Model name: model_name=Morse_Shifted_GirifalcoWeizer_1959HighCutoff_Ag__MO_111986436268_004
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.073291137814522
cohesive_energy=3.00442488504709
mass=107.8682
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.196636888755188e-19, 1.7279955650680198e-19, 2.1497365204358398e-19, 2.5037694912508198e-19, 2.8086957482337e-19, 3.07539407072934e-19, 3.31080188356296e-19, 3.51996604313166e-19, 3.7062831638995196e-19, 3.87241285907898e-19, 4.0205180671259394e-19, 4.15231311703878e-19, 4.2691758807227397e-19, 4.3722599253543e-19, 4.46259064397922e-19, 4.54106525551254e-19, 4.60835667414054e-19, 4.66512179228316e-19, 4.71193739352864e-19, 4.749364239698879e-19, 4.77783491848506e-19, 4.797717930512999e-19, 4.809413819941199e-19, 4.813243022096459e-19, 4.809205536978779e-19, 4.79593951444926e-19, 4.77161847314514e-19, 4.73407947461052e-19, 4.680759036230999e-19, 4.60854893533662e-19, 4.51366803507114e-19, 4.39145400142962e-19, 4.23621910736136e-19, 4.04107399334016e-19, 3.79704647021562e-19, 3.4929853886150995e-19, 3.1148717029911e-19, 2.64460081737942e-19, 2.0589892358860798e-19, 1.327289586727986e-19, 4.0898442500791196e-20, -7.506421835018759e-20, -2.22609625881228e-19, -4.12190380452546e-19, -6.586403946476939e-19, -9.83617892205084e-19, -1.4196166174388698e-18, -2.01707629514064e-18, -2.8574019179072994e-18, -4.0786610571738e-18, -5.92986400539642e-18, -8.89578134672454e-18, -1.402474929631704e-17, -2.3940684571208397e-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: 0.011177218491118534
Energy: 0.7745820572194851
Energy: 0.3999146213505286
Energy: 1.034094688652002
Energy: 1.0297233391908351
Energy: 0.3561030407285225
Energy: 0.011457777579046053
Energy: 0.08525608121228931
Energy: 0.776094872813759
Energy: 0.08603626849887434
Energy: 0.21654377071824685
Energy: 0.7692114768339301
Energy: 0.01285272382164565
Energy: 0.08716989622815613
Energy: 0.011514332136996914
Energy: 0.7728618728892627
Energy: 0.21721840549634144
Energy: 0.21739447759463423
Energy: 0.7685715969181355
Energy: 0.08537311760773815
Energy: 0.08692665640015762
Energy: 0.013721958643442974
Energy: 0.7793917758110159
Energy: 0.4001542101931366
Energy: 0.7774526841159933
Energy: 0.7785110037981143
Energy: 0.08568658814939625
Energy: 0.012310734128819088
Energy: 0.08578218082422859
Energy: 0.771085850234999
Energy: 0.08611239523360643
Energy: 0.3990045805286317
Energy: 0.7700801724799499
Energy: 0.012162117189244032
Energy: 0.08746971554000324
Energy: 0.01143512776336838
Energy: 0.7723882045410857
Energy: 0.216839557410343
Energy: 0.2169617863812392
Energy: 0.7682656809458905
Energy: 0.08521794713011711
Energy: 0.08685788404687793

minimum gb energy = 0.011177218491118534 eV
minimum distance =  2.85144008034716 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.236419501941059
Energy: 1.220838739898727
Energy: 1.3972609083040441
Energy: 1.2689085233695565
Energy: 1.3320487258951401
Energy: 1.3028897667135748
Energy: 1.246057205252854
Energy: 1.2065412477875241
Energy: 1.2248166962066955
Energy: 1.2184136467402527
Energy: 1.3213401540397876
Energy: 1.310600425389212
Energy: 1.2165563171906382
Energy: 1.2090643672735666
Energy: 1.2131631836129557
Energy: 1.2751962409670161
Energy: 1.2716811900381537
Energy: 1.27319459649586
Energy: 1.280142958314862
Energy: 1.2929480750878737
Energy: 1.2869923232872558
Energy: 1.2250241397732036
Energy: 1.2717365857318523
Energy: 1.2174620820605266
Energy: 1.2994919385657813
Energy: 1.2428726115302335
Energy: 1.2241932136170257
Energy: 1.2587136635549474
Energy: 1.307324574382143
Energy: 1.2639273722597502
Energy: 1.3077098395728917
Energy: 1.239279539743047
Energy: 1.2973393144513745
Energy: 1.3557664652642312
Energy: 1.2908631285862213
Energy: 1.2710874755101726
Energy: 1.2326936425965516
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Energy: 1.2563341873381375
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Energy: 1.224874976673899
Energy: 1.2043516997769523
Energy: 1.2617071860780003
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Energy: 1.2589266220237358
Energy: 1.3211101656858715
Energy: 1.2662858764448155
Energy: 1.2562640428646545
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Energy: 1.268042045822256
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Energy: 1.2094974741855304
Energy: 1.289840468280889
Energy: 1.2752664334327002
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Energy: 1.2444935998996969
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Energy: 1.2179646238920951
Energy: 1.2743919574287947
Energy: 1.3046191781739536
Energy: 1.2425612771597052
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Energy: 1.2682532220725595
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Energy: 1.3064394712132688
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Energy: 1.23370050081543
Energy: 1.303956010670048
Energy: 1.3215106728531616
Energy: 1.291633380922002
Energy: 1.2819390458674687
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Energy: 1.2308080464481206
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Energy: 1.2653831786114176
Energy: 1.2722500582790583
Energy: 1.261660892634117
Energy: 1.291093943862393
Energy: 1.2085474218084338
Energy: 1.2947702246842456
Energy: 1.205381425407342
Energy: 1.2948727087433975
Energy: 1.2862769457963554
Energy: 1.2231782873382022
Energy: 1.2502053176482817
Energy: 1.2584705237612464
Energy: 1.2198787815513303
Energy: 1.2778266889043544
Energy: 1.322002100125199
Energy: 1.295607294738413
Energy: 1.2598403177387163
Energy: 1.3021763507968276
Energy: 1.2334162124246366
Energy: 1.2836892932975563
Energy: 1.200813285485378
Energy: 1.3165913889279384
Energy: 1.3042787701201561
Energy: 1.2131199645549802
Energy: 1.2393785325067428
Energy: 1.2110681550828968
Energy: 1.2819259097010438
Energy: 1.2568908283618567
Energy: 1.3023342438394458
Energy: 1.2810947705754976
Energy: 1.2729050412410032
Energy: 1.287272232402861
Energy: 1.2409561568454506
Energy: 1.243366812926661
Energy: 1.2198186490838472
Energy: 1.2888206405853337
Energy: 1.2867756909477952
Energy: 1.1950744288032362
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Energy: 1.2391031185581787
Energy: 1.3128760583635724
Energy: 1.2588034055134576
Energy: 1.328475690330538
Energy: 1.3038052981166346
Energy: 1.2513630226325743

minimum gb energy = 1.1950744288032362 eV
minimum distance =  2.56605452532948 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.3995779344473904
Energy: 1.232158536450585
Energy: 1.31047179371042
Energy: 1.2638353099943433
Energy: 1.2743349035505094
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Energy: 1.2728357426269123
Energy: 1.4225140021371454
Energy: 1.3486006574817953
Energy: 1.2641608994298104
Energy: 1.2455987225162024
Energy: 1.2241059162139947
Energy: 1.1978167822609236
Energy: 1.270041022406744
Energy: 1.3094692825086383
Energy: 1.3113581952483555
Energy: 1.2915337827614632
Energy: 1.2515846791645202
Energy: 1.212846426787507
Energy: 1.199874903628121
Energy: 1.3288465852941769
Energy: 1.2961620298717662
Energy: 1.2302790847810277
Energy: 1.2729610388123944
Energy: 1.3360176851140322
Energy: 1.276516280665173
Energy: 1.2260549576094775
Energy: 1.3780299828213665
Energy: 1.2826710015738307
Energy: 1.2581980992007444
Energy: 1.273106445032468
Energy: 1.2502298708212207
Energy: 1.2596190444985504
Energy: 1.258720197177251
Energy: 1.232350615875466
Energy: 1.2524300430035915
Energy: 1.224944126107723
Energy: 1.239817463234933
Energy: 1.3039951109299857
Energy: 1.2758433887084104
Energy: 1.235489134866367
Energy: 1.2695699102921683
Energy: 1.2320292631997793
Energy: 1.22466673396193
Energy: 1.2674097604955024
Energy: 1.303363866301425
Energy: 1.2628159124190077
Energy: 1.2579771300162228
Energy: 1.261996080981048
Energy: 1.230578775945965
Energy: 1.2465323167696025
Energy: 1.248978527653598
Energy: 1.2856506293145435
Energy: 1.2492870425096254
Energy: 1.306212288085899
Energy: 1.3277048210842586
Energy: 1.2419154507392811
Energy: 1.305252953011917
Energy: 1.2784482016829666
Energy: 1.2270965707618906
Energy: 1.2552083213792136
Energy: 1.240891176909151
Energy: 1.2436624018577627
Energy: 1.3225824005042968
Energy: 1.248740697421163
Energy: 1.2803738166283842
Energy: 1.2432461625104918
Energy: 1.2555433346560476
Energy: 1.2230389394818493
Energy: 1.2735121768534499
Energy: 1.3279547716111966
Energy: 1.3115143940079543
Energy: 1.2509188124554924
Energy: 1.2554169177808956
Energy: 1.2646886768302703
Energy: 1.2030231634037343
Energy: 1.2553276423951683
Energy: 1.3108811690068576
Energy: 1.2489299033807504
Energy: 1.3070684840097828
Energy: 1.2410630809939225
Energy: 1.256866503909163
Energy: 1.2002132623674673
Energy: 1.251246541283346
Energy: 1.3288130923560164
Energy: 1.2671177909906335
Energy: 1.318962603435373
Energy: 1.2258326857387578
Energy: 1.2579833348714826
Energy: 1.2024187230795964
Energy: 1.285481401838355
Energy: 1.3311112533758178
Energy: 1.2298681799638578
Energy: 1.274078904233071
Energy: 1.2777521202771562
Energy: 1.4133502015042911
Energy: 1.2451697747816135
Energy: 1.3626447201703602
Energy: 1.2514047580045051
Energy: 1.2492257317123039
Energy: 1.2471380778273369
Energy: 1.2504978594358411
Energy: 1.2578078692602885
Energy: 1.2744314377302965
Energy: 1.246888933051043
Energy: 1.2512662712274805
Energy: 1.2337635360798571
Energy: 1.2419197361528853
Energy: 1.2582632446856366
Energy: 1.3231125199643212
Energy: 1.2781667604081757
Energy: 1.2881441910660167
Energy: 1.2372162316986255

minimum gb energy = 1.1930456725812189 eV
minimum distance =  2.5901221873261 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.3639450617076572
Energy: 1.3058016716884622
Energy: 1.3303716465527609
Energy: 1.303127122185856
Energy: 1.315577925113859
Energy: 1.2702527346214407
Energy: 1.2872893000237895
Energy: 1.30135833926843
Energy: 1.279033124094324
Energy: 1.2896290712564311
Energy: 1.2967725825161966
Energy: 1.3188684041046461
Energy: 1.2922851842860161
Energy: 1.2892574353840192
Energy: 1.242519575309832
Energy: 1.297808024172168
Energy: 1.2706348388139754
Energy: 1.3276500476813229
Energy: 1.3122585671059386
Energy: 1.2981568429180985
Energy: 1.2629008015023613
Energy: 1.274930852134173
Energy: 1.2451830182375445
Energy: 1.3062584352497728
Energy: 1.3909499741186677
Energy: 1.2978457579311002
Energy: 1.2657338147331418
Energy: 1.310153505689243
Energy: 1.2875511790862342
Energy: 1.3074376478723428
Energy: 1.2537108754456012
Energy: 1.26591644635828
Energy: 1.2919447304002944
Energy: 1.277259147759437
Energy: 1.3343143801434363
Energy: 1.277529427648348
Energy: 1.267541087754596
Energy: 1.2526354155448407
Energy: 1.265381044500255
Energy: 1.2737958894310901
Energy: 1.2611274909980195
Energy: 1.2581862523814993
Energy: 1.2789450975775172
Energy: 1.2885342305847665
Energy: 1.260205791532881
Energy: 1.315605087473013
Energy: 1.2679077614050274
Energy: 1.3356267939767714
Energy: 1.324707314688484
Energy: 1.296602426487424
Energy: 1.2499682560248497
Energy: 1.2894951676564876
Energy: 1.258646067182093
Energy: 1.3778400523785306
Energy: 1.2904177039444047
Energy: 1.3353576828548086
Energy: 1.277040235502211
Energy: 1.3301824301249536
Energy: 1.2694288143416055
Energy: 1.3191050200776144
Energy: 1.2831770037005805
Energy: 1.2983900260189425
Energy: 1.3227084185830786
Energy: 1.3040981330336507
Energy: 1.3008878453482433
Energy: 1.2935187879571899
Energy: 1.2504988188869977
Energy: 1.3001720938141865
Energy: 1.2648275230529178
Energy: 1.3218388801866234
Energy: 1.2962158883668649
Energy: 1.2542807490543633
Energy: 1.2814436848438202
Energy: 1.3159727929175737
Energy: 1.3026893135730562
Energy: 1.2874899785876857
Energy: 1.2867062083811962
Energy: 1.2768265510943897
Energy: 1.2750646238677388
Energy: 1.2635238489979874
Energy: 1.254224937860168
Energy: 1.2765408136106648
Energy: 1.2877025670216702
Energy: 1.2722721503647323
Energy: 1.3021684058997
Energy: 1.2907700228700731
Energy: 1.2945570154938153
Energy: 1.2922388606710569
Energy: 1.284316357456154
Energy: 1.298535773744453
Energy: 1.298381106859486
Energy: 1.2954272806930702
Energy: 1.2501281963761546
Energy: 1.300036204491763
Energy: 1.3279579829330745
Energy: 1.3937447168436112
Energy: 1.3028570205992
Energy: 1.3358977581851388
Energy: 1.2731456664052925
Energy: 1.2796341082391178
Energy: 1.252723708535645
Energy: 1.2852808988577114
Energy: 1.279590591814871
Energy: 1.2604600100118875
Energy: 1.3061055956576604
Energy: 1.28391983721196
Energy: 1.3042522937374723
Energy: 1.3046528690083172
Energy: 1.2725009128529632
Energy: 1.2878272406616056
Energy: 1.231362855797158
Energy: 1.2893505831751082
Energy: 1.2989168722736688
Energy: 1.2685504177138125
Energy: 1.2677380017491473
Energy: 1.279248787075447
Energy: 1.2763330857031399
Energy: 1.2822937410403479
Energy: 1.3262427974250726
Energy: 1.2812666198176292
Energy: 1.306041287607784
Energy: 1.263591639960819
Energy: 1.243674997755749
Energy: 1.2546684270510442
Energy: 1.23988144075269
Energy: 1.2929782184080663
Energy: 1.2652897838869956
Energy: 1.315076135550745
Energy: 1.2745923063276425
Energy: 1.266244878668624
Energy: 1.2540829866565233
Energy: 1.2966487073011281
Energy: 1.3272063561065484
Energy: 1.2895628426342398
Energy: 1.311319590170473
Energy: 1.2809910839433574
Energy: 1.3069387850669223
Energy: 1.2774991646988003
Energy: 1.3395387575615596
Energy: 1.3746066448370236
Energy: 1.271437566335897
Energy: 1.2860075507862219
Energy: 1.3084617996101904
Energy: 1.294736736897645
Energy: 1.3163960901425937
Energy: 1.3098918257797045
Energy: 1.335136434194499
Energy: 1.2748960155439037
Energy: 1.313103953029059
Energy: 1.288582656746782
Energy: 1.2449259341544825
Energy: 1.250377578915481
Energy: 1.3103749726087353
Energy: 1.298313523942023
Energy: 1.2916358016848075
Energy: 1.2836771194086507
Energy: 1.2859838469288132
Energy: 1.3008859319632715
Energy: 1.2626993801981443
Energy: 1.316726848144519
Energy: 1.2823692326871072
Energy: 1.258675204163436
Energy: 1.3134455103098053
Energy: 1.3042882992792593
Energy: 1.2642162545754523
Energy: 1.2620251184415552
Energy: 1.2428321850344881
Energy: 1.284229375624532
Energy: 1.3266541012490087
Energy: 1.3086969462104547
Energy: 1.2571784380904596
Energy: 1.3117846313465857
Energy: 1.2478400319379102
Energy: 1.2862066293226007
Energy: 1.3276238134775369
Energy: 1.2607634796361573
Energy: 1.3012700608408438
Energy: 1.2870247773138614
Energy: 1.3511660592008403
Energy: 1.42316244670645
Energy: 1.2784350493247674
Energy: 1.3218185713067698
Energy: 1.26934725787745
Energy: 1.3361476617450012
Energy: 1.2867117377949007
Energy: 1.3199783905938285
Energy: 1.3099657602955372
Energy: 1.2802753277026573
Energy: 1.241967045266728
Energy: 1.2652142217347013
Energy: 1.3029926331864452
Energy: 1.2802818391742379
Energy: 1.201866523111959
Energy: 1.284029259943662
Energy: 1.2401242821594236
Energy: 1.238939661168437
Energy: 1.2594299285977049
Energy: 1.3216554952130495
Energy: 1.2530150520523817
Energy: 1.3018849180219343
Energy: 1.29509040800579
Energy: 1.2496615769805293
Energy: 1.3059364191641953
Energy: 1.3253424621005494
Energy: 1.2969924973605933
Energy: 1.2744283545226347
Energy: 1.2824018461813849
Energy: 1.2904107596561387
Energy: 1.2829890712113396
Energy: 1.3055269088273047
Energy: 1.2597454332945206
Energy: 1.3084569258332535
Energy: 1.2616557915188573
Energy: 1.313448065555793
Energy: 1.2476779224716628
Energy: 1.2742659204103837
Energy: 1.3095745045249618
Energy: 1.2749102399959242
Energy: 1.2950126987963766
Energy: 1.2565467042551373
Energy: 1.3023708239913807
Energy: 1.378193971456662
Energy: 1.2837837483185037
Energy: 1.3331010280860065
Energy: 1.2791844634194969
Energy: 1.3114177909358569
Energy: 1.2675656873668562
Energy: 1.3111999037309585
Energy: 1.314468955662306
Energy: 1.2711537831790976
Energy: 1.3183504318720587
Energy: 1.2713230905019268
Energy: 1.2789660197445394
Energy: 1.2634808154123676
Energy: 1.2907118976803225
Energy: 1.260503749335892
Energy: 1.3065656917463084
Energy: 1.2668122219591131
Energy: 1.3137584872062518
Energy: 1.2816917107793857
Energy: 1.2939736291983803
Energy: 1.2952005813238594
Energy: 1.283357836146042
Energy: 1.2844880229351834
Energy: 1.2889860391631691
Energy: 1.302506075885828
Energy: 1.318891373405845
Energy: 1.3770244939609961
Energy: 1.2760419212699243
Energy: 1.3131766081400107
Energy: 1.2897584890739187
Energy: 1.3122729331075524

minimum gb energy = 1.201866523111959 eV
minimum distance =  2.57123746463714 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.1969747791464478
Energy: 1.2191740245937153
Energy: 1.6977188847806146
Energy: 1.4682940124316444
Energy: 1.2551924570595283
Energy: 1.3310330676699331
Energy: 1.1804207426859064
Energy: 1.2388626690632107
Energy: 1.2837679150149695
Energy: 1.2143962754967401
Energy: 1.2662558729600255
Energy: 1.2679536779339855
Energy: 1.2553951278429722
Energy: 1.260531051297993
Energy: 1.2552930274718512
Energy: 1.1635576385722752
Energy: 1.213448638715107
Energy: 1.3530793516313522
Energy: 1.2733304904815848
Energy: 1.2542559962323392
Energy: 1.2541678625871169
Energy: 1.2566891306854415
Energy: 1.1638797768098503
Energy: 1.3305053560132283
Energy: 1.162075908770458
Energy: 1.3349670292409432
Energy: 1.21770882514805
Energy: 1.3133492467189216
Energy: 1.2850901692552064
Energy: 1.2678365601654968
Energy: 1.3534469320584432
Energy: 1.21567038249095
Energy: 1.2061105007403978
Energy: 1.2272555143035089
Energy: 1.254545123198065
Energy: 1.1791244750089829
Energy: 1.2668303258500473
Energy: 1.2147634547370463
Energy: 1.2307984013512598
Energy: 1.283842113590441
Energy: 1.253826917116937
Energy: 1.2861815934483598
Energy: 1.256805686466925
Energy: 1.2462120600657183
Energy: 1.2138681454419475
Energy: 1.277481740932367
Energy: 1.1800423777183333
Energy: 1.180543624831192
Energy: 1.2601243618155158
Energy: 1.179786122252716
Energy: 1.2849380231917034
Energy: 1.3420693532316879
Energy: 1.2317204524535499
Energy: 1.342384004110462
Energy: 1.2150520844733268
Energy: 1.285862985867493
Energy: 1.1795610809172694
Energy: 1.2842189069886334
Energy: 1.343460936094276
Energy: 1.2310981126767948
Energy: 1.2664393117618256
Energy: 1.2136497938687814
Energy: 1.2859177588170547
Energy: 1.2564704273565772
Energy: 1.2448004434308801
Energy: 1.2178639839564305
Energy: 1.334172673842312
Energy: 1.2729020404936902
Energy: 1.253639244831245
Energy: 1.254109916851644
Energy: 1.2559585727142677
Energy: 1.233073936213768
Energy: 1.2193322606532326
Energy: 1.2335308986569793
Energy: 1.2842900957296393
Energy: 1.2585326559161165
Energy: 1.3140134321414692
Energy: 1.285381684868278
Energy: 1.2668648811938268
Energy: 1.2313915215986109
Energy: 1.163097530982507
Energy: 1.2860599797361778
Energy: 1.228508189776203
Energy: 1.2586366980808843
Energy: 1.1810058697828858
Energy: 1.1953150468058003
Energy: 1.3411393763002073
Energy: 1.2172116466726273
Energy: 1.3414079414663735
Energy: 1.2183424016532662
Energy: 1.2542000936548343
Energy: 1.2555106279339037
Energy: 1.1641556848281238
Energy: 1.2137340085611374
Energy: 1.306889677099015
Energy: 1.1799635253141363
Energy: 1.1805568819748933
Energy: 1.2601448382023193
Energy: 1.1791293208354687
Energy: 1.2452472506887187
Energy: 1.2131873836996687
Energy: 1.3461354541127184
Energy: 1.180019242852713
Energy: 1.1799079875487621
Energy: 1.260770971164986
Energy: 1.180243605523014
Energy: 1.3263247774834892
Energy: 1.3408275559852472
Energy: 1.2146807742988057
Energy: 1.264454236761803
Energy: 1.3314546880891485
Energy: 1.1800887348817133
Energy: 1.2592917337268463
Energy: 1.283915340018363
Energy: 1.2149505208633422
Energy: 1.266369704038171
Energy: 1.2689364102912093
Energy: 1.255421260090103
Energy: 1.2602872228174722
Energy: 1.2547728975716947
Energy: 1.165319831392424
Energy: 1.2137356982256478
Energy: 1.3535578994806639
Energy: 1.273269039681441
Energy: 1.2545180096493693
Energy: 1.2540731197602006
Energy: 1.2565156860776454
Energy: 1.1639353617489259
Energy: 1.2208625171192344
Energy: 1.1622205677295774
Energy: 1.335053874868878
Energy: 1.2151019739667366
Energy: 1.3950222116195303
Energy: 1.28559694537711
Energy: 1.2677379413418686
Energy: 1.3534539315400085
Energy: 1.2157651457890473
Energy: 1.3358713779209663
Energy: 1.2138685508641507
Energy: 1.2546787137938284
Energy: 1.1791467475678017
Energy: 1.266880770723654
Energy: 1.214568028663541
Energy: 1.2307505609308766
Energy: 1.2846811708291022
Energy: 1.1800390943485284
Energy: 1.2865457724470382
Energy: 1.2569158545373322
Energy: 1.2472889456812297
Energy: 1.2138459522269633
Energy: 1.207092201022108
Energy: 1.180020872081492
Energy: 1.1805566987768883
Energy: 1.2601372418647472
Energy: 1.180358990920801
Energy: 1.2867052167171815
Energy: 1.287189046933851
Energy: 1.2320000073387798
Energy: 1.3432953475322351
Energy: 1.2149627507107974
Energy: 1.285200169502139
Energy: 1.1792720620340347
Energy: 1.2838377896023938
Energy: 1.3425231104189368
Energy: 1.2311989561655932
Energy: 1.2663663107650085
Energy: 1.213645385234211
Energy: 1.2863236928101984
Energy: 1.2566058079518985
Energy: 1.2463019495086842
Energy: 1.2192958450519105
Energy: 1.3350462545000759
Energy: 1.273242913173162
Energy: 1.2536255704765735
Energy: 1.2542141464718064
Energy: 1.2559191592288508
Energy: 1.2331304938039938
Energy: 1.2211940938134265
Energy: 1.233387246529616
Energy: 1.2835976012996944
Energy: 1.2139113042050007
Energy: 1.315099070397049
Energy: 1.2846537073961906
Energy: 1.2668061685315317
Energy: 1.2316901103272828
Energy: 1.233791045419355
Energy: 1.2888643589400703
Energy: 1.227353526388487
Energy: 1.2586831481828085
Energy: 1.1803433864908308
Energy: 1.269770670633056
Energy: 1.3411156813603968
Energy: 1.2173207553194616
Energy: 1.3523146082772868
Energy: 1.2179635868467265
Energy: 1.2542499579305568
Energy: 1.255710882739882
Energy: 1.1639194497531316
Energy: 1.2136618009310296
Energy: 1.3071807878385606
Energy: 1.1799568484719412
Energy: 1.1806207778547528
Energy: 1.2598974421249378
Energy: 1.1790896791564194
Energy: 1.2454720430300268
Energy: 1.2131247896381654
Energy: 1.2307097419178863
Energy: 1.1800122564487894
Energy: 1.1799477289627702
Energy: 1.2608782400313705

minimum gb energy = 1.162075908770458 eV
minimum distance =  2.62351921543952 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.5155884651518634
Energy: 1.332190630300837
Energy: 1.2148829235964815
Energy: 1.2374017162565734
Energy: 1.2262985168452363
Energy: 1.2268249707773005
Energy: 1.4239902950529515
Energy: 1.3169612260569479
Energy: 1.2780189035859173
Energy: 1.3525307229160797
Energy: 1.2474637986023318
Energy: 1.1509456016622626
Energy: 1.3395354422727352
Energy: 1.2365831604922586
Energy: 1.2265178504659642
Energy: 1.235876710193973
Energy: 1.2773828358049577
Energy: 1.2014175518119727
Energy: 1.3373958484468276
Energy: 1.3320883176374636
Energy: 1.2388215127222777
Energy: 1.4921896218818271
Energy: 1.2374085131320243
Energy: 1.2307570670965469
Energy: 1.264544922252661
Energy: 1.2608254459583725
Energy: 1.2272853844586942
Energy: 1.2075485618148967
Energy: 1.2055864676231869
Energy: 1.2096698085680133
Energy: 1.2628618339218747
Energy: 1.1810812376734505
Energy: 1.1309416970189154
Energy: 1.233000285474673
Energy: 1.2192639176423201
Energy: 1.1758410052297212
Energy: 1.1506102608763407
Energy: 1.295978367381309
Energy: 1.2342868762177786
Energy: 1.1252729803709334
Energy: 1.2353741566359886
Energy: 1.2172687686158303
Energy: 1.3944954896314354
Energy: 1.176403778911685
Energy: 1.2550235323952617
Energy: 1.2306636955511658
Energy: 1.1752619238867894
Energy: 1.1755357128826602
Energy: 1.2167169011986534
Energy: 1.226576966916166
Energy: 1.1815009446163425
Energy: 1.2757314914265505
Energy: 1.2634515906054447
Energy: 1.239503615746301
Energy: 1.2058189189196058
Energy: 1.2230932780787003
Energy: 1.2379635443374302
Energy: 1.1795959495151134
Energy: 1.2732917816014973
Energy: 1.3128491437904906
Energy: 1.2265828739283988
Energy: 1.3697072865417985
Energy: 1.2330281351133547
Energy: 1.4924569525581615
Energy: 1.337866213713582
Energy: 1.1681208060902353
Energy: 1.2452085723530864
Energy: 1.2265241407220446
Energy: 1.2286278650700773
Energy: 1.2054615957855968
Energy: 1.3330409369147875
Energy: 1.2487822521719352
Energy: 1.2543773987270275
Energy: 1.306299270425733
Energy: 1.1752988836962757
Energy: 1.1751294916940156
Energy: 1.2288597869718287
Energy: 1.2273587915083413
Energy: 1.2844274526174766
Energy: 1.3762610749286808
Energy: 1.244836858021935
Energy: 1.3083772782523029
Energy: 1.4226066203135905
Energy: 1.3961276670889569
Energy: 1.4221583543372163
Energy: 1.345310906982529
Energy: 1.2232450307219431
Energy: 1.2508554506228011
Energy: 1.1853743748210375
Energy: 1.2280515569520905
Energy: 1.175531816197807
Energy: 1.1742559469673173
Energy: 1.2336273256794807
Energy: 1.334474938901089
Energy: 1.2574177567170821
Energy: 1.277152928986901
Energy: 1.240502416152439
Energy: 1.2355408992047339
Energy: 1.2278401851100011
Energy: 1.2652038891341382
Energy: 1.2404061248881413
Energy: 1.191669637464846
Energy: 1.359697966183903
Energy: 1.3425947921559853
Energy: 1.3795845189690228
Energy: 1.4589899579165118
Energy: 1.1310355516019517
Energy: 1.238818489005238
Energy: 1.244711663938151
Energy: 1.2421603165213657
Energy: 1.2305068817455367
Energy: 1.2383069447596744
Energy: 1.205687631716351
Energy: 1.278081933469858
Energy: 1.243923660765104
Energy: 1.1796169426194703
Energy: 1.0907412284646008
Energy: 1.219414127411103
Energy: 1.2307703953058788
Energy: 1.1748259186267092
Energy: 1.1404524111387089
Energy: 1.309905073625729
Energy: 1.1706948855967545
Energy: 1.236819199766692
Energy: 1.2181132918438908
Energy: 1.2063862335497484
Energy: 1.174422931610561
Energy: 1.1267244720747294
Energy: 1.2613317435485596
Energy: 1.3110050013354113
Energy: 1.1754090033031557
Energy: 1.1753598296577634
Energy: 1.2186012543985838
Energy: 1.1992301097541291
Energy: 1.1800594163190559
Energy: 1.2305533213891298
Energy: 1.339932552067591
Energy: 1.2110155225727222
Energy: 1.2057385729612435
Energy: 1.2282361915993192
Energy: 1.2264711787905207
Energy: 1.1406704119915851
Energy: 1.289730350910938
Energy: 1.282371230742278
Energy: 1.2363166776592889
Energy: 1.2145115461419453
Energy: 1.257450463838005
Energy: 1.330340138585049
Energy: 1.195437440380104
Energy: 1.2498947359104127
Energy: 1.283199958726809
Energy: 1.1553486841752028
Energy: 1.2190653530864726
Energy: 1.22360241325066
Energy: 1.452718640012868
Energy: 1.1811894949595718
Energy: 1.1915736051407568
Energy: 1.2461933714164617
Energy: 1.24934889840989
Energy: 1.2392883389500697
Energy: 1.205633800275739
Energy: 1.227816930988241
Energy: 1.2655790326252283
Energy: 1.1518109372735514
Energy: 1.3171750630183114
Energy: 1.4230572267656563
Energy: 1.4237017208563547
Energy: 1.4303836262084593
Energy: 1.174288729123083
Energy: 1.2921372628458654
Energy: 1.2894352798610886
Energy: 1.2869696893986486
Energy: 1.2998689010176352
Energy: 1.2392284245603375
Energy: 1.2168213690676628

minimum gb energy = 1.0907412284646008 eV
minimum distance =  2.59917713173864 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.4735771305793504
Energy: 1.2179621124404518
Energy: 1.2426210248754201
Energy: 1.3298473294171484
Energy: 1.2440134912827945
Energy: 1.4083586430765842
Energy: 1.4272364294838142
Energy: 1.300566413093738
Energy: 1.2215722673096674
Energy: 1.236728532227656
Energy: 1.325377467234423
Energy: 1.140588086865446
Energy: 1.2446543004741963
Energy: 1.1504128602706472
Energy: 1.2561350252761347
Energy: 1.3055132957884887
Energy: 1.325179969580967
Energy: 1.27161098640018
Energy: 1.2686597397693569
Energy: 1.3126966399865185
Energy: 1.2856352398394204
Energy: 1.2244516102724197
Energy: 1.1912464149057724
Energy: 1.332505061358685
Energy: 1.3043044965377177
Energy: 1.3286573828584558
Energy: 1.4074240203788877
Energy: 1.1661351230506702
Energy: 1.1365602256967544
Energy: 1.1776845997059087
Energy: 1.1462592160052723
Energy: 1.241458212248925
Energy: 1.217559122262714
Energy: 1.1629923198904186
Energy: 1.3497579693000101
Energy: 1.2820138393146914
Energy: 1.2537619371283615
Energy: 1.2449772477455707
Energy: 1.1521916959781318
Energy: 1.241191348979238
Energy: 1.3618374803256166
Energy: 1.1946045883432894
Energy: 1.2720673703578798
Energy: 1.171864346481606
Energy: 1.2846012078885352
Energy: 1.231355562076559
Energy: 1.1374123643508574
Energy: 1.260836392959823
Energy: 1.2335064797062554
Energy: 1.2176491648666998
Energy: 1.1748686450499004
Energy: 1.1551490834427651
Energy: 1.151244304184529
Energy: 1.2864177543962065
Energy: 1.1530931196922358
Energy: 1.2001997217399956
Energy: 1.1471403742895345
Energy: 1.227956249040686
Energy: 1.2912440188146075
Energy: 1.158272636497606
Energy: 1.1408774074983057
Energy: 1.383604613912869
Energy: 1.3423154225792222
Energy: 1.292459117386399
Energy: 1.1886832606898403
Energy: 1.2287460925101212
Energy: 1.16908325726109
Energy: 1.2059327943414095
Energy: 1.2069437960002523
Energy: 1.1553061251301444
Energy: 1.2967532538631619
Energy: 1.1633025917686963
Energy: 1.2435673487592735
Energy: 1.1727043977667078
Energy: 1.2090272811121558
Energy: 1.2579887048518146
Energy: 1.1905730429904466
Energy: 1.1797495771882878
Energy: 1.1669179892648887
Energy: 1.3818405279764892
Energy: 1.2090351431603297
Energy: 1.306578445869162
Energy: 1.4572975727404136
Energy: 1.1736126982710087
Energy: 1.2182512986025478
Energy: 1.18760433205755
Energy: 1.2495601337206026
Energy: 1.2584944625828183
Energy: 1.1956034648423908
Energy: 1.228923005185853
Energy: 1.1771796536948393
Energy: 1.3849681459248204
Energy: 1.1755968147362226
Energy: 1.2261382905678218
Energy: 1.2254546644979138
Energy: 1.1882557894866266
Energy: 1.2084373751670585
Energy: 1.1966835767179855
Energy: 1.249340217570042
Energy: 1.370852646620858
Energy: 1.3210169687866138
Energy: 1.159286738326583
Energy: 1.246927823921631
Energy: 1.3263062241757364
Energy: 1.2569280060624595
Energy: 1.1346609270731671
Energy: 1.2749440373101435
Energy: 1.1500692995637718
Energy: 1.223075389615088
Energy: 1.162359677119373
Energy: 1.2002319570894706
Energy: 1.2313948388901603
Energy: 1.2839316268253043
Energy: 1.1635083672693678
Energy: 1.2362037527000576
Energy: 1.1870655143710094
Energy: 1.1327003683299548
Energy: 1.215854337880914
Energy: 1.2810765338117016
Energy: 1.3134213841795706
Energy: 1.2977751268893454
Energy: 1.4198739006716323
Energy: 1.1465566418212387
Energy: 1.2779839923274587
Energy: 1.3983235795781601
Energy: 1.2006490008422197
Energy: 1.2108025582634863
Energy: 1.2028439588738715
Energy: 1.294972987570787
Energy: 1.202365839216664
Energy: 1.1567477177226237
Energy: 1.161533508345404
Energy: 1.2025195316832924
Energy: 1.166313108069723
Energy: 1.2962615707243665
Energy: 1.197281128508469
Energy: 1.2898711913721037
Energy: 1.3325570970238352
Energy: 1.4076909718124608
Energy: 1.3197979962066186
Energy: 1.3551642787550862
Energy: 1.1892889999854526
Energy: 1.1764183692376313
Energy: 1.2249436568814671
Energy: 1.2275842157522918
Energy: 1.1363009510513886
Energy: 1.2577799279496227
Energy: 1.2676940378331893
Energy: 1.1774149233590594
Energy: 1.2304632245821037
Energy: 1.1467261328787974
Energy: 1.2228310265971158
Energy: 1.1341671437760732
Energy: 1.2585034829815749
Energy: 1.3138050069832192
Energy: 1.257574794449993
Energy: 1.324993460613615
Energy: 1.33032136888847
Energy: 1.2435215923195784
Energy: 1.4077998583573432
Energy: 1.3283831164045536
Energy: 1.3150729968248211
Energy: 1.2030898915391743
Energy: 1.2459441614282678
Energy: 1.2136430376816458
Energy: 1.1404545883501744
Energy: 1.224815897287454
Energy: 1.1469296781982556
Energy: 1.3175388358387474
Energy: 1.3086650599678336
Energy: 1.4031269093813794
Energy: 1.2261830284643542
Energy: 1.160420160725449
Energy: 1.3164294147903708
Energy: 1.2852618222721872
Energy: 1.3428248842949435
Energy: 1.1602398266742238
Energy: 1.153379047831836
Energy: 1.1932308916413745
Energy: 1.175025680189272
Energy: 1.1392153376257645
Energy: 1.221559582019547
Energy: 1.1606538940983593
Energy: 1.3070213365795842
Energy: 1.1460545413551408
Energy: 1.241352547804861
Energy: 1.2467200628942505
Energy: 1.1627677215643348
Energy: 1.3499658405669543
Energy: 1.2828872395974271
Energy: 1.243443678004638
Energy: 1.3691358045809139
Energy: 1.154001235932939
Energy: 1.3387333653356337
Energy: 1.3629993403335454
Energy: 1.1363443674736466
Energy: 1.2741384510434073
Energy: 1.1880723563156674
Energy: 1.224922658251777
Energy: 1.17746771908546
Energy: 1.1537909128947015
Energy: 1.2673907596235299
Energy: 1.2322407232766721
Energy: 1.215221344992803
Energy: 1.1972805351372964
Energy: 1.249202414554677
Energy: 1.1739433539492103
Energy: 1.3165700059846217
Energy: 1.2223647915402434
Energy: 1.200778935490434
Energy: 1.1483042647410282
Energy: 1.2472594485839656
Energy: 1.3236247798715457
Energy: 1.2337162417084118
Energy: 1.3055259733316908
Energy: 1.3378265633763404
Energy: 1.3415012358676404
Energy: 1.2286074133573563
Energy: 1.1892716679505098
Energy: 1.2340362522355957
Energy: 1.1579078942461936
Energy: 1.2043475394850667
Energy: 1.2715175381880974
Energy: 1.1513175059196612
Energy: 1.2941863333568202
Energy: 1.163221158553456
Energy: 1.2412232595217114
Energy: 1.2546691524570623
Energy: 1.2104708588200166
Energy: 1.2560165832309071
Energy: 1.1959635353076115
Energy: 1.1796227881828154
Energy: 1.168167420966052
Energy: 1.3836795682952443
Energy: 1.2556025997777769
Energy: 1.2918216600061487
Energy: 1.4566663612061395
Energy: 1.2469395161796797
Energy: 1.2129758475269692
Energy: 1.1859166260489822
Energy: 1.2499239064910295
Energy: 1.264963735968937
Energy: 1.2886843706692215
Energy: 1.1984534135646807
Energy: 1.1607804623945264
Energy: 1.3848531709693028
Energy: 1.2110173079291666
Energy: 1.2259372185958186
Energy: 1.1924336377803062
Energy: 1.1785169219616498
Energy: 1.2083680280556197
Energy: 1.196870266675529
Energy: 1.248674587543395
Energy: 1.187503116786191
Energy: 1.3090115777165021
Energy: 1.1580143472894384
Energy: 1.151729468824827
Energy: 1.3255315006936175
Energy: 1.1513935056237852
Energy: 1.1353829566993516
Energy: 1.2710639411978866
Energy: 1.1500552882750465
Energy: 1.23181869707733
Energy: 1.163746750872599
Energy: 1.1629370640127934
Energy: 1.2955931490766726
Energy: 1.2829493881234957
Energy: 1.1589981908711884
Energy: 1.234647782031042
Energy: 1.1526634059461691
Energy: 1.1311800389569844
Energy: 1.203666594875419
Energy: 1.2590952260937402
Energy: 1.314125868462744
Energy: 1.2975212243826038
Energy: 1.4202272036018337
Energy: 1.1468605175472082
Energy: 1.3750752229717516
Energy: 1.2239982196565113
Energy: 1.1971602357669555
Energy: 1.2073412113942816
Energy: 1.2028872644498114
Energy: 1.2498085698093169
Energy: 1.2016248577807092
Energy: 1.1538350546601712
Energy: 1.1588382411626468
Energy: 1.2626336285727495
Energy: 1.3135799168319118
Energy: 1.3685122309304465
Energy: 1.5218385225776176
Energy: 1.3306570915862503
Energy: 1.2425104407247363
Energy: 1.408140653535859
Energy: 1.3635256197679866
Energy: 1.3008959559785247
Energy: 1.18871783446754
Energy: 1.173925550761937
Energy: 1.1641999797125564
Energy: 1.2283492482541714
Energy: 1.1344253662541584
Energy: 1.1502378972954799
Energy: 1.3694790282247804
Energy: 1.1925021891231575
Energy: 1.1737264678597548
Energy: 1.145491745492713
Energy: 1.2277126477184868
Energy: 1.1360997827097399
Energy: 1.2572329414858543
Energy: 1.3137781807575302
Energy: 1.2878093363750804
Energy: 1.3388252392281432
Energy: 1.2599781925143732
Energy: 1.2090970318254826
Energy: 1.4072600016447099
Energy: 1.2305607188475332

minimum gb energy = 1.1311800389569844 eV
minimum distance =  2.57286875129896 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.2440327190810971
Energy: 1.49942116498796
Energy: 1.0577292448323463
Energy: 1.0576315056066101
Energy: 1.0579042623621258
Energy: 1.0581060842009753
Energy: 1.0572396633666272
Energy: 1.0568391504336712
Energy: 1.2700091461354792
Energy: 1.0564905323071045
Energy: 1.055774020729736
Energy: 1.05484410717102
Energy: 1.0560700553646503
Energy: 1.2703281188223259
Energy: 1.0557148299680326
Energy: 1.2715644350505582
Energy: 1.0556320242033848
Energy: 1.0560241651446913
Energy: 1.0558310280381105
Energy: 1.0553875308864284
Energy: 1.056260513989701
Energy: 1.2465719945671205
Energy: 1.2709111561312325
Energy: 1.0565770972976227
Energy: 1.0562226408720683
Energy: 1.0580819757033602
Energy: 1.055599901593603
Energy: 1.0578882566895895
Energy: 1.3269696839486516
Energy: 1.2685724772990608
Energy: 1.0673447083156216
Energy: 1.2714845518176343
Energy: 1.056418779268956
Energy: 1.0662100954227784
Energy: 1.2689614665546747
Energy: 1.2447577374260206
Energy: 1.2706019477062016
Energy: 1.0575898060589115
Energy: 1.0574011717564038
Energy: 1.0568959979163939
Energy: 1.0577831502057673
Energy: 1.0571075046695688
Energy: 1.132737009125781
Energy: 1.2705602214574387
Energy: 1.0556461724440342
Energy: 1.0556206146438214
Energy: 1.0555158605513475
Energy: 1.0553301310557477
Energy: 1.2709650124959297
Energy: 1.0557409246304492
Energy: 1.271357197143303
Energy: 1.0554338389533453
Energy: 1.0557989900324172
Energy: 1.0555920335232907
Energy: 1.0552804358399688
Energy: 1.2708083509432664
Energy: 1.2455616961108789
Energy: 1.2709936632576935
Energy: 1.0577605639824357
Energy: 1.056274376308557
Energy: 1.0573492176967119
Energy: 1.0559450931515986
Energy: 1.0575566910370167
Energy: 1.3268263350349947
Energy: 1.2700762907471743
Energy: 1.068159811813608
Energy: 1.2693239819530169
Energy: 1.269579431920437
Energy: 1.066831744726839
Energy: 1.2693511426729613
Energy: 1.2459493144981502
Energy: 1.270561015009999
Energy: 1.055331159046691
Energy: 1.0573975986737183
Energy: 1.0561766759147346
Energy: 1.056344164529673
Energy: 1.0570845151382366
Energy: 1.0555098635391094
Energy: 1.2699111484014278
Energy: 1.0552319349008163
Energy: 1.0555337397702556
Energy: 1.0554585200279978
Energy: 1.0554900213006593
Energy: 1.2708256597115615
Energy: 1.0551678021824646
Energy: 1.270982444315505
Energy: 1.0558860269234986
Energy: 1.0553063978056814
Energy: 1.055846022211458
Energy: 1.055140054264059
Energy: 1.2712206701796307
Energy: 1.2443216104059613
Energy: 1.2704930480598111
Energy: 1.0575196899937893
Energy: 1.0574180390243575
Energy: 1.0577753916021047
Energy: 1.058126639699329
Energy: 1.057174258018748
Energy: 1.3270648049254306
Energy: 1.2689441548650755
Energy: 1.0663207568404054
Energy: 1.0549614083051289
Energy: 1.0555244602493936
Energy: 1.056569947430792
Energy: 1.2691179353726207
Energy: 1.2469455409703392
Energy: 1.2703643781457787
Energy: 1.055443895104232
Energy: 1.0582135507901593
Energy: 1.0557266851589622
Energy: 1.0553712816405385
Energy: 1.056259953122435
Energy: 1.2465842428846607
Energy: 1.2701549221799688
Energy: 1.0552900982798654
Energy: 1.0556058349694313
Energy: 1.058423407738431
Energy: 1.055632685483139
Energy: 1.0561174513398384
Energy: 1.3271738155947208
Energy: 1.2705443262081038
Energy: 1.057119190728008
Energy: 1.0549682213420533
Energy: 1.0548326177580936
Energy: 1.056553704066815
Energy: 1.2689135139593506
Energy: 1.2441676345334594
Energy: 1.2694204052232487
Energy: 1.0573669408249897
Energy: 1.0576067841329515
Energy: 1.0579561654158156
Energy: 1.057993665814046
Energy: 1.0569883253817405
Energy: 1.1305422706289736
Energy: 1.2706751070948255
Energy: 1.0560335041276738
Energy: 1.0557972835142866
Energy: 1.0549426380061195
Energy: 1.055629280914408
Energy: 1.2713268578306298

minimum gb energy = 1.0548326177580936 eV
minimum distance =  2.71023185967461 Angstroms
sigma value = 23