy: 0.2705877146300321
Energy: 0.1712880346333088
Energy: 0.2976631544739963
Energy: 0.17128803463300107
Energy: 0.303764101310279
Energy: 0.18628698261417614
Energy: 0.24886397607688465
Energy: 0.18628698261417614
Energy: 0.32696573789408984
Energy: 0.14329862858199627
Energy: 0.24903700885380825
Energy: 0.1432986285813808
Energy: 0.2789411363363093
Energy: 0.14423206954727644
Energy: 0.2592267123815799
Energy: 0.14423206954419915
Energy: 0.34477991972428845
Energy: 0.1429905839851915
Energy: 0.21083952086513197
Energy: 0.14299058398488376
Energy: 0.35444574171791415
Energy: 0.14341773565086063
Energy: 0.21185813449468732
Energy: 0.14341773565239932
Energy: 0.3420911382045903
Energy: 0.14327385664806894
Energy: 0.16446011631537868
Energy: 0.1432738566486844
Energy: 0.32692152128826085
Energy: 0.14311584151100282
Energy: 0.16273936645973813
Energy: 0.14311584151100282
Energy: 0.3552672566935876
Energy: 0.1434333303250611
Energy: 0.1624774277531822
Energy: 0.1434333303253688
Energy: 0.31251159821456703
Energy: 0.14331328418249556
Energy: 0.1431892006773706
Energy: 0.14331328418280329
Energy: 0.3270195580572621
Energy: 0.1432643900266879
Energy: 0.14322769996720236
Energy: 0.14326439002638017
Energy: 0.3357079002155979
Energy: 0.14378758619244336
Energy: 0.1435177560269591
Energy: 0.14378758619213564

minimum gb energy = 0.14222019405090486 eV
minimum distance =  3.17775015175458 Angstroms
sigma value = 113


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

Energy: 0.004748608717207425
Energy: 0.005012766903570415
Energy: 0.2682463299285861
Energy: 0.005012766903333849
Energy: 0.007167139149622023
Energy: 0.03499892036849172
Energy: 0.18597935636289747
Energy: 0.03499892036849172
Energy: 0.0053134140717298025
Energy: 0.03460488709408693
Energy: 0.18540404620928957
Energy: 0.03460488709408693
Energy: 0.005251310926763344
Energy: 0.035633044122897535
Energy: 0.18710591759700276
Energy: 0.035633044122897535
Energy: 0.18575487228568485
Energy: 0.035490456952130114
Energy: 0.1867079437110492
Energy: 0.035490456952130114
Energy: 0.0071771486657858105
Energy: 0.03453600464673755
Energy: 0.1853650519136794
Energy: 0.03453600464673755

minimum gb energy = 0.004748608717207425 eV
minimum distance =  3.45915437764696 Angstroms
sigma value = 1