Model name: model_name=EAM_Dynamo_BonnyPasianotCastin_2009_FeCuNi__MO_469343973171_005 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Fe Lattice type: short_name=bcc Lattice constant (meters) and cohesive energy (J): a=2.855324625968933 cohesive_energy=4.122759316665687 mass=55.845 Min. tilt angle (degrees): theta_min=0.0 Max. tilt angle (degrees): theta_max=120.0 Max. denominator: max_denominator=8 Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.3390607784579838e-19, 2.2042425695245197e-19, 2.91573716915124e-19, 3.54379040967924e-19, 4.05180857678796e-19, 4.455653219154e-19, 4.77759459198996e-19, 5.04128082241368e-19, 5.267876663760299e-19, 5.469991246139399e-19, 5.6516620546686595e-19, 5.81332167703926e-19, 5.955242483278979e-19, 6.0783377140692e-19, 6.184209546043919e-19, 6.275293287686819e-19, 6.35365574685576e-19, 6.420979209016439e-19, 6.478000675420499e-19, 6.524607993703559e-19, 6.560544815604179e-19, 6.585731032290661e-19, 6.600262774361039e-19, 6.604877043066959e-19, 6.60013460023032e-19, 6.585314466365819e-19, 6.5595514660911e-19, 6.52183622812674e-19, 6.47067872820312e-19, 6.403851940798979e-19, 6.31856807857116e-19, 6.211783005915059e-19, 6.080580761356799e-19, 5.919481900808099e-19, 5.71885734269862e-19, 5.4678283076835e-19, 5.15146250953386e-19, 4.758624820643399e-19, 4.2867838019304e-19, 3.7387913278033796e-19, 3.1210881483310196e-19, 2.4415409507862597e-19, 1.7058855275188197e-19, 7.56140853709764e-20, -6.34449129650928e-20, -2.67952826800062e-19, -5.565961626516e-19] 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: 0.014416825948786198 Energy: 0.10479264184714515 Energy: 0.09145300133519915 Energy: 0.09258097547073055 Energy: 0.10752230082383235 Energy: 0.09034320468335968 Energy: 0.10582426923844089 Energy: 0.09161930267945421 Energy: 0.09341132731518885 Energy: 0.01718927843805009 Energy: 0.09069627312150394 Energy: 0.09052038630414326 Energy: 0.10441524607306978 Energy: 0.015328783127866081 Energy: 0.01565285259749617 Energy: 0.0945524816992785 Energy: 0.09066894835707658 Energy: 0.10418030144838142 Energy: 0.09054574042649398 Energy: 0.10593743352799104 Energy: 0.09124230289303258 Energy: 0.09049027168525578 Energy: 0.10441900677939982 Energy: 0.01796059487134913 Energy: 0.09267801348337118 Energy: 0.09166662823210442 Energy: 0.016837088184721953 Energy: 0.01494119497242411 Energy: 0.10413420781459051 Energy: 0.09201491967142446 Energy: 0.01608556905267445 Energy: 0.10560258399921496 Energy: 0.09051551062066147 Energy: 0.09092491379515044 Energy: 0.09252830218007202 Energy: 0.09047937952544151 Energy: 0.015328360578727517 Energy: 0.01524110974891582 Energy: 0.09082070049735046 Energy: 0.014656224429907078 Energy: 0.016560386963926862 Energy: 0.09371593580381866 Energy: 0.09126001812112723 Energy: 0.015721373484625583 Energy: 0.014650948596272452 Energy: 0.09056679518141957 Energy: 0.09233678281646122 Energy: 0.09169690372263663 Energy: 0.09046883656805661 Energy: 0.014477266118016262 Energy: 0.09078291160975735 Energy: 0.09319184932185524 Energy: 0.10636811514873781 Energy: 0.0152478312218014 Energy: 0.014704496816855631 Energy: 0.0911388271224805 Energy: 0.015096406827123238 Energy: 0.01616940217893887 Energy: 0.1048118594253161 Energy: 0.09055492874212175 Energy: 0.014648117478958306 Energy: 0.10453823574098345 Energy: 0.09040275737171335 Energy: 0.10435564184197 Energy: 0.09123394666849088 Energy: 0.09053109852001938 Energy: 0.014988085730223073 Energy: 0.016553948856042385 Energy: 0.1042122578400922 Energy: 0.09172768859264177 minimum gb energy = 0.014416825948786198 eV minimum distance = 2.47070238550066 Angstroms sigma value = 3 ======================================== theta = 23.07391806563098 ======================================== Energy: 1.6288769344245977 Energy: 1.3293183820019168 Energy: 1.3457187830449517 Energy: 1.3637192646032554 Energy: 1.3386102788035263 Energy: 1.3219262485506151 Energy: 1.3319610954751944 Energy: 1.3917831691339657 Energy: 1.3566244670409862 Energy: 1.2886213588171276 Energy: 1.4008496799265613 Energy: 1.333775191292582 Energy: 1.3414545395536661 Energy: 1.3023391286730752 Energy: 1.393873002975659 Energy: 1.3075243162699117 Energy: 1.3514456904185386 Energy: 1.3586858948612803 Energy: 1.3130426484402795 Energy: 1.330474052737688 Energy: 1.2957071809367036 Energy: 1.27069284526555 Energy: 1.3359133058087664 Energy: 1.3100680801954103 Energy: 1.3649379342977772 Energy: 1.3343154198575755 Energy: 1.3048132983090914 Energy: 1.2548776892979312 Energy: 1.3318996096467997 Energy: 1.3268581809532667 Energy: 1.4782854402683687 Energy: 1.2629434520169525 Energy: 1.3352235095338372 Energy: 1.2867762167301569 Energy: 1.282286043238965 Energy: 1.345801545614025 Energy: 1.3579607483019216 Energy: 1.4407743904093342 Energy: 1.2872824186018341 Energy: 1.2902917888839918 Energy: 1.4933157017028127 Energy: 1.2887314323814614 Energy: 1.5145469277036454 Energy: 1.48821150752727 Energy: 1.269470643814912 Energy: 1.340601624700854 Energy: 1.3582431427087116 Energy: 1.294278415327818 Energy: 1.2940859504055973 Energy: 1.2667858062261417 Energy: 1.3352660419889872 Energy: 1.283506013952547 Energy: 1.2698643599745858 Energy: 1.2688624956685466 Energy: 1.5071366208287746 Energy: 1.3637921875059 Energy: 1.4353447804075188 Energy: 1.257004973089522 Energy: 1.2965696830279005 Energy: 1.2818750546329856 Energy: 1.336930302979996 Energy: 1.2930442651217686 Energy: 1.2584598279815915 Energy: 1.27560773733389 Energy: 1.293154229311512 Energy: 1.3228701660621982 Energy: 1.2593734843619449 Energy: 1.424675388988021 Energy: 1.3192664931233473 Energy: 1.3344959801776026 Energy: 1.3428207816471815 Energy: 1.37540074629369 Energy: 1.271572388083079 Energy: 1.270925530155587 Energy: 1.3148802117706353 Energy: 1.3031061103878525 Energy: 1.2689177567987033 Energy: 1.3762436627665788 Energy: 1.440454326242667 Energy: 1.2521614926836633 Energy: 1.3672316118104824 Energy: 1.3587651021882259 Energy: 1.2731148352207928 Energy: 1.2753975466255005 Energy: 1.2881931774414033 Energy: 1.2684408232177324 Energy: 1.2638370596458879 Energy: 1.361767859195385 Energy: 1.331349852199992 Energy: 1.2503105788379392 Energy: 1.320699607795682 Energy: 1.4223291708390502 Energy: 1.2574257363236696 Energy: 1.2598122676840964 Energy: 1.290501822647676 Energy: 1.2653421401539224 Energy: 1.2659615770352008 Energy: 1.3085182231249783 Energy: 1.2494213510209622 Energy: 1.3293129842788813 Energy: 1.3065600503129575 Energy: 1.2731652681131123 Energy: 1.3987512657395968 Energy: 1.397652441446583 Energy: 1.442833935012863 Energy: 1.3987452263940066 Energy: 1.2970648354558316 Energy: 1.2886908418252643 Energy: 1.3033023494661253 Energy: 1.3158854293313758 Energy: 1.2862268649164221 Energy: 1.290861770469136 Energy: 1.3700541701187883 Energy: 1.3897810601689198 Energy: 1.2655943475994869 Energy: 1.5119208690164572 Energy: 1.5246551040874976 Energy: 1.3958181181063642 Energy: 1.3041183442158641 Energy: 1.2823904861622475 Energy: 1.324609248369848 Energy: 1.2875996539634493 Energy: 1.3352811330393082 Energy: 1.3175613941057842 Energy: 1.3227087275926437 Energy: 1.3549036120550255 Energy: 1.3698504965859593 Energy: 1.3468814816440822 Energy: 1.266547675498469 Energy: 1.4137935490155429 Energy: 1.335694939866757 Energy: 1.3272567442640035 Energy: 1.4852861597242002 Energy: 1.298417455426219 Energy: 1.3164639079073648 Energy: 1.3267279034752195 Energy: 1.3659464107622934 Energy: 1.2806280418677807 Energy: 1.2938977951661699 Energy: 1.288570785314184 Energy: 1.31836648078018 Energy: 1.3046187449728346 Energy: 1.368887901765484 Energy: 1.3559599223845304 Energy: 1.5140513950206511 Energy: 1.2575199863108173 Energy: 1.3554694470441375 Energy: 1.378125565785685 Energy: 1.3115886655757303 Energy: 1.3139165738142597 Energy: 1.3130077730291025 Energy: 1.2997319393611062 Energy: 1.3204606160907515 Energy: 1.3416713801264581 Energy: 1.3683894981723452 Energy: 1.4393947429653091 Energy: 1.300895556069193 Energy: 1.2606494696830655 Energy: 1.2978493832197886 Energy: 1.3174201105997578 Energy: 1.2795558657709685 Energy: 1.3022038040105546 Energy: 1.2570958531438499 Energy: 1.3502786020910973 Energy: 1.3713620474478294 Energy: 1.3820221086548474 Energy: 1.3043582134913492 Energy: 1.3174439268634603 Energy: 1.3601426032603727 Energy: 1.3552839105167194 Energy: 1.349024113946021 Energy: 1.26894721623538 Energy: 1.4345626603164545 Energy: 1.254706120107829 Energy: 1.312497726654991 Energy: 1.582419399322914 Energy: 1.299752874524392 Energy: 1.3174009059210792 Energy: 1.306244623160145 Energy: 1.2705765253611367 Energy: 1.3382335111545294 Energy: 1.3539406119730661 Energy: 1.3084856423454052 Energy: 1.2944900940177915 Energy: 1.2618789445987943 Energy: 1.4774886300791272 Energy: 1.3808257285966086 Energy: 1.4918777490622377 Energy: 1.5581561980724516 Energy: 1.2658942514308877 Energy: 1.3498195367874122 Energy: 1.4310519510423454 Energy: 1.2532233935736734 Energy: 1.29177748559604 Energy: 1.2662317014978308 Energy: 1.3775012475137431 Energy: 1.2762006359120897 Energy: 1.263721187062286 Energy: 1.2552989219298345 Energy: 1.5001853570417498 Energy: 1.430216883281131 Energy: 1.25347939046044 Energy: 1.4466709756630245 Energy: 1.301789112736192 Energy: 1.3133002277044432 Energy: 1.3378978495840557 Energy: 1.2878391349168994 Energy: 1.261230783829536 Energy: 1.2873841758909492 Energy: 1.2741691066794312 Energy: 1.3033259026707853 Energy: 1.2608853667362607 Energy: 1.3589034033348713 Energy: 1.4352593284510835 Energy: 1.2571014059030818 Energy: 1.3504953708521503 Energy: 1.265793615976349 Energy: 1.2715920624310597 Energy: 1.2708897610972347 Energy: 1.3071895491941175 Energy: 1.2911494099084404 Energy: 1.268594097705408 Energy: 1.3658442418109404 Energy: 1.332102371167427 Energy: 1.2562865400978502 Energy: 1.364592533743984 Energy: 1.359963705886643 Energy: 1.2666994009083856 Energy: 1.2910277572194155 Energy: 1.2483032077761724 Energy: 1.2920658613015765 Energy: 1.2681244206778375 Energy: 1.2591510758421312 Energy: 1.2572352714312431 Energy: 1.329784337029544 Energy: 1.336301721805556 Energy: 1.4308969121104695 Energy: 1.2557838348518966 Energy: 1.2568256658990655 Energy: 1.3106705583806415 Energy: 1.332425959964233 Energy: 1.2632154490543592 Energy: 1.291701901957866 Energy: 1.2897460421369031 Energy: 1.2824509669769892 Energy: 1.3035294588601343 Energy: 1.2541316581552635 Energy: 1.4423272223427674 Energy: 1.3426578935089355 Energy: 1.4967321317377331 Energy: 1.5106382399423939 Energy: 1.3132375854250722 Energy: 1.289378585860477 Energy: 1.324188097235715 Energy: 1.272453510679822 Energy: 1.2925820713685579 Energy: 1.282383234481917 Energy: 1.3965760210523712 Energy: 1.3372292634032679 Energy: 1.2996055381897451 Energy: 1.3859239911554169 Energy: 1.4695136522848327 Energy: 1.464614433561001 Energy: 1.5021107364642339 Energy: 1.2467828746867045 Energy: 1.29588794910151 Energy: 1.3194823803944118 Energy: 1.3496010728405001 Energy: 1.3142309817319056 Energy: 1.2912378603474688 Energy: 1.410946238890476 Energy: 1.335506003406914 Energy: 1.255158178704898 Energy: 1.3209607397247378 Energy: 1.4257097024580772 Energy: 1.5341877692118833 Energy: 1.4648733159488474 Energy: 1.2595113771883322 Energy: 1.336435405012137 Energy: 1.2870362566059932 Energy: 1.428851364901235 Energy: 1.3322689127297263 Energy: 1.3143026928750454 Energy: 1.3352804979718804 Energy: 1.3383436401767081 Energy: 1.3303388521329458 Energy: 1.3325971164753094 Energy: 1.4485248797890347 Energy: 1.294875050144501 Energy: 1.2909696060475884 minimum gb energy = 1.2467828746867045 eV minimum distance = 2.22042362795469 Angstroms sigma value = 75 ======================================== theta = 34.04773236999154 ======================================== Energy: 1.6834104707987159 Energy: 1.3910449278564894 Energy: 1.3664933076813919 Energy: 1.4239225480766728 Energy: 1.3599503138226585 Energy: 1.4067290834564492 Energy: 1.4298902168488314 Energy: 1.4350988919008616 Energy: 1.3914550982647713 Energy: 1.3925342503045206 Energy: 1.4635165504235135 Energy: 1.3510246105263797 Energy: 1.4279768853368306 Energy: 1.3804587609503811 Energy: 1.4065715874168774 Energy: 1.3512653123832599 Energy: 1.3758727444288594 Energy: 1.393196509023719 Energy: 1.3526504471351155 Energy: 1.3671570472385548 Energy: 1.4661078925525004 Energy: 1.3920611531847484 Energy: 1.362334775960165 Energy: 1.3774562750504327 Energy: 1.3855286148887846 Energy: 1.3819565162522232 Energy: 1.4852103190524821 Energy: 1.4107740512988678 Energy: 1.4636442978712407 Energy: 1.4414945122274916 Energy: 1.4250681463372703 Energy: 1.392050827932102 Energy: 1.4562952508129576 Energy: 1.4383099064684497 Energy: 1.3290908357188316 Energy: 1.3529552498790665 Energy: 1.3484839496017635 Energy: 1.4343797526040005 Energy: 1.4676411996649315 Energy: 1.4693327346192466 Energy: 1.4251495116116284 Energy: 1.4633035591197552 Energy: 1.4730566769433198 Energy: 1.4193225793693132 Energy: 1.332350743786266 Energy: 1.333339260713088 Energy: 1.3582967887166124 Energy: 1.3411396582255906 Energy: 1.4258305517725105 Energy: 1.3908673031547272 Energy: 1.372037944980983 Energy: 1.4140447650313352 Energy: 1.3384363437782665 Energy: 1.3355880720334514 Energy: 1.4181377719620742 Energy: 1.3288340081126808 Energy: 1.3472395809612474 Energy: 1.3479953877825355 Energy: 1.3425998991326473 Energy: 1.3346856809056842 Energy: 1.341658845812351 Energy: 1.4220013947800687 Energy: 1.3428131604605098 Energy: 1.3540111085679254 Energy: 1.402090154370982 Energy: 1.3371367371709668 Energy: 1.3359833313890788 Energy: 1.3450006326273125 Energy: 1.3523047949313742 Energy: 1.354679183903759 Energy: 1.3348860629954498 Energy: 1.3360408537731192 Energy: 1.419727701393548 Energy: 1.436003403714864 Energy: 1.4806042712443674 Energy: 1.4343996668257946 Energy: 1.3818891301930163 Energy: 1.4547458941985985 Energy: 1.3538671869113992 Energy: 1.3660412736258578 Energy: 1.4324450240621256 Energy: 1.333718220418588 Energy: 1.427961365509577 Energy: 1.417155298437821 Energy: 1.3805404090170845 Energy: 1.4470110622613368 Energy: 1.4772182613347344 Energy: 1.4554852090886228 Energy: 1.3659542637718984 Energy: 1.4312609006271426 Energy: 1.5364805257123197 Energy: 1.3783056855511988 Energy: 1.4605475721831978 Energy: 1.363406173343534 Energy: 1.3641612787268513 Energy: 1.4443526235772355 Energy: 1.492707606107639 Energy: 1.4084080614721883 Energy: 1.4111112944161692 Energy: 1.4383270165495954 Energy: 1.3479451026165497 Energy: 1.4052655658161974 Energy: 1.46398005206911 Energy: 1.4682381092318888 Energy: 1.4022995798691444 Energy: 1.3461079045088533 Energy: 1.3768723264846805 Energy: 1.378064827523019 Energy: 1.456925887632068 Energy: 1.3618081456425586 Energy: 1.3801546088643322 Energy: 1.436527158937514 Energy: 1.3716700512839275 Energy: 1.3687473537434744 Energy: 1.3907460582239888 Energy: 1.3569949907560015 Energy: 1.4700128326460293 Energy: 1.4180401963408074 Energy: 1.3603401170547185 Energy: 1.3522642118390125 Energy: 1.4134825933715864 Energy: 1.4468906046294592 Energy: 1.39502904077629 Energy: 1.3971530137887416 Energy: 1.4376539905892702 Energy: 1.3570222392189606 Energy: 1.3666647890187666 Energy: 1.3560636898154856 Energy: 1.4247326295384675 Energy: 1.5226803533459974 Energy: 1.4278598220388916 Energy: 1.3958381068578634 Energy: 1.4703733700119443 Energy: 1.465298952958264 Energy: 1.4205794877168272 Energy: 1.417126574300402 Energy: 1.33511358579572 Energy: 1.3538069312706258 Energy: 1.397206931088658 Energy: 1.408386471031207 Energy: 1.3430751213082872 Energy: 1.336126919319014 Energy: 1.4313656435318571 Energy: 1.46796497628661 Energy: 1.3459542122998422 Energy: 1.3422814522866742 Energy: 1.3413269886446362 Energy: 1.3526299356118898 Energy: 1.3626652883791694 Energy: 1.3470159396738068 Energy: 1.3429897514426823 Energy: 1.3413724665927633 Energy: 1.4116797016828118 Energy: 1.4035768043149812 Energy: 1.3273549045332782 Energy: 1.4162411000956663 Energy: 1.4127606968201112 Energy: 1.3517164479435646 Energy: 1.3488519323036023 Energy: 1.3366677106262441 Energy: 1.342691007430561 Energy: 1.3484648346979622 Energy: 1.3692816331600435 Energy: 1.4202033455509493 Energy: 1.3395892215762444 Energy: 1.4653321899966958 Energy: 1.455384797430034 Energy: 1.3332552394436015 Energy: 1.3352796186318627 Energy: 1.3497590807043198 Energy: 1.3692284384044504 Energy: 1.369292276270752 Energy: 1.3363422303681547 Energy: 1.340046285793021 Energy: 1.4159089356491106 Energy: 1.4190214782333075 Energy: 1.4648264047064516 Energy: 1.384553741802533 Energy: 1.471491927439139 Energy: 1.455204921801701 Energy: 1.4339443661132714 Energy: 1.4175472935839861 Energy: 1.355223109435274 Energy: 1.3248842419214346 Energy: 1.4347491394338034 Energy: 1.3846158324977818 Energy: 1.3590253110304102 Energy: 1.4360182913971216 Energy: 1.5206392646283626 Energy: 1.4360839802044285 Energy: 1.3647205027274119 Energy: 1.4676870631007475 Energy: 1.472100231291553 Energy: 1.4604769421520858 Energy: 1.363662615065022 Energy: 1.3514950586332102 Energy: 1.3877113105624632 Energy: 1.43694289137738 Energy: 1.4081468573137925 Energy: 1.4170558089164313 Energy: 1.3994353759865912 Energy: 1.361895973305287 Energy: 1.3527121379737748 Energy: 1.3558555334313476 Energy: 1.3757585121133717 Energy: 1.4390937854726698 Energy: 1.3653794799876444 Energy: 1.3641802471892903 Energy: 1.3678690461276581 Energy: 1.3693971582226128 Energy: 1.4125111392743972 Energy: 1.38471623278577 Energy: 1.425543786315344 Energy: 1.429646056055739 Energy: 1.3664995605434782 Energy: 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1.1591248178195204 Energy: 1.2156448360606547 Energy: 1.3185859188192428 Energy: 1.2560138449546956 Energy: 1.2470608240580872 Energy: 1.2476887905907865 Energy: 1.319955272184918 Energy: 1.323613796602281 Energy: 1.41671173372711 Energy: 1.2910541348035594 Energy: 1.2289438663657457 Energy: 1.2479872144559523 Energy: 1.2587463390484153 Energy: 1.258394509809888 Energy: 1.2391272718857689 Energy: 1.2447397311489827 Energy: 1.2831733305702464 Energy: 1.3305895477772758 Energy: 1.4148714417047483 Energy: 1.3730954310681642 Energy: 1.3753009964551157 Energy: 1.2138539723334663 Energy: 1.2487031950946181 Energy: 1.264937892431924 Energy: 1.244112202625523 Energy: 1.2942027968237304 Energy: 1.3271878499139234 Energy: 1.2504983437494763 Energy: 1.4126755841055012 Energy: 1.357100710167028 Energy: 1.288536229070144 Energy: 1.2162640631213786 Energy: 1.2370027378093438 Energy: 1.1970131118437897 Energy: 1.353333842659591 Energy: 1.3291098920071798 Energy: 1.3183361616156695 Energy: 1.3585444534345437 Energy: 1.33110304944862 Energy: 1.3322811718313916 Energy: 1.3570650876994228 Energy: 1.4127230534445163 Energy: 1.3418771048529246 minimum gb energy = 1.1433317701408774 eV minimum distance = 2.20370084171146 Angstroms sigma value = 185 ======================================== theta = 62.96430821058772 ======================================== Energy: 2.367709168969023 Energy: 1.124958276270294 Energy: 1.275944318501159 Energy: 1.2764923809343893 Energy: 1.2786920715367436 Energy: 1.3273373094016796 Energy: 1.4107077132100843 Energy: 1.3287839049826795 Energy: 1.2763876105537295 Energy: 1.1213134264783788 Energy: 1.2768944425355775 Energy: 1.4156145595243927 Energy: 1.2761584864738533 Energy: 1.113253225854671 Energy: 1.1137098456463115 Energy: 1.2770563544897935 Energy: 1.4294189615353174 Energy: 1.4094852200102335 Energy: 1.4108648754635291 Energy: 1.2786824429388968 Energy: 1.2760196187916881 Energy: 1.302743335612894 Energy: 1.2761425314236536 Energy: 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1.4305030600276734 Energy: 1.3922502820706857 Energy: 1.4161846060519732 Energy: 1.4185481755882314 Energy: 1.275788243960345 Energy: 1.279300162471279 Energy: 1.279080237110641 Energy: 1.1172603307603275 Energy: 1.1173123832506926 Energy: 1.122474505477138 Energy: 1.1200034019195673 minimum gb energy = 1.113253225854671 eV minimum distance = 2.26708306025125 Angstroms sigma value = 33 ======================================== theta = 69.97282751604145 ======================================== Energy: 1.6172070088509725 Energy: 1.3573783302467188 Energy: 1.477497554110858 Energy: 1.2613397549981493 Energy: 1.3490197338291574 Energy: 1.5089695223996116 Energy: 1.4050571660363043 Energy: 1.4358020479139115 Energy: 1.3584681412782196 Energy: 1.4679294601558732 Energy: 1.2394145588635739 Energy: 1.4228614090960738 Energy: 1.4690197401099252 Energy: 1.3625670741072486 Energy: 1.3838442713923675 Energy: 1.467998896809661 Energy: 1.421282704108155 Energy: 1.3527323389143144 Energy: 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1.4688596974223833 Energy: 1.6092208504840932 Energy: 1.424186639226352 Energy: 1.3583011216887217 Energy: 1.3940160478029042 Energy: 1.3751683484762043 Energy: 1.3829746054380467 Energy: 1.4267978527598912 Energy: 1.5090175909186974 Energy: 1.5345863258408872 Energy: 1.4997310958079078 Energy: 1.4054187207986424 Energy: 1.4090264370884324 Energy: 1.3547703635823225 Energy: 1.372149708918573 Energy: 1.3586514013571778 Energy: 1.4195301961874607 Energy: 1.4353614619381072 Energy: 1.510037117129003 Energy: 1.4253866455028403 Energy: 1.3330029461919342 Energy: 1.390773713495447 Energy: 1.3922405584517803 Energy: 1.4318765373519797 Energy: 1.3399894947592073 Energy: 1.3836776027050888 Energy: 1.4326437096299809 Energy: 1.4235987912096657 Energy: 1.5052661845725108 Energy: 1.337317598609272 minimum gb energy = 1.325875866429564 eV minimum distance = 2.23857616262082 Angstroms sigma value = 293 ======================================== theta = 91.16938280561406 ======================================== Energy: 1.9145503774682517 Energy: 1.403409426667678 Energy: 1.4352600476836093 Energy: 1.4363599737145991 Energy: 1.3964265898659105 Energy: 1.4030091386920442 Energy: 1.4412342082127296 Energy: 1.4107458768673613 Energy: 1.4311982129840812 Energy: 1.495176005157025 Energy: 1.551571084832668 Energy: 1.432038801574523 Energy: 1.4256090378316322 Energy: 1.6000984593825125 Energy: 1.425097855769807 Energy: 1.427315486517265 Energy: 1.3584218997405404 Energy: 1.3336458794817618 Energy: 1.3355911263679057 Energy: 1.3965981849251654 Energy: 1.5588621030082954 Energy: 1.4197326117619857 Energy: 1.4319370514339107 Energy: 1.427044477188134 Energy: 1.5044865269502052 Energy: 1.410353957092056 Energy: 1.334032144001837 Energy: 1.3464404404838926 Energy: 1.3983912833253378 Energy: 1.463237303159256 Energy: 1.4937953438395255 Energy: 1.3961962635394174 Energy: 1.3911147777123063 Energy: 1.3260760435997816 Energy: 1.3925568113923783 Energy: 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1.3910016241910044 Energy: 1.3723326342154318 Energy: 1.4738106756938278 Energy: 1.4537022467561154 Energy: 1.3805558039613763 Energy: 1.3765846552702052 Energy: 1.464120159446677 Energy: 1.4711677252936188 Energy: 1.418285674369184 Energy: 1.3997338927562715 Energy: 1.3998013133197666 Energy: 1.391677103425007 Energy: 1.4699927631267227 Energy: 1.4425739404938962 Energy: 1.4575115291051306 Energy: 1.386314749716817 Energy: 1.4367630542310197 Energy: 1.5073688772987623 Energy: 1.4356860940721132 Energy: 1.3979602810971832 Energy: 1.3898694967167846 Energy: 1.3943083941392085 Energy: 1.4252663420657776 Energy: 1.4485438465248497 Energy: 1.5919970863043706 Energy: 1.445674995932581 Energy: 1.4597462285983058 Energy: 1.4553776890840902 Energy: 1.3541773388372724 Energy: 1.4132141088525623 Energy: 1.4002858274307854 Energy: 1.399564036561668 Energy: 1.4668963053872788 Energy: 1.3476652429702143 Energy: 1.4765481761789079 Energy: 1.4092714919687817 Energy: 1.4460373039091883 Energy: 1.4822152516221354 Energy: 1.4700069930455009 Energy: 1.4134393513370727 Energy: 1.5398761241915306 Energy: 1.3809608100882051 Energy: 1.3316727450861663 Energy: 1.3765017350416477 Energy: 1.3645533806531953 Energy: 1.391663818147116 Energy: 1.3795919748780612 Energy: 1.469145568602375 Energy: 1.4583305333917924 Energy: 1.5642575350550574 Energy: 1.3994556434435899 Energy: 1.3992639442116677 Energy: 1.3155529507719668 Energy: 1.3285739522734277 Energy: 1.3536049240373733 Energy: 1.4110036560232693 Energy: 1.4398827191844266 Energy: 1.4734522227235076 Energy: 1.4187543247707948 Energy: 1.4120800355386458 Energy: 1.404510071837091 Energy: 1.3793889798618535 Energy: 1.3185806550588632 Energy: 1.3542498379445433 Energy: 1.3642804537891262 Energy: 1.6703880032644236 Energy: 1.3462043040887242 Energy: 1.4248404201946774 Energy: 1.4383083362764666 minimum gb energy = 1.315201655444235 eV minimum distance = 2.24059314682195 Angstroms sigma value = 293 ======================================== theta = 101.5369590328155 ======================================== Energy: 1.6209731952116955 Energy: 1.2935543044757492 Energy: 1.337932734238051 Energy: 1.4733034044743063 Energy: 1.2394148129202531 Energy: 1.3596520358095558 Energy: 1.227541566213502 Energy: 1.2283826652447623 Energy: 1.2492651780547648 Energy: 1.412279716378677 Energy: 1.3055671274735987 Energy: 1.3055494611850826 Energy: 1.2773845283593195 Energy: 1.2682605622011445 Energy: 1.231419961762819 Energy: 1.207641850126788 Energy: 1.2253015677575716 Energy: 1.2915454187566344 Energy: 1.3750912782495328 Energy: 1.2243908903237066 Energy: 1.396568103653184 Energy: 1.399983777922854 Energy: 1.2485557508028908 Energy: 1.2211846022386061 Energy: 1.395773226299351 Energy: 1.2798387198643797 Energy: 1.292597651878497 Energy: 1.2305532227533094 Energy: 1.2295210218685289 Energy: 1.2211729457663663 Energy: 1.226564271812423 Energy: 1.2607573851357234 Energy: 1.4130871513501253 Energy: 1.2826677283560852 Energy: 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1.237008794430692 Energy: 1.2716749470789008 Energy: 1.2771108276994116 Energy: 1.2204681091165825 Energy: 1.223248660623462 Energy: 1.2361399103484063 Energy: 1.259796295939727 Energy: 1.4114430838776402 Energy: 1.220738782303469 Energy: 1.280751592157238 Energy: 1.2626885871044438 Energy: 1.2203683787066224 Energy: 1.2293040810429245 Energy: 1.2252603582934565 Energy: 1.246753800497486 Energy: 1.2769098937323975 Energy: 1.2606501702178265 Energy: 1.3052395612530154 Energy: 1.4393830000761212 Energy: 1.2407866808061985 Energy: 1.472392769521894 Energy: 1.2829608753537802 Energy: 1.2953902248445193 Energy: 1.2377010627064735 Energy: 1.23107732619365 Energy: 1.2268699399429737 Energy: 1.2507174652079882 Energy: 1.39877972586959 Energy: 1.2607277815300444 Energy: 1.2795460769596188 Energy: 1.4014581766830154 Energy: 1.3919342791553955 Energy: 1.3287037367143928 Energy: 1.2281990042862685 Energy: 1.225923398318651 Energy: 1.2826189303528786 Energy: 1.2867340163849548 Energy: 1.2525001535703344 minimum gb energy = 1.110683826158516 eV minimum distance = 2.29201652289104 Angstroms sigma value = 15 ======================================== theta = 110.02717248395858 ======================================== Energy: 1.5323921743563087 Energy: 1.3520497676376364 Energy: 1.370169826421281 Energy: 1.3521311356718524 Energy: 1.3413474218139252 Energy: 1.3316832266284755 Energy: 1.4450369818998978 Energy: 1.3823716269901767 Energy: 1.3593178245230393 Energy: 1.3665099919776706 Energy: 1.4023714206220348 Energy: 1.5533553953278592 Energy: 1.5526009741496425 Energy: 1.5477668178721662 Energy: 1.378220097709062 Energy: 1.3556713940888163 Energy: 1.2969415743248702 Energy: 1.2989318349480172 Energy: 1.3325794625203353 Energy: 1.4402921212970154 Energy: 1.4440044908711234 Energy: 1.4952870048264404 Energy: 1.5017130951250517 Energy: 1.341014050389521 Energy: 1.3353508738252082 Energy: 1.3210262941926625 Energy: 1.3160526075557704 Energy: 1.3216450363810552 Energy: 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1.4941913741650228 Energy: 1.327563909214264 Energy: 1.345512259830551 Energy: 1.4047979732942035 Energy: 1.457193502314415 Energy: 1.4738874688852661 Energy: 1.4799261793745335 Energy: 1.3902938627013608 Energy: 1.3187364586451868 Energy: 1.4410788732039876 Energy: 1.4321558052653467 Energy: 1.484653768328754 Energy: 1.4997395989995563 Energy: 1.5516304876816895 Energy: 1.3558370510433615 Energy: 1.35348040421884 Energy: 1.355797583561014 Energy: 1.318073683446974 Energy: 1.3696134518620677 Energy: 1.5050962571227646 Energy: 1.6698573575627904 Energy: 1.4629184451043575 Energy: 1.4669957223268613 Energy: 1.3612407243083666 Energy: 1.324466500067217 Energy: 1.3147920091389413 Energy: 1.3172446648877993 Energy: 1.354109630369865 Energy: 1.2892823563046398 Energy: 1.5533019097370897 Energy: 1.4259699388919325 Energy: 1.386466722538091 Energy: 1.4420501522206872 Energy: 1.304224883234695 Energy: 1.3001819808564428 Energy: 1.3088749390219958 Energy: 1.355563072787631 Energy: 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1.4673882574961907 Energy: 1.3657175071027237 Energy: 1.3677420648122705 Energy: 1.3723920193322467 Energy: 1.3551600288610561 Energy: 1.455305865141009 Energy: 1.3914702744136946 Energy: 1.3425734923265558 Energy: 1.4070056802391337 Energy: 1.337071623629982 Energy: 1.3724094594997733 Energy: 1.411855929066292 Energy: 1.4000382073713094 Energy: 1.4186030032839476 Energy: 1.3796290283340833 Energy: 1.4464185378881718 Energy: 1.4294267288941283 Energy: 1.3991417245152196 Energy: 1.4656766725309531 Energy: 1.3772682865151789 Energy: 1.4639222895936874 Energy: 1.4462326260862999 Energy: 1.3805760693168883 Energy: 1.4075192475194578 Energy: 1.4181101157593563 Energy: 1.41672523634039 Energy: 1.3727432577252243 Energy: 1.3452000060019482 Energy: 1.489329843345246 Energy: 1.3421217083485353 Energy: 1.3176594281268215 Energy: 1.443258127415262 Energy: 1.3572500047817535 Energy: 1.4149127749104158 Energy: 1.368545499123055 Energy: 1.3843753770215985 Energy: 1.3384782479510866 Energy: 1.4983095840836942 Energy: 1.4508208531009334 Energy: 1.373088240389451 Energy: 1.4973816812001337 Energy: 1.4921217141066538 Energy: 1.3901699501074845 Energy: 1.3724857040657716 Energy: 1.3359847790617685 Energy: 1.33726297189589 Energy: 1.3556317039269685 Energy: 1.4717738582826323 Energy: 1.4300507582361721 Energy: 1.4424187351765114 Energy: 1.4174645672454604 Energy: 1.3401539894311603 Energy: 1.3422523877572465 Energy: 1.3350592927762013 Energy: 1.3609358460646916 Energy: 1.3819337808243903 Energy: 1.555004565707654 Energy: 1.5283343580615845 Energy: 1.6648261724336493 Energy: 1.4827096666033783 Energy: 1.4270638108085671 Energy: 1.3594519756896253 Energy: 1.3168214894542225 Energy: 1.3302199535355248 Energy: 1.3373010104430483 Energy: 1.545624447295821 Energy: 1.3814193816560885 Energy: 1.3571570202690224 Energy: 1.356395155724587 Energy: 1.5069884720124767 Energy: 1.3527657319727708 Energy: 1.3677225844905907 Energy: 1.3665815011620386 Energy: 1.339339230352013 Energy: 1.3558332717652626 Energy: 1.3239000601822737 Energy: 1.2981722036701528 Energy: 1.3042803866602959 Energy: 1.4327960873787584 Energy: 1.2838185709821268 Energy: 1.541081076516129 Energy: 1.5515941045459456 Energy: 1.5437989127864264 Energy: 1.3737681654802119 Energy: 1.3481257138807505 Energy: 1.3161377806294452 Energy: 1.3181351203931233 Energy: 1.3559867518548163 Energy: 1.459805055861532 Energy: 1.4414550119751937 Energy: 1.5689181154195917 Energy: 1.5030669778023966 Energy: 1.3636495239751045 Energy: 1.3533158752336483 Energy: 1.3387513274487983 Energy: 1.3613518093944525 Energy: 1.3552130473637325 Energy: 1.5257464842359616 Energy: 1.4987901798664858 Energy: 1.506007192639205 Energy: 1.4314858019873913 Energy: 1.465518685069238 Energy: 1.3329667842595445 Energy: 1.315103666154879 Energy: 1.3828184924243203 Energy: 1.4724529309568 Energy: 1.3871436514124718 Energy: 1.401418860560632 Energy: 1.345634448243145 Energy: 1.3269266096300594 Energy: 1.460036624792672 Energy: 1.4131862332342728 Energy: 1.3574849319182616 Energy: 1.3948835352093378 Energy: 1.3787749847390585 Energy: 1.3802873035349816 Energy: 1.3549657347738389 Energy: 1.3860762452569997 Energy: 1.3920148203467781 Energy: 1.408584626738073 Energy: 1.4545849233857775 Energy: 1.3958050004750846 Energy: 1.443325709359966 Energy: 1.4729676371732756 Energy: 1.3505495003024188 Energy: 1.3705098480664368 Energy: 1.371657992475885 Energy: 1.4177624855248963 Energy: 1.408983469165214 Energy: 1.3848854804043822 Energy: 1.4256401962582261 Energy: 1.3860073173510665 Energy: 1.4085157021297607 Energy: 1.4555565238222277 Energy: 1.4024080610514449 Energy: 1.3744304919288362 Energy: 1.381219247820749 Energy: 1.3896494909386927 Energy: 1.415847211077521 Energy: 1.3821316704056483 Energy: 1.3830967242592809 Energy: 1.3823836830329195 Energy: 1.337438830728019 Energy: 1.3875815237273974 Energy: 1.4344151934176599 Energy: 1.372091428464862 Energy: 1.3720038736331794 Energy: 1.4185772119719224 Energy: 1.5020089156771292 Energy: 1.4088600752909992 Energy: 1.4086504188322324 Energy: 1.4048899918060413 Energy: 1.43413360294882 Energy: 1.4090177763901035 Energy: 1.408224561295991 Energy: 1.4190098495343468 Energy: 1.3833357399065263 Energy: 1.3819565260495228 Energy: 1.4846467417401004 Energy: 1.4441047854709612 Energy: 1.397572289088991 Energy: 1.500781093742871 Energy: 1.4058477248534802 Energy: 1.3922435420386126 Energy: 1.4313867395875166 Energy: 1.458661740147949 Energy: 1.5150795038632667 Energy: 1.4754860509695606 Energy: 1.451744077462527 Energy: 1.356271861058235 Energy: 1.3437885265567564 Energy: 1.5122578919847987 Energy: 1.3262464394654148 Energy: 1.3452043031337495 Energy: 1.5434902506324633 Energy: 1.5006833525554162 Energy: 1.3509052199329112 Energy: 1.354903570883771 Energy: 1.3160847166375649 Energy: 1.3165500362733153 Energy: 1.4875793657708436 Energy: 1.4231107670790282 Energy: 1.3610440642819093 Energy: 1.4988744043044129 Energy: 1.3613114074643864 Energy: 1.3234724783369094 Energy: 1.3138794209869578 Energy: 1.31311166963107 Energy: 1.3125574743206994 Energy: 1.3688683755908548 Energy: 1.50364646448513 Energy: 1.4707792185190312 Energy: 1.4458956691224947 Energy: 1.4569389390341168 Energy: 1.3778545005974874 Energy: 1.2974791664460426 Energy: 1.2965642008362892 Energy: 1.3562505762268677 Energy: 1.356143753648091 Energy: 1.3376854972841439 Energy: 1.5515243690795497 Energy: 1.5662697858627581 Energy: 1.4041140469765347 Energy: 1.4349856331361859 Energy: 1.3597131755998813 Energy: 1.3829884992848314 Energy: 1.55521834539347 Energy: 1.3173646403288584 Energy: 1.5603814102491491 Energy: 1.3518822486168969 Energy: 1.379469085846203 Energy: 1.3588514992234564 Energy: 1.4246998320081214 Energy: 1.3380314111913147 Energy: 1.5563052514275089 Energy: 1.5473289427188073 Energy: 1.3820591102549624 Energy: 1.3589942188060213 Energy: 1.3243755120231249 Energy: 1.3154658820929581 Energy: 1.3414629649859107 Energy: 1.4278033260442655 Energy: 1.3781871744266643 Energy: 1.448267974711331 Energy: 1.396768569853185 Energy: 1.3786430924628403 Energy: 1.342631468485584 Energy: 1.3709690374431214 Energy: 1.3373930558067875 Energy: 1.3417022858075602 Energy: 1.3176117263693063 Energy: 1.4440842872385526 Energy: 1.4712711659302387 Energy: 1.410063413462846 Energy: 1.33698583174051 Energy: 1.4244572846741337 Energy: 1.3398978900695764 Energy: 1.335511649548618 Energy: 1.3775289549608294 Energy: 1.3828929213957155 Energy: 1.5234075228872153 Energy: 1.5240362837757275 Energy: 1.46212045172032 Energy: 1.4441004530576196 Energy: 1.3358145403175554 Energy: 1.3766543204086958 Energy: 1.3698501140444193 Energy: 1.3877848244429825 Energy: 1.4149844381657415 Energy: 1.40077667927155 Energy: 1.4470011005088539 Energy: 1.3252035057018947 Energy: 1.342610208867498 Energy: 1.4104286974820726 Energy: 1.400447012089006 Energy: 1.465150687598706 Energy: 1.4504286418702161 Energy: 1.4164378993124187 Energy: 1.3868840798132636 Energy: 1.37638164935695 Energy: 1.4420088799093225 Energy: 1.4651617902592586 Energy: 1.4081282256799672 Energy: 1.4703279333748238 Energy: 1.3437501163166397 Energy: 1.3581131710534153 Energy: 1.4420797769402562 Energy: 1.3563077362871263 Energy: 1.4156706957053122 Energy: 1.4193390124743632 Energy: 1.4581048985484393 Energy: 1.481611513693191 Energy: 1.3838550423964469 Energy: 1.46538533482219 Energy: 1.3618366488564555 Energy: 1.3675680100958292 Energy: 1.4737776647437268 Energy: 1.4174948547100663 Energy: 1.4113755185797572 Energy: 1.3648399113329852 Energy: 1.3668713838874116 Energy: 1.3509437757914602 Energy: 1.4416697309359099 Energy: 1.3644010844397096 Energy: 1.4429624106197503 Energy: 1.4146641716413886 Energy: 1.3229006919397481 Energy: 1.35225861828353 Energy: 1.3358789785733944 Energy: 1.3363773377229975 Energy: 1.3387529011532777 Energy: 1.3919050402934974 Energy: 1.469179749843963 Energy: 1.4275100222358643 Energy: 1.4099535598576562 Energy: 1.4335996966993299 Energy: 1.3627781813449644 Energy: 1.315011657780897 Energy: 1.331370719124426 Energy: 1.357384949727455 Energy: 1.382696710012262 Energy: 1.5528778356626765 Energy: 1.4697543752219286 Energy: 1.4058906623394993 Energy: 1.38413445050835 Energy: 1.3769557144712983 Energy: 1.3793040499164668 Energy: 1.3675039252508467 Energy: 1.3309302569989485 Energy: 1.3520646529917857 Energy: 1.544967914623707 Energy: 1.3826987662245602 Energy: 1.360847312835126 Energy: 1.3516945278409656 minimum gb energy = 1.2838185709821268 eV minimum distance = 2.25061420134715 Angstroms sigma value = 437 ======================================== theta = 117.03569178941231 ======================================== Energy: 1.600824674026611 Energy: 1.3388407681674082 Energy: 1.3470403793908443 Energy: 1.4016491178336639 Energy: 1.519884857680279 Energy: 1.4338748832207415 Energy: 1.438871343202487 Energy: 1.3560585993378311 Energy: 1.3536385350251268 Energy: 1.3450319431356854 Energy: 1.4809888405870004 Energy: 1.3437348452987705 Energy: 1.4432665828293598 Energy: 1.5846763150328655 Energy: 1.3565706445848469 Energy: 1.3099111470549183 Energy: 1.3266337737517708 Energy: 1.3443143662237178 Energy: 1.443794231382159 Energy: 1.6032127795205666 Energy: 1.5044622606837228 Energy: 1.372288904235847 Energy: 1.5956446435933995 Energy: 1.3975276131651997 Energy: 1.3375094874313906 Energy: 1.3415893950470543 Energy: 1.349048174059447 Energy: 1.3498739306350995 Energy: 1.394594887727865 Energy: 1.549845210402172 Energy: 1.4455709737130895 Energy: 1.3825755082525146 Energy: 1.5296498181142963 Energy: 1.3365570035838668 Energy: 1.343213712312582 Energy: 1.3468101213881698 Energy: 1.353861945607896 Energy: 1.3105005849754365 Energy: 1.5959502130207017 Energy: 1.5684360545954745 Energy: 1.3551195371013982 Energy: 1.5216343370788694 Energy: 1.353694245603892 Energy: 1.3117183924603912 Energy: 1.4626736772295836 Energy: 1.4533798835567486 Energy: 1.4534590970271886 Energy: 1.5078306241975676 Energy: 1.4995014863616782 Energy: 1.3584450943615323 Energy: 1.377355899956282 Energy: 1.5720702119258072 Energy: 1.372915204125159 Energy: 1.5061048342473344 Energy: 1.4410801395303277 Energy: 1.3501674598192799 Energy: 1.3523565995660922 Energy: 1.3675245339160844 Energy: 1.4761892614216083 Energy: 1.312926455185639 Energy: 1.288567285209695 Energy: 1.3828216360877428 Energy: 1.352159836216691 Energy: 1.3982385849826608 Energy: 1.442093390042712 Energy: 1.3342373988478329 Energy: 1.4566187325589637 Energy: 1.4534775000919995 Energy: 1.4399945929731768 Energy: 1.3464300018715085 Energy: 1.288246286617259 Energy: 1.3100761247957737 Energy: 1.3387941550420466 Energy: 1.4068602011105624 Energy: 1.4600762112871695 Energy: 1.4245152095284204 Energy: 1.3506681575146575 Energy: 1.3452458004788077 Energy: 1.3496517823360508 Energy: 1.2978102886699767 Energy: 1.4761332790448025 Energy: 1.3417906054309132 Energy: 1.440291415542257 Energy: 1.465710432833927 Energy: 1.3534712615853628 Energy: 1.3350145021778126 Energy: 1.322404552127764 Energy: 1.3233751924648482 Energy: 1.3971962412480365 Energy: 1.571973116593801 Energy: 1.436712723268153 Energy: 1.3746793508127924 Energy: 1.481144674970779 Energy: 1.3753558388904095 Energy: 1.3389740970761101 Energy: 1.3224015142573853 Energy: 1.3473166634909144 Energy: 1.3284525030158973 Energy: 1.3649472718171842 Energy: 1.5221156851001025 Energy: 1.3372354793835244 Energy: 1.3498896874076904 Energy: 1.585740595594803 Energy: 1.346523556054358 Energy: 1.3464559091952009 Energy: 1.3342821718983326 Energy: 1.421974196707827 Energy: 1.4636682402234458 Energy: 1.5568804665180906 Energy: 1.3372475193304671 Energy: 1.3475504540166499 Energy: 1.5427945395223488 Energy: 1.3285129440354517 Energy: 1.4515974830153742 Energy: 1.4471752021491326 Energy: 1.3576299540115335 Energy: 1.33737210863406 Energy: 1.4144158214316753 Energy: 1.4757615256932357 Energy: 1.3913205081997735 Energy: 1.3743743024349524 Energy: 1.6006695547489882 Energy: 1.3200347666441457 Energy: 1.4788740530259366 Energy: 1.4210506241417975 Energy: 1.332408069313548 Energy: 1.3542350248182642 Energy: 1.4479733842901947 Energy: 1.4383478217612262 Energy: 1.3441613939608956 Energy: 1.5642079338381891 Energy: 1.3336830379021785 Energy: 1.3539447822736932 Energy: 1.4016377676647056 Energy: 1.3485464060476744 Energy: 1.510757722625443 Energy: 1.4492823404310815 Energy: 1.3785218662832193 Energy: 1.3338976349528477 Energy: 1.2935475931474463 minimum gb energy = 1.288246286617259 eV minimum distance = 2.24965504103552 Angstroms sigma value = 33