Model name: model_name=MEAM_LAMMPS_KimShinLee_2009_FeMn__MO_058735400462_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.863657340407371
cohesive_energy=4.290337440834252
mass=55.845
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=[0.0, 2.4558483881278797e-19, 2.90855941783092e-19, 3.2776528490055e-19, 3.5962136291437197e-19, 4.79688479866332e-19, 5.086766617052939e-19, 5.34122431006482e-19, 5.56616990947842e-19, 5.765528748047039e-19, 5.94229689607626e-19, 6.09886159675074e-19, 6.23712944026494e-19, 6.35868658148652e-19, 6.4648628270216995e-19, 6.55679572228062e-19, 6.63543055147734e-19, 6.70161646822788e-19, 6.756106495550219e-19, 6.799525482331619e-19, 6.83246623392666e-19, 6.85544144685822e-19, 6.8689317741165e-19, 6.87333775986e-19, 6.868579295257019e-19, 6.85311829073892e-19, 6.82496804727954e-19, 6.78172529992788e-19, 6.7204901089764e-19, 6.63780177289566e-19, 6.52939850183922e-19, 6.39015333057828e-19, 6.213721639642199e-19, 5.992284807057059e-19, 5.716085577121799e-19, 5.37293138565168e-19, 4.94750542402566e-19, 4.4202451155426e-19, 3.7653714381614393e-19, 2.95007181441786e-19, 1.9309593010631396e-19, 6.49823616630792e-20, -9.72234427220514e-20, -3.0442157134317e-19, -5.71948219158588e-19, -9.21913263499842e-19, -1.3869658598145839e-18, -2.01685199041188e-18, -2.8901183647735795e-18, -4.13624328539976e-18, -5.9802043952366996e-18, -8.83983333866526e-18, -1.3560662812512598e-17, -2.2064695950457802e-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: 0.016148349650898206
Energy: 0.016719433063125327
Energy: 1.2911562264569498
Energy: 0.01681457410037715
Energy: 0.016616402243575926
Energy: 1.3808200685636627
Energy: 0.01646069609285059
Energy: 0.016804558441824605
Energy: 0.21667482723061288
Energy: 0.17502411620056596
Energy: 0.17524108823537976
Energy: 0.3553721887195476
Energy: 0.21630711594312532
Energy: 0.1754446134528416
Energy: 0.17560582413230105
Energy: 0.21607057228177842
Energy: 0.17507318619563722
Energy: 0.17572234103942586
Energy: 0.17547503225525446
Energy: 0.21635948557938145
Energy: 0.1753293562362584
Energy: 0.17604841258316167
Energy: 0.21603762338957333
Energy: 0.21728077191947504
Energy: 0.1752760725844795
Energy: 0.17629849495633146
Energy: 0.216662723830282
Energy: 0.175445714024629
Energy: 0.17542671237851834
Energy: 0.21654348035715723
Energy: 0.17513826331030305
Energy: 0.17577943449717934
Energy: 0.17536815304104578
Energy: 0.21600336450843435
Energy: 0.17534588635113516
Energy: 0.016656996348504725
Energy: 0.215902046517896
Energy: 0.17514972986451588
Energy: 0.017034252872866265
Energy: 0.01713429891314565
Energy: 0.2165342505684339
Energy: 0.17531841326755337

minimum gb energy = 0.016148349650898206 eV
minimum distance =  2.44980378737888 Angstroms
sigma value = 5


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

Energy: 2.5230062564779154
Energy: 1.3805112834006696
Energy: 1.5914942679494994
Energy: 1.3219294125198096
Energy: 2.318676443900686
Energy: 1.6949646054117644
Energy: 1.38647800029849
Energy: 1.3224463616012074
Energy: 1.2999701711235025
Energy: 1.3470759851223923
Energy: 1.3352082600105624
Energy: 1.2778007139232583
Energy: 1.3412559741011267
Energy: 1.2810897031040014
Energy: 1.2285216262022332
Energy: 1.260829102384942
Energy: 1.2697200814688998
Energy: 1.2358922764999958
Energy: 1.2633849479691825
Energy: 1.2791233141748906
Energy: 1.241108788615499
Energy: 1.2306666470325929
Energy: 1.2859453511406795
Energy: 1.268618726438843
Energy: 1.2811063307983817
Energy: 1.257421823230081
Energy: 1.2726126002530118
Energy: 1.2621779081678752
Energy: 1.25286359891881
Energy: 1.2621388136687515
Energy: 1.2506772960450279
Energy: 1.2431813242560594
Energy: 1.277351036409401
Energy: 1.2796524834960803
Energy: 1.244768102976616
Energy: 1.2715220897331714
Energy: 1.238670839015931
Energy: 1.2349171248772852
Energy: 1.2914769010816316
Energy: 1.2849119005630012
Energy: 1.2344175770269583
Energy: 1.249901815778736
Energy: 1.2699416468396358
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Energy: 1.2367381530063262
Energy: 1.2762368989531099
Energy: 1.2464202227759593
Energy: 1.227609346076313
Energy: 1.2379279964788092
Energy: 1.2997334307732387
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Energy: 1.2975367512054112
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Energy: 1.2293790111643395
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Energy: 1.2211126557528234
Energy: 1.175253274230812
Energy: 1.2157657940028206
Energy: 1.2337347099744824
Energy: 1.1750369941314989
Energy: 1.259900208841202
Energy: 1.2704137057503035
Energy: 1.3134768117002094
Energy: 1.3200271620505888
Energy: 1.2866042058267524
Energy: 1.3064569694576789
Energy: 1.3076968532605893
Energy: 1.2938488017592407
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Energy: 1.3835643284916495
Energy: 1.2843901720267665
Energy: 1.2851671503949997
Energy: 1.3174932733789952
Energy: 1.3023571574933674
Energy: 1.3127739692028135
Energy: 1.2583471687788117
Energy: 1.297462362026316
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Energy: 1.292502321436206
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Energy: 1.318911786078456
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Energy: 1.305804495141873
Energy: 1.3206549746086995
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Energy: 1.2960609880285894
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Energy: 1.3077485562452071
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Energy: 1.3439646575127082
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Energy: 1.2976969453474712
Energy: 1.3059621535475672
Energy: 1.3115758799890325
Energy: 1.3482301086804411
Energy: 1.3110770993107899
Energy: 1.3104677963035856
Energy: 1.2749495706843592
Energy: 1.2914438640557069
Energy: 1.362468404367125
Energy: 1.2066278416661693
Energy: 1.2190853195846723
Energy: 1.2337597782237775
Energy: 1.2924688927530918
Energy: 1.2170397132673219
Energy: 1.2526516055821384
Energy: 1.2728588058546024
Energy: 1.183276135497478
Energy: 1.1992590144931756
Energy: 1.2167319597808886
Energy: 1.2114991327003013
Energy: 1.2028784149002596
Energy: 1.2370326467641535
Energy: 1.1952164751991272
Energy: 1.2002228017065233
Energy: 1.2083807096851693
Energy: 1.2289036469318735
Energy: 1.2185729091782853
Energy: 1.2155276124955592
Energy: 1.2259507345664236
Energy: 1.2090049867708093
Energy: 1.2497893411009948
Energy: 1.2787006858490086
Energy: 1.3244876289861334
Energy: 1.316072922323758
Energy: 1.2930988841732183
Energy: 1.357954295784102
Energy: 1.2901960367657601
Energy: 1.231473551964211
Energy: 1.2927956568373522
Energy: 1.2542797602136633
Energy: 1.2447244472650054
Energy: 1.2463469787991106
Energy: 1.3619879738900509
Energy: 1.2368158735151187
Energy: 1.2254671912068147
Energy: 1.3036937065305776
Energy: 1.267982653145011
Energy: 1.2302727762495205
Energy: 1.247459743613921
Energy: 1.3359711328186126
Energy: 1.2342445137688585
Energy: 1.3315774654069357
Energy: 1.2728889203119398
Energy: 1.3653835601574096
Energy: 1.2769725564488172
Energy: 1.3018190086273562
Energy: 1.3515623186459895
Energy: 1.2778514281648627
Energy: 1.2845295608609189
Energy: 1.325349248584745
Energy: 1.3943223474593671
Energy: 1.2643269738026033
Energy: 1.2629234946092636
Energy: 1.3541051877610624
Energy: 1.2991315649741724

minimum gb energy = 1.1629992803247269 eV
minimum distance =  2.31343910816114 Angstroms
sigma value = 401


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

Energy: 2.1826424032510494
Energy: 1.274420981651157
Energy: 1.6209708253059436
Energy: 2.0573458388998116
Energy: 2.0600350493872024
Energy: 2.026725096525717
Energy: 1.3547750178799598
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Energy: 1.2811780289991532
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Energy: 1.379994091116583
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Energy: 1.3283001434873314
Energy: 1.170670627041763
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Energy: 1.4962708502565536
Energy: 1.2964959504235358
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Energy: 1.1741492861194582
Energy: 1.293190064326656
Energy: 1.2568158636182964
Energy: 1.3606319994767044
Energy: 1.267114495360361
Energy: 1.3470726274672238
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Energy: 1.4297568290675668
Energy: 1.2495921683522924
Energy: 1.328628557786321
Energy: 1.2688642614198182
Energy: 1.322332337254263
Energy: 1.2439211326935269
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Energy: 1.4209612102638143
Energy: 1.3335032209466273
Energy: 1.3953306065641482
Energy: 1.3560424899007548
Energy: 1.2646713516309642
Energy: 1.2596101873303276
Energy: 1.3403422115256867
Energy: 1.424166754668231
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Energy: 1.3622480668950043
Energy: 1.3507013169440631
Energy: 1.2550480554166936
Energy: 1.337922431797502
Energy: 1.3539467618024594
Energy: 1.4692454541219466
Energy: 1.3818338244343524
Energy: 1.364454325945996
Energy: 1.4342093643054201
Energy: 1.4810224375036136
Energy: 1.3931839986633998
Energy: 1.3421079389626522
Energy: 1.4981085735582402
Energy: 1.352746924881215
Energy: 1.3469468883109927
Energy: 1.3688798781995002
Energy: 1.3527771097412638
Energy: 1.3476749402667245
Energy: 1.3529507597808563
Energy: 1.3258594624816014
Energy: 1.336904833450069
Energy: 1.2846305351201572
Energy: 1.4215261317474512
Energy: 1.3504903201359961
Energy: 1.4106959148246867
Energy: 1.3696208633745337
Energy: 1.5534171672250268
Energy: 1.4139784386128258
Energy: 1.300535782913212
Energy: 1.387248541983251
Energy: 1.4749460482987782
Energy: 1.3246578763712809
Energy: 1.6812993728410797
Energy: 1.423287682751706
Energy: 1.3623848523499607
Energy: 1.5468751567587242
Energy: 1.4871296120232331
Energy: 1.35867440793066
Energy: 1.4092581538326592
Energy: 1.2943662339065982
Energy: 1.5545798795234722
Energy: 1.4680287450114626
Energy: 1.330015329083759
Energy: 1.4095997903599107
Energy: 1.520641115490578
Energy: 1.268824036652543
Energy: 1.3212517830014305
Energy: 1.7821286235531946
Energy: 1.7239222944099406
Energy: 1.3558363364228652
Energy: 1.5180691163888362
Energy: 1.5577920996240544
Energy: 1.4024210519747913
Energy: 1.3974276755951018
Energy: 1.3508663415014694
Energy: 1.438799776710398
Energy: 1.3232192133441494
Energy: 1.3736725669424128
Energy: 1.403339388928914
Energy: 1.3863840801090233
Energy: 1.3477609312242538
Energy: 1.3262227567859615
Energy: 1.3137474481519018
Energy: 1.3188984844435419
Energy: 1.3005007129768662
Energy: 1.2531612608663927
Energy: 1.338566806297192
Energy: 1.308341528843877
Energy: 1.349194446731411
Energy: 1.3330601966266185
Energy: 1.311458636559817
Energy: 1.312815960483527
Energy: 1.3444909012843946
Energy: 1.356948359548088
Energy: 1.3361350428504137
Energy: 1.3197617990076538
Energy: 1.3641468959497107
Energy: 1.4020946483020655
Energy: 1.3151560709587444
Energy: 1.2560811791416229
Energy: 1.32369437577062
Energy: 1.3289366093536483
Energy: 1.330414916329771
Energy: 1.2929006827876963
Energy: 1.463482820118841
Energy: 1.278299484442681
Energy: 1.2764711123539474
Energy: 1.5312676867674462
Energy: 1.2833137040233693
Energy: 1.353160624754801
Energy: 1.230640363161081
Energy: 1.2964338947296383
Energy: 1.2313333872990524
Energy: 1.5183213314422337
Energy: 1.629918629707815
Energy: 1.441594604305192
Energy: 1.3595135828420288
Energy: 1.3224302634129226
Energy: 1.3229033028125656
Energy: 1.243305526846942
Energy: 1.226680287425416
Energy: 1.3975733042359364
Energy: 1.2302064645346735
Energy: 1.26729480640399
Energy: 1.2466708922558047
Energy: 1.3358764792132036
Energy: 1.1923519849089308
Energy: 1.1697158092893574
Energy: 1.2837783457817424
Energy: 1.2844315167114808

minimum gb energy = 1.1661434719139623 eV
minimum distance =  2.26989125059594 Angstroms
sigma value = 311


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

Energy: 1.5774505522042206
Energy: 1.5116292487155412
Energy: 1.482882799993938
Energy: 1.626137757590249
Energy: 1.6610015498046782
Energy: 1.4784376049992056
Energy: 1.4466954634067999
Energy: 1.4013241925981124
Energy: 1.343735362286796
Energy: 1.2697875566689218
Energy: 1.26827707351836
Energy: 1.3489938191908273
Energy: 1.2575220032588714
Energy: 1.246449363637256
Energy: 1.2510487609668464
Energy: 1.3262860418736773
Energy: 1.2266956744067257
Energy: 1.25159576089928
Energy: 1.3275151117634043
Energy: 1.2628474412698598
Energy: 1.2284015878685686
Energy: 1.3250283078657563
Energy: 1.3722600193440313
Energy: 1.279538159853155
Energy: 1.30063784561086
Energy: 1.3701719538972978
Energy: 1.2061749698538489
Energy: 1.347354925554854
Energy: 1.2941463805589322
Energy: 1.295714203208533
Energy: 1.2381396392952693
Energy: 1.2374932881242506
Energy: 1.3031493610410527
Energy: 1.2706622574358437
Energy: 1.2386466327937469
Energy: 1.3900253351749163
Energy: 1.378140134640313
Energy: 1.3446700226706716
Energy: 1.401201688867472
Energy: 1.3907035986135534
Energy: 1.3800168970384927
Energy: 1.349068533426391
Energy: 1.3992724493246436
Energy: 1.3829803845126234
Energy: 1.4009629799736247
Energy: 1.3780936553540561
Energy: 1.3872290928840207
Energy: 1.3824705187398227
Energy: 1.400929450474603
Energy: 1.3621906765895822
Energy: 1.32283631414761
Energy: 1.3148882149046455
Energy: 1.2929750662643975
Energy: 1.2739840739420791
Energy: 1.314021534383136
Energy: 1.2930004712966683
Energy: 1.2735640380784627
Energy: 1.2345073230643158
Energy: 1.2904826011518686
Energy: 1.276424659018867
Energy: 1.2650796092979197
Energy: 1.310032859873432
Energy: 1.284855390750866
Energy: 1.285734475811756
Energy: 1.3234834041018328
Energy: 1.292048592678989
Energy: 1.364679417701304
Energy: 1.2708861316621531
Energy: 1.3141545910126717
Energy: 1.2640599200107816
Energy: 1.278498366716707
Energy: 1.2694645500138384
Energy: 1.2715207774765636
Energy: 1.2846095068179857
Energy: 1.2487071183873006
Energy: 1.2663850446513083
Energy: 1.272297718001188
Energy: 1.4727770827179905
Energy: 1.4432134845017286
Energy: 1.3765710406582619
Energy: 1.4592441560931553
Energy: 1.4119819593885583
Energy: 1.3267579082872187
Energy: 1.4327908523228754
Energy: 1.4489371651135714
Energy: 1.395891218634035
Energy: 1.454512213038042
Energy: 1.4476061097229065
Energy: 1.445616752746416
Energy: 1.3491482550573435
Energy: 1.4432901079099998
Energy: 1.3789168235244886
Energy: 1.3019715804015732
Energy: 1.2676388914486638
Energy: 1.3396964195292906
Energy: 1.3234359551126877
Energy: 1.2771832031001475
Energy: 1.3754195659123714
Energy: 1.2681509230017654
Energy: 1.2503835685223814
Energy: 1.2779279820846237
Energy: 1.2701857942676964
Energy: 1.240291221277536
Energy: 1.2843581946693123
Energy: 1.3280136053978304
Energy: 1.34577950299925
Energy: 1.249784482194999
Energy: 1.2521597784043994
Energy: 1.328181553945412
Energy: 1.3798165169851715
Energy: 1.2879728415482006
Energy: 1.233493575280671
Energy: 1.3068639896692371
Energy: 1.2363652945793262
Energy: 1.3028005862641814
Energy: 1.2660881436901752
Energy: 1.2594424662505586
Energy: 1.3098044870317078
Energy: 1.295403474965359
Energy: 1.40565598093422
Energy: 1.3801645122589035
Energy: 1.3707257828087258
Energy: 1.3811142867421526
Energy: 1.410744681755524
Energy: 1.3715258792891036
Energy: 1.3648849999641826
Energy: 1.4085377352557271
Energy: 1.416487345500299
Energy: 1.3583154486613398
Energy: 1.3893977019087613
Energy: 1.4355878091536183
Energy: 1.3579454905385002
Energy: 1.34684115802487
Energy: 1.3005613742698652
Energy: 1.2614200834147344
Energy: 1.2502196832281292
Energy: 1.2505575437254661
Energy: 1.2733531255977586
Energy: 1.2636076523118336
Energy: 1.2447119536207611
Energy: 1.2532467907345464
Energy: 1.3478020350735573
Energy: 1.3226446784425858
Energy: 1.3164378252275157
Energy: 1.2665817769734995
Energy: 1.3097011745619946
Energy: 1.266307363052771
Energy: 1.2360452396569874
Energy: 1.265151961314295
Energy: 1.2559373698036935
Energy: 1.2334800192830289
Energy: 1.2921405896664604
Energy: 1.228706824529875
Energy: 1.2306664355465942
Energy: 1.335294231181932
Energy: 1.2746467772219345
Energy: 1.1961549663604736
Energy: 1.2328101046755253
Energy: 1.295804569151832
Energy: 1.2061543171802231
Energy: 1.2140268467265252
Energy: 1.396506753864936
Energy: 1.3989039308279867
Energy: 1.3660247795185074
Energy: 1.3621641716519268
Energy: 1.405465705119273
Energy: 1.365192373166394
Energy: 1.3724605233870202
Energy: 1.3667729633428742
Energy: 1.352718896232185
Energy: 1.366171887849324
Energy: 1.3647180265454115
Energy: 1.3587492179177418
Energy: 1.3627690724924852
Energy: 1.384588233674864
Energy: 1.2767802343736152
Energy: 1.2331006446191395
Energy: 1.2056084729534304
Energy: 1.3049988710994955
Energy: 1.2496059865767701
Energy: 1.2035747391782363
Energy: 1.2425785854872282
Energy: 1.235894954874606
Energy: 1.2360863639603827
Energy: 1.2205113830966212
Energy: 1.2412062882490877
Energy: 1.2405836320234582
Energy: 1.2294265880314856
Energy: 1.2421052562791048
Energy: 1.1446375845427208
Energy: 1.2915547507784846
Energy: 1.3058478123448338
Energy: 1.1661814274350975
Energy: 1.166995131242036
Energy: 1.3234943010924136
Energy: 1.5658010438466057
Energy: 1.3028106059464242
Energy: 1.2900621144551665
Energy: 1.2598990925464464
Energy: 1.2704313069267117
Energy: 1.266053313486767
Energy: 1.2592139653714096
Energy: 1.2801017380420585
Energy: 1.3645591422555572
Energy: 1.4119303626340358
Energy: 1.5014960304058391
Energy: 1.4656912118638186
Energy: 1.4554049135860558
Energy: 1.5079820800024668
Energy: 1.3983465939608655
Energy: 1.445654501105798
Energy: 1.384446412248665
Energy: 1.425534391230021
Energy: 1.4649784538532578
Energy: 1.3945546625893925
Energy: 1.4223541066169945
Energy: 1.4638238126724492
Energy: 1.3075912140417691
Energy: 1.2635793374476787
Energy: 1.2979443750860233
Energy: 1.2690455558599003
Energy: 1.2539157000516097
Energy: 1.2490103410432913
Energy: 1.310664807619425
Energy: 1.3662161085563436
Energy: 1.2300912671475066
Energy: 1.3100783150377602
Energy: 1.322002273643139
Energy: 1.4535587632902418
Energy: 1.3679872991331583
Energy: 1.4545623829409013
Energy: 1.2600549719894423
Energy: 1.2826236848897203
Energy: 1.2455534503178156
Energy: 1.264710544852113
Energy: 1.292023648003665
Energy: 1.2845906531070914
Energy: 1.2534233667478254
Energy: 1.3585008961652587
Energy: 1.4245471307549575
Energy: 1.3655723625770935
Energy: 1.3623247169161603
Energy: 1.3750715904422819
Energy: 1.253849315119972
Energy: 1.3665668364424812
Energy: 1.382090104722674
Energy: 1.4250847509956668
Energy: 1.4225083647249277
Energy: 1.3937677695324375
Energy: 1.430128907091925
Energy: 1.419673542146611
Energy: 1.3804947767339741

minimum gb energy = 1.1446375845427208 eV
minimum distance =  2.26986531206432 Angstroms
sigma value = 39


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

Energy: 1.6417754163287126
Energy: 1.4426048150308466
Energy: 1.469361639806132
Energy: 1.4743565899398738
Energy: 1.434774616197712
Energy: 1.4165905651502728
Energy: 1.3595629627916639
Energy: 1.2932150570377279
Energy: 1.203973138142713
Energy: 1.2321168406212863
Energy: 1.2929505036641236
Energy: 1.273383648553572
Energy: 1.2250837192295592
Energy: 1.2979009899737968
Energy: 1.2934122868274127
Energy: 1.225068531865606
Energy: 1.2480485362803428
Energy: 1.3195424588378255
Energy: 1.255765975554602
Energy: 1.2472794946488754
Energy: 1.343519242186582
Energy: 1.331452420256168
Energy: 1.1332296777167197
Energy: 1.2284807087207268
Energy: 1.3711856558153896
Energy: 1.1340088749079729
Energy: 1.1215027938986268
Energy: 1.286568175856503
Energy: 1.332464394382621
Energy: 1.232817480648078
Energy: 1.2422634623314766
Energy: 1.2524634361025306
Energy: 1.2437401937035262
Energy: 1.2419207342161196
Energy: 1.2493616737969888
Energy: 1.2931667341807576
Energy: 1.2135110209366562
Energy: 1.2276994432139705
Energy: 1.2864320128909872
Energy: 1.2543236845806742
Energy: 1.2129161580096413
Energy: 1.25728763169602
Energy: 1.3272959293050295
Energy: 1.2118898798370539
Energy: 1.2249274250151996
Energy: 1.3247674853290414
Energy: 1.2512992960291704
Energy: 1.217334371011741
Energy: 1.2392608401722107
Energy: 1.2891923864323924
Energy: 1.23605769769571
Energy: 1.2627614554692734
Energy: 1.28586371213019
Energy: 1.270914384580499
Energy: 1.2581485275917672
Energy: 1.3414407038224307
Energy: 1.315041649044334
Energy: 1.3243280087973024
Energy: 1.4544088612367838
Energy: 1.3281624126524625
Energy: 1.3095470840437673
Energy: 1.4250407858895493
Energy: 1.2818226538779285
Energy: 1.3113860469620702
Energy: 1.3442739987969385
Energy: 1.4136454756523171
Energy: 1.3646708794837257
Energy: 1.3082368429634774
Energy: 1.3636217208270673
Energy: 1.3860741395580078
Energy: 1.290874583593794
Energy: 1.2984665734424419
Energy: 1.2304823489432557
Energy: 1.3109711223095268
Energy: 1.283332792722624
Energy: 1.262924730838602
Energy: 1.3120719078631569
Energy: 1.3148787431894302
Energy: 1.2461121372415869
Energy: 1.2382671937883614
Energy: 1.3153041306527682
Energy: 1.2898866111052054
Energy: 1.23996950756525
Energy: 1.3106655772810962
Energy: 1.3313015361196388
Energy: 1.255211486008526
Energy: 1.4238595603305226
Energy: 1.3708841080115575
Energy: 1.279181213455773
Energy: 1.2480318334411211
Energy: 1.4633542765494043
Energy: 1.287651331588649
Energy: 1.2592544516647821
Energy: 1.2379877685606622
Energy: 1.3060147382455405
Energy: 1.2669339289764114
Energy: 1.2490628102085106
Energy: 1.3135677666527237
Energy: 1.2868946725632089
Energy: 1.3112934555545492
Energy: 1.2545475477062624
Energy: 1.3146331765613286
Energy: 1.3195781221420262
Energy: 1.3946513369323166
Energy: 1.3155104461308968
Energy: 1.36680367635292
Energy: 1.3819457662408359
Energy: 1.4264864704146085
Energy: 1.438491952968759
Energy: 1.3699933642814015
Energy: 1.3640172972079447
Energy: 1.361350002361405
Energy: 1.2836262137694499
Energy: 1.2026756784746777
Energy: 1.2322063202860722
Energy: 1.3078501304476147
Energy: 1.2735878975340484
Energy: 1.2246961561521184
Energy: 1.3043729494271765
Energy: 1.2960696078809222
Energy: 1.212240776109087
Energy: 1.2474305847461995
Energy: 1.3010584539290286
Energy: 1.2980091334346793
Energy: 1.246647745727913
Energy: 1.3497952435092393
Energy: 1.345668880888345
Energy: 1.1311871677222578
Energy: 1.2345459854902523
Energy: 1.3083234707115012
Energy: 1.1669933427339259
Energy: 1.1216197624358217
Energy: 1.3154870983550189
Energy: 1.336012253872894
Energy: 1.233989342492484
Energy: 1.2348418052414327
Energy: 1.2550569447390973
Energy: 1.2373669994871888
Energy: 1.2541520407999867
Energy: 1.248861872603633
Energy: 1.2858966822650926
Energy: 1.2137708718291846
Energy: 1.2282275532752678
Energy: 1.2596273615987272
Energy: 1.2551049550556401
Energy: 1.2131583946455544
Energy: 1.2643831863488413
Energy: 1.3040359730338913
Energy: 1.2156436556874108
Energy: 1.2249674762507816
Energy: 1.3248065374656384
Energy: 1.2484394613193686
Energy: 1.2160852906690065
Energy: 1.241676676870564
Energy: 1.289123308772252
Energy: 1.2363710326463624
Energy: 1.2578028449647898
Energy: 1.2843169769200955
Energy: 1.2701008443811161
Energy: 1.2581293696210223
Energy: 1.3415631339707534
Energy: 1.311826029662469
Energy: 1.324097787364221
Energy: 1.4534189227720435
Energy: 1.3265002923388312
Energy: 1.3095340582845199
Energy: 1.4175775476351973
Energy: 1.3246165041672902
Energy: 1.312112171117529
Energy: 1.3322959149218592
Energy: 1.3551640523238404
Energy: 1.370814300358869
Energy: 1.3082642611870845
Energy: 1.4490577010983519
Energy: 1.4177922927110997
Energy: 1.2814077475246732
Energy: 1.3192204516178527
Energy: 1.2303570642350214
Energy: 1.3107678245756806
Energy: 1.2822434136588265
Energy: 1.2505169669117933
Energy: 1.299082861560606
Energy: 1.3139047838982325
Energy: 1.238453552962628
Energy: 1.2454288627174317
Energy: 1.2943906260112796
Energy: 1.306718827926339
Energy: 1.2400947960592001
Energy: 1.315969871516154
Energy: 1.3298899505963924
Energy: 1.255484764755352
Energy: 1.4267383870592403
Energy: 1.3721707536724081
Energy: 1.2449918570374108
Energy: 1.2255280676959994
Energy: 1.4604687187503884
Energy: 1.292245765837184
Energy: 1.2295829910058824
Energy: 1.2499413828978578
Energy: 1.3057521260258547
Energy: 1.277221562478863
Energy: 1.2485633038553898
Energy: 1.3131302362535664
Energy: 1.2790989104128774
Energy: 1.3107834913565815
Energy: 1.2561557406873245
Energy: 1.3171949458283982
Energy: 1.312306707394361
Energy: 1.4202770426069693
Energy: 1.3162475020440794

minimum gb energy = 1.1215027938986268 eV
minimum distance =  2.2332417678594 Angstroms
sigma value = 21


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

Energy: 1.8174246717537939
Energy: 1.3012594557894706
Energy: 1.4884169756424508
Energy: 1.308419765055616
Energy: 1.3624063347565167
Energy: 1.9797326968640991
Energy: 1.3626352804497839
Energy: 1.2504829592200826
Energy: 1.2217608654909506
Energy: 1.1600241781663334
Energy: 1.2766402654283675
Energy: 1.2311541308574077
Energy: 1.1245945148164207
Energy: 1.2866372829335282
Energy: 1.269377120173149
Energy: 1.120876845343196
Energy: 1.1733668350090325
Energy: 1.1877093651756818
Energy: 1.269865694397214
Energy: 1.1613124563798756
Energy: 1.1743162439576362
Energy: 1.2659840982341464
Energy: 1.076835766600733
Energy: 1.1042372099030557
Energy: 1.2465995545778383
Energy: 1.2154788972132085
Energy: 1.1039442363768552
Energy: 1.4264199818840047
Energy: 1.1046059844247933
Energy: 1.1198273357130242
Energy: 1.1732361190141931
Energy: 1.165697963717726
Energy: 1.1411102578797085
Energy: 1.0970496028680325
Energy: 1.1547560394585485
Energy: 1.1400194296159332
Energy: 1.2044377176837358
Energy: 1.160806572206448
Energy: 1.1214158424186427
Energy: 1.2016562848404544
Energy: 1.1238730790349922
Energy: 1.172932748191748
Energy: 1.140139838856694
Energy: 1.1077637108287868
Energy: 1.0500052886171494
Energy: 1.1125263082304906
Energy: 1.0705327948412946
Energy: 1.146546467429607
Energy: 1.122197349302902
Energy: 1.0773285277361104
Energy: 1.0485592708848874
Energy: 1.0898137864808757
Energy: 1.0700091670976954
Energy: 1.0437032369822148
Energy: 1.143272207643731
Energy: 1.0966902230874558
Energy: 1.0824440385029428
Energy: 1.056089396751918
Energy: 1.1177962653177687
Energy: 1.087287073043993
Energy: 1.0807812314449308
Energy: 1.169060836451658
Energy: 1.1373618092197215
Energy: 1.0341917608117988
Energy: 1.0186752870591715
Energy: 1.089124329512747
Energy: 1.035665777611161
Energy: 1.0186618858182805
Energy: 1.0320120616869932
Energy: 1.0835140112345918
Energy: 1.0629357885256887
Energy: 1.054539649651517
Energy: 1.0911522598750387
Energy: 1.1130326089101013
Energy: 1.060149130059025
Energy: 1.1046391451317998
Energy: 1.1119461484069575
Energy: 1.1031703484424507
Energy: 1.0682000140363705
Energy: 1.1032544336072352
Energy: 1.0947185729583253
Energy: 1.0818593566272114
Energy: 1.107628398082477
Energy: 1.1087897757355043
Energy: 1.0413865842394787
Energy: 1.0319631226772779
Energy: 1.0233855282025233
Energy: 1.0955074051837568
Energy: 1.1521916940465702
Energy: 1.0265446895169386
Energy: 1.0364362595449077
Energy: 1.0899318909792426
Energy: 1.1636585230724994
Energy: 1.0733244172464536
Energy: 1.1281219075077122
Energy: 1.1914654027978686
Energy: 1.073545721268548
Energy: 1.067271481287201
Energy: 1.114949187970659
Energy: 1.152227073011397
Energy: 1.0732034567379694
Energy: 1.0917253442386383
Energy: 1.1651628626670705
Energy: 1.0474590327066449
Energy: 1.0891055144030044
Energy: 1.172002898524901
Energy: 1.1701203208298132
Energy: 1.1693455973085407
Energy: 1.1187650344992004
Energy: 1.1057318338297402
Energy: 1.2160833375183147
Energy: 1.1197024381075638
Energy: 1.163371236226465
Energy: 1.1133942867338449
Energy: 1.0701311175534094
Energy: 1.1407490305947483
Energy: 1.1950284215100677
Energy: 1.1734186030191651
Energy: 1.1177228603320688
Energy: 1.17523040998569
Energy: 1.124435516672951
Energy: 1.1891667495946578
Energy: 1.1926803821701415
Energy: 1.1746079337633926
Energy: 1.1179439672110227
Energy: 1.2219402955074439
Energy: 1.2245825064101306
Energy: 1.0994511027474452
Energy: 1.1612588674093618
Energy: 1.1627156213789511
Energy: 1.1020909853512406
Energy: 1.132152254375984
Energy: 1.226681429486356
Energy: 1.1754631405007028
Energy: 1.171933552511727
Energy: 1.2240008112793355
Energy: 1.1607441794362592
Energy: 1.1593600013922916
Energy: 1.1284131486631235
Energy: 1.2854361109047248
Energy: 1.2473498374364198
Energy: 1.1689301360087818
Energy: 1.24581898335278
Energy: 1.2773757756636508
Energy: 1.17427894326675
Energy: 1.1618749853321888
Energy: 1.2914942397256381
Energy: 1.2482516385292812
Energy: 1.1025057024378164
Energy: 1.2819772940543195
Energy: 1.241726328658281
Energy: 1.0806042987164566
Energy: 1.187618868977261
Energy: 1.2418884198777627
Energy: 1.270689076611709
Energy: 1.1075059642495366
Energy: 1.2965845421204905
Energy: 1.2407731225153609
Energy: 1.2384757183101653
Energy: 1.159633301110819
Energy: 1.2768236967816486
Energy: 1.2651936239220507
Energy: 1.2307356481955047
Energy: 1.1760135240437328
Energy: 1.2701094233992032
Energy: 1.1758056312599536
Energy: 1.1984369366483805
Energy: 1.271938302015762
Energy: 1.2533721717224189
Energy: 1.2205830669842377
Energy: 1.2029084668315768
Energy: 1.2560644992584318
Energy: 1.255242909328752
Energy: 1.1979637063879693
Energy: 1.3039712418194276

minimum gb energy = 1.0186618858182805 eV
minimum distance =  2.29963956385458 Angstroms
sigma value = 113


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

Energy: 1.9219077370427913
Energy: 1.979759661642813
Energy: 1.2619625179223852
Energy: 1.2347797655862227
Energy: 1.2454383836812992
Energy: 1.1166318041786678
Energy: 1.0449211234081794
Energy: 1.1349064091185177
Energy: 1.0392225935449944
Energy: 1.103682771715255
Energy: 1.1812060007157974
Energy: 1.1063578531991467
Energy: 1.0512218927295087
Energy: 1.1233406029188648
Energy: 1.071985885184744
Energy: 1.0478317167201925
Energy: 1.0699102412278305
Energy: 1.3085617157033755
Energy: 1.0359380107258105
Energy: 1.089903470011298
Energy: 1.0571792390977097
Energy: 1.0776908316537377
Energy: 1.0455638184183742
Energy: 1.0426663708072004
Energy: 0.9829890085261122
Energy: 1.0154454596687719
Energy: 1.03808723639018
Energy: 1.06873759559634
Energy: 0.9810683082746674
Energy: 1.0608061670071265
Energy: 1.01248478934215
Energy: 1.076954188714851
Energy: 1.0185024730560035
Energy: 1.1819347434751626
Energy: 1.0640226371536383
Energy: 0.9967741114690842
Energy: 1.041138368899315
Energy: 1.0040541121749655
Energy: 1.0426393904668914
Energy: 1.0066700419195664
Energy: 1.0323335863463816
Energy: 1.010696990881493
Energy: 1.0388893733485056
Energy: 1.1346873582629058
Energy: 1.006229916614914
Energy: 1.0183701743750533
Energy: 1.004597602380537
Energy: 1.030147437906182
Energy: 1.0347225388519574
Energy: 1.007549606727172
Energy: 1.1084899644888535
Energy: 1.0797983318288014
Energy: 0.9809423291151776
Energy: 1.0069021742539044
Energy: 1.0439026456423728
Energy: 0.9901299704784507
Energy: 0.9979495002474165
Energy: 1.0240903873918945
Energy: 0.9925038527787666
Energy: 1.0276356080610247
Energy: 1.014756231201121
Energy: 1.055575692194847
Energy: 0.9900731014446704
Energy: 0.9452387360467454
Energy: 0.9750532839469146
Energy: 0.9689979725735088
Energy: 0.988227099206407
Energy: 0.9689088957529188
Energy: 1.0038398590192767
Energy: 0.9901022222468238
Energy: 0.9825643152616553
Energy: 0.998240237799351
Energy: 0.9760186872177992
Energy: 0.9822163573346079
Energy: 0.9760927292919572
Energy: 0.9520528928995926
Energy: 0.9943372413252559
Energy: 0.9920222230149042
Energy: 0.9505747017716689
Energy: 0.9663762243450178
Energy: 0.9802086684465294
Energy: 1.00034027743153
Energy: 0.9746587946899995
Energy: 0.9944636573127883
Energy: 1.0381723436047892
Energy: 0.9431729628531746
Energy: 0.9236731880572544
Energy: 0.9423987052996521
Energy: 1.0243699673205142
Energy: 0.9264861564087394
Energy: 0.9316071903622317
Energy: 0.9716859415528207
Energy: 0.9280887511541853
Energy: 0.9392255136392607
Energy: 0.973571067061595
Energy: 1.0336543976164896
Energy: 0.9215637042717512
Energy: 0.9327623873675825
Energy: 0.9290637173978303
Energy: 0.9609589728484684
Energy: 0.9380283160477233
Energy: 0.9561691020073185
Energy: 0.9694619366600365
Energy: 0.963888784244323
Energy: 0.9549038931249416
Energy: 0.9180378369047164
Energy: 0.9656003488715456
Energy: 0.9729898412112808
Energy: 0.9387900175223753
Energy: 0.9147575413758247
Energy: 0.9645207087939266
Energy: 0.9577906659115728
Energy: 0.9189175877662947
Energy: 0.9225074248987591
Energy: 0.9320909478296544
Energy: 0.9600179477375503
Energy: 0.9312605542256283
Energy: 0.9664144378432007
Energy: 0.9398760908271191
Energy: 0.9402578207636706
Energy: 0.9570637855520256
Energy: 0.9698574430152446
Energy: 0.953221730751142
Energy: 0.9367673302047316
Energy: 0.9643736773328581
Energy: 0.9478893528438277
Energy: 0.9311348964240026
Energy: 0.931457592685481
Energy: 0.946651280573677
Energy: 0.9495529937471608
Energy: 0.9340533686319933
Energy: 0.9509866275090385
Energy: 0.9656851553151318
Energy: 0.8974799829066784
Energy: 0.9073507152573125
Energy: 0.9922226959350673
Energy: 0.9383628698657517
Energy: 0.8995964581128973
Energy: 0.9439902005972703
Energy: 0.9249416989713809
Energy: 0.9424428461184986
Energy: 0.9471331618296295
Energy: 0.9394112216490225
Energy: 0.9458631363952342
Energy: 0.9456746304111938
Energy: 0.9431745746436941
Energy: 0.9493029915448392
Energy: 0.9638027089499613
Energy: 0.9520397544696961
Energy: 0.9466797694997355
Energy: 0.9531778753627913
Energy: 0.9230879581223548
Energy: 0.9450536149763518
Energy: 0.9536001086936826
Energy: 0.9415811031141361
Energy: 0.927518893203332
Energy: 0.8998184296597608
Energy: 0.9503047546810264
Energy: 0.9245741995007221
Energy: 0.899885927428281
Energy: 0.9041722974201556
Energy: 0.9526233397403239
Energy: 0.9268250487200779
Energy: 0.9346069516194943
Energy: 0.9507580434473031
Energy: 0.9579292949259844
Energy: 0.9426974500735527
Energy: 0.9382341199348142
Energy: 0.9484144031047153
Energy: 0.9589376583557996
Energy: 0.933700991393099
Energy: 0.9478837224548867
Energy: 0.9683299535186312
Energy: 0.9369035957899284
Energy: 0.9387335165121731
Energy: 0.9701538741265834
Energy: 0.9343367136429196
Energy: 0.9096595524535414
Energy: 0.9257605825378404
Energy: 0.9314262748221013
Energy: 0.9252659172337508
Energy: 0.9282788569581416
Energy: 0.9650167064062589
Energy: 0.9292315724891204
Energy: 0.9142425484168614
Energy: 0.9128614518441845
Energy: 0.9724950147848204
Energy: 0.9735467449871907
Energy: 0.9582445055071515
Energy: 0.9561279935148289
Energy: 0.9949400472667974
Energy: 1.1212468950778747
Energy: 0.9601544919558556
Energy: 0.9563951282357341
Energy: 0.9639009139725461
Energy: 0.9663442408187667
Energy: 0.9259433631328969
Energy: 0.9468694097067909
Energy: 0.9818401636038929
Energy: 0.9241865536456298
Energy: 0.9295210455963878
Energy: 1.0032589605464248
Energy: 0.9572349831310527
Energy: 0.9233644761142077
Energy: 0.9305763028362071
Energy: 0.950824494443775
Energy: 0.9349028532612852
Energy: 0.9230370169740962
Energy: 1.0150240426281265
Energy: 0.987530488831695
Energy: 0.9746197243994674
Energy: 0.9769886772301536
Energy: 1.0038694903244998
Energy: 0.9827135668235576
Energy: 0.9729011131647342
Energy: 1.0068658184357702
Energy: 0.987423671436888
Energy: 0.9471121986594275
Energy: 0.9650493037756313
Energy: 1.0060383781089552
Energy: 0.9887405263741873
Energy: 0.9453038358598449
Energy: 1.0120077568151256
Energy: 1.0126556529751414
Energy: 0.9848337287133392
Energy: 0.9684939000201583
Energy: 0.9712833406397452
Energy: 0.9808641450591545
Energy: 1.02116423901077
Energy: 0.969819006790858
Energy: 0.9731439825095356
Energy: 0.9920307252650131
Energy: 0.9985492870055077
Energy: 1.0095085156774308
Energy: 1.0321078026578197
Energy: 1.0268460891499156
Energy: 1.018306483301851
Energy: 1.009795167137036
Energy: 1.0052892579430637
Energy: 1.0345973696895334
Energy: 1.00768439897117
Energy: 1.0021427615299239
Energy: 1.0092516210839577
Energy: 1.0172574916609065
Energy: 0.9938367357373575
Energy: 0.9928106356448406
Energy: 1.0988975909192171
Energy: 1.011935013475875
Energy: 0.9645202723959247
Energy: 1.0195920935609875
Energy: 1.0323784925651414
Energy: 1.021940838861963
Energy: 1.0516646262387923
Energy: 1.022589337627284
Energy: 1.0081311625898086
Energy: 1.0108756104255257
Energy: 1.03735860838316
Energy: 1.0013575585639996
Energy: 1.008767429073793
Energy: 1.0773707112977957
Energy: 1.0256653398841542
Energy: 1.0307947039819245
Energy: 1.2150986125237249
Energy: 1.0343868395731912
Energy: 1.0743486147240875
Energy: 1.1164643211200431
Energy: 1.1173762579282482
Energy: 1.1307301769687985
Energy: 0.9915172107939941
Energy: 1.02760137664029
Energy: 1.0430802887139856
Energy: 1.0159772772754867
Energy: 1.0056732986029906
Energy: 1.0755291455073968
Energy: 1.1058604364796791
Energy: 1.0189238037570083
Energy: 1.058685891355534
Energy: 1.0703281524374333
Energy: 1.0484494279015615
Energy: 1.0980980632575763
Energy: 1.0554321306955032
Energy: 1.054628109190761
Energy: 1.107446975846773
Energy: 1.0537709026790678
Energy: 1.0544965930982204
Energy: 1.0443983199519509
Energy: 1.1944515334964008
Energy: 0.9875580563520279
Energy: 1.2686307621122686
Energy: 1.0927260417427687
Energy: 0.9877073385957739
Energy: 1.080699269741487
Energy: 1.0579910950299174
Energy: 1.1486273538575893
Energy: 1.093620778884651
Energy: 1.0595945386876533
Energy: 1.135748969120908
Energy: 1.062255647344077
Energy: 1.197663303783625
Energy: 1.0477884112247131
Energy: 1.1314498400533193
Energy: 1.1201182336766804
Energy: 1.0396892234724633
Energy: 1.117425044084804
Energy: 1.0678983248994127
Energy: 1.1089638980882506
Energy: 1.049159371050506
Energy: 1.2111432371331052
Energy: 1.093424195071073
Energy: 1.1544178058266044
Energy: 0.9996502467317928
Energy: 1.1164450125626881
Energy: 1.1382653121950503
Energy: 1.0010017798705317
Energy: 0.9916000295637177

minimum gb energy = 0.8974799829066784 eV
minimum distance =  2.3121323973066 Angstroms
sigma value = 365


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

Energy: 1.1276396484588609
Energy: 1.2604035141540644
Energy: 1.1059579965457593
Energy: 1.1172084419827448
Energy: 1.1175069592574118
Energy: 1.1010031332277566
Energy: 1.1037689131730224
Energy: 1.0723414168785599
Energy: 0.39214208654628546
Energy: 0.3993926480919628
Energy: 0.38501057806715033
Energy: 0.385404598721156
Energy: 0.3993131864056589
Energy: 0.3924088354790972
Energy: 0.36912232769266845
Energy: 0.3990791883588292
Energy: 0.38523449371292234
Energy: 0.3848332272984944
Energy: 0.3847654242281397
Energy: 0.38633993245063836
Energy: 0.3835076439173225
Energy: 1.0907513640242328
Energy: 1.088621117512271
Energy: 1.0998100678080929
Energy: 1.1004152691225297
Energy: 1.099383834658876
Energy: 1.0984422583609603
Energy: 1.0911288253231544
Energy: 1.0837813811874326
Energy: 1.0850621800625353
Energy: 1.092421952031434
Energy: 1.092892102780788
Energy: 1.1018289882181918
Energy: 1.0932365079451878
Energy: 1.0852406281431406
Energy: 0.36888238484127167
Energy: 0.37104659975754195
Energy: 0.38510090749030124
Energy: 0.38544568983474237
Energy: 0.38527622967301306
Energy: 0.3848113169600973
Energy: 0.3843334382479239
Energy: 1.093991978786803
Energy: 1.087882102896319
Energy: 1.100602707105648
Energy: 1.100763615987551
Energy: 1.0996310547460866
Energy: 1.1041024192828972
Energy: 1.0931525510238338
Energy: 1.0876457681348994
Energy: 1.0879001605103287
Energy: 1.0988117378821542
Energy: 1.105907730383079
Energy: 1.1010354145785886
Energy: 1.1023524731186347
Energy: 1.09321147983563
Energy: 0.36892589024815714
Energy: 0.3807167344711251
Energy: 0.38471609550788993
Energy: 0.38537250248586
Energy: 0.38535875528265756
Energy: 0.384973885830554
Energy: 0.38069808852936
Energy: 1.087327107970047
Energy: 1.0842293696177536
Energy: 1.0918533398388046
Energy: 1.0941561749109083
Energy: 1.105724211159101
Energy: 1.0932522623865102
Energy: 1.0847400586611489
Energy: 1.090237836394548
Energy: 1.0953597852141772
Energy: 1.1030085863862888
Energy: 1.103615881869248
Energy: 1.098790388704134
Energy: 1.1015171827253625
Energy: 1.0911427830662503
Energy: 0.3689153017571728
Energy: 0.3921509143964385
Energy: 0.38627255061205207
Energy: 0.386870578535372
Energy: 0.38475867902587546
Energy: 0.3858858523726989
Energy: 0.4011415121431917
Energy: 0.36916279653703693
Energy: 0.3920822626180943
Energy: 0.39904233245352116
Energy: 0.3852905670183755
Energy: 0.3852118497947056
Energy: 0.39948489561360534
Energy: 0.4014670831649598
Energy: 1.096227739336183
Energy: 1.0959161578933019
Energy: 1.1032902815928582
Energy: 1.098872006432236
Energy: 1.095129560192748
Energy: 1.1033142257784332
Energy: 1.0909891843473327
Energy: 1.0720808900402108
Energy: 1.0847494718458164
Energy: 1.0891009906007207
Energy: 0.38531146907971864
Energy: 0.3853197279374838
Energy: 0.3989871919393886
Energy: 1.0739088657064186
Energy: 0.36903489912162707
Energy: 0.3992919183948448
Energy: 0.3853869465874371
Energy: 0.3849804559378921
Energy: 0.38480690436701676
Energy: 0.3846416558219885
Energy: 0.3821889024567956
Energy: 1.0889187159695737
Energy: 1.0939972026753944
Energy: 1.0998038631805391
Energy: 1.1005085703913322
Energy: 1.1006185593740343
Energy: 1.100110259143144
Energy: 1.0910543875103715
Energy: 1.0877217396616006
Energy: 1.084859197933944
Energy: 1.0921968826217134
Energy: 1.101528646588627
Energy: 1.1007692897650516
Energy: 1.0927251930660138
Energy: 1.0847359888196844
Energy: 0.3688303139768192
Energy: 0.40093193375527375
Energy: 0.38547250233669994
Energy: 0.40365561595392024
Energy: 0.3856735417160912
Energy: 0.78994613078828
Energy: 0.732820435712625
Energy: 1.0958788402181041
Energy: 1.0838639402722035
Energy: 1.0920642183490363
Energy: 1.101079618968788
Energy: 1.1012077561660958
Energy: 1.1019021304803507
Energy: 1.0844617932421863

minimum gb energy = 0.3688303139768192 eV
minimum distance =  2.37542122248465 Angstroms
sigma value = 23