Model name: model_name=EAM_Dynamo_NormanStarikovStegailov_2012_Au__MO_592431957881_001 a1: a1=[1, 1, -1] a2: a2=[-1, 1, 0] a3: a3=[1, 1, 2] Species: species=Au Lattice type: short_name=fcc Lattice constant (meters) and cohesive energy (J): a=4.068500682711602 cohesive_energy=4.299700974521185 mass=196.9665 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=[9.58971609044262e-20, 9.76613175961236e-20, 1.4088371730453179e-19, 1.8959357198438997e-19, 2.4160663423056595e-19, 3.0183405607925996e-19, 3.6785975516639994e-19, 4.3243228004650197e-19, 4.87060094559366e-19, 5.2923899662605e-19, 5.60298792852774e-19, 5.832291448385819e-19, 6.0181759814625e-19, 6.17937097260924e-19, 6.319817776345679e-19, 6.44196772292184e-19, 6.547855576662899e-19, 6.638634904745339e-19, 6.71478636015936e-19, 6.7769668353249e-19, 6.8254326785034e-19, 6.860263998526559e-19, 6.88130057773098e-19, 6.88833413315424e-19, 6.880419380582279e-19, 6.854175727317359e-19, 6.8052292311486595e-19, 6.728324752716659e-19, 6.6195209375017185e-19, 6.47304994962144e-19, 6.2819743642506e-19, 6.039324713031299e-19, 5.738003353474919e-19, 5.366602787947379e-19, 4.90943770720182e-19, 4.34787479698482e-19, 3.6551416857422396e-19, 2.7989064489999596e-19, 1.74606811749954e-19, 4.585317374143619e-20, -1.1396859181230238e-19, -3.141868379274e-19, -5.65933648074552e-19, -8.85582306147258e-19, -1.3019719915575178e-18, -1.8601110503076597e-18, -2.6251183495099795e-18, -3.6775080715528794e-18, -5.14676813199624e-18, -7.23946716426168e-18, -1.0164048348432599e-17, -1.412595879428682e-17, -1.90902550294368e-17, -2.15234806834926e-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: 0.014812815399981177 Energy: 11.016442735969036 Energy: 32.68058101580435 Energy: 32.68069623605355 Energy: 0.017120567079773455 Energy: 0.016071660312532942 Energy: 11.01697064617296 Energy: 32.68436330637292 Energy: 32.68127472646407 Energy: 0.016705071255912578 Energy: 11.017372876544073 Energy: 11.01490229564674 Energy: 11.019226080364685 Energy: 0.09114863652340785 Energy: 11.014250517119939 Energy: 11.01439164981563 Energy: 11.015501641114138 Energy: 11.019249249746235 Energy: 0.09143598047830236 Energy: 11.014664737395478 Energy: 0.09184503997458295 Energy: 0.017126880363261168 Energy: 0.015358945672637691 Energy: 11.015897270430745 Energy: 32.683455598425084 Energy: 11.01367889131873 Energy: 0.01663947670373353 Energy: 0.015275722357236272 Energy: 11.016504211214931 Energy: 32.683271564752665 Energy: 0.09054391498776868 Energy: 0.015944089616138944 Energy: 0.0156533495690622 Energy: 11.013864718809767 Energy: 0.09066143394756121 Energy: 0.09078645683822628 Energy: 0.0161217784940077 Energy: 0.015434542529761048 Energy: 0.08944280823953778 Energy: 0.0903772829786419 Energy: 0.09064915237773404 Energy: 32.681576842571836 Energy: 11.013733205176084 Energy: 0.015914087383858723 Energy: 0.015534199038791226 Energy: 0.09022625941306897 Energy: 0.09157412135381728 Energy: 11.01405642771159 Energy: 0.01653876551797684 Energy: 11.013473938038796 Energy: 0.09132960411297857 Energy: 32.6862171413533 Energy: 11.015132658406689 Energy: 0.0159589560249376 Energy: 0.017656874407433677 Energy: 0.08990189248151431 Energy: 32.68793184566747 Energy: 11.014667784910948 Energy: 0.015700277220517672 Energy: 0.01801945835663064 Energy: 0.018547350010266608 Energy: 11.013921020950976 Energy: 0.09073270842303151 Energy: 11.01403758798147 Energy: 11.014397919359633 Energy: 0.01844438808204468 Energy: 11.013459419545088 Energy: 0.09070552298338742 Energy: 11.013854515917314 Energy: 11.014762970716017 minimum gb energy = 0.014812815399981177 eV minimum distance = 0.00374069319582144 Angstroms sigma value = 3 ======================================== theta = 23.07391806563098 ======================================== Energy: 0.9962701432322819 Energy: 9.376664649750978 Energy: 7.4431465378249735 Energy: 7.443474365519304 Energy: 7.623650545931576 Energy: 0.7265916280142615 Energy: 8.505470799730993 Energy: 7.447821795721374 Energy: 7.443055511351635 Energy: 7.6116349315838825 Energy: 9.414290563802144 Energy: 5.943972814887584 Energy: 5.873254112003847 Energy: 0.7152491465099996 Energy: 1.4644066838003584 Energy: 8.504304174432692 Energy: 6.033106459322827 Energy: 5.870908169372682 Energy: 0.6985285610374624 Energy: 2.360837304907512 Energy: 2.362824237672346 Energy: 7.577364177192805 Energy: 7.581270529122707 Energy: 7.644055031040614 Energy: 2.3547300229047803 Energy: 2.341363525497159 Energy: 7.5835287554515185 Energy: 7.583548211258914 Energy: 7.648456403028997 Energy: 2.374395341485026 Energy: 2.3575819094821373 Energy: 5.8599201593953625 Energy: 0.7035697110090569 Energy: 2.3474146159700187 Energy: 2.351198721061112 Energy: 2.3419264316175705 Energy: 5.868441717461979 Energy: 0.7192704142737062 Energy: 2.348730352806582 Energy: 2.3743596344186697 Energy: 2.469720988700188 Energy: 0.7080259538480776 Energy: 2.4612037284602177 Energy: 5.888648199651953 Energy: 5.877531050722991 Energy: 2.4452385173039874 Energy: 0.6779791557802359 Energy: 0.7375600216686709 Energy: 5.878486341881316 Energy: 5.86759039490608 Energy: 0.7395782679120887 Energy: 7.484874745176146 Energy: 2.4672468170088875 Energy: 5.889291799829527 Energy: 5.878866133599624 Energy: 0.7055362122869099 Energy: 7.4866256901570605 Energy: 2.9235748350296142 Energy: 5.878973944465388 Energy: 5.865888589012967 Energy: 2.5374953777014437 Energy: 2.445097670167986 Energy: 8.555449922135956 Energy: 8.504358582375016 Energy: 0.7420204217859433 Energy: 2.446406333231859 Energy: 2.450143352090757 Energy: 8.098435499731005 Energy: 8.064348395299767 Energy: 0.7509949280492453 Energy: 7.443722563685516 Energy: 1.5851838124432556 Energy: 7.697151307096124 Energy: 7.630973200215339 Energy: 1.6093915100104461 Energy: 7.442616228427639 Energy: 1.1579742403843434 Energy: 0.7367322969020126 Energy: 7.62239324679241 Energy: 0.7321092022718889 Energy: 2.423482423624727 Energy: 0.6831157818738264 Energy: 8.502834144898095 Energy: 8.549533395252363 Energy: 5.855317439849585 Energy: 2.4233764926808976 Energy: 0.6788968451128703 Energy: 7.623810825372479 Energy: 8.083902095775711 Energy: 5.867728157997515 Energy: 0.7404749919152126 Energy: 2.356918008261147 Energy: 2.3624971597863293 Energy: 5.922684322702454 Energy: 7.580008369475137 Energy: 5.856975764546413 Energy: 2.353443091462777 Energy: 2.349353336697568 Energy: 5.974657579718358 Energy: 7.580253198386632 Energy: 5.960425513544616 Energy: 2.3562693118608657 Energy: 2.359882332079858 Energy: 5.864896042455375 Energy: 7.586125559417219 Energy: 5.938220689246911 Energy: 2.3487645402780117 Energy: 2.3548244982176163 Energy: 5.857916807432522 Energy: 7.586148925502089 Energy: 5.887633178445579 Energy: 5.890604950555549 Energy: 0.7962905310530624 Energy: 2.451825170822823 Energy: 2.435711555431797 Energy: 5.885559887461875 Energy: 5.892418691243446 Energy: 2.4757557154923457 Energy: 2.45182288098863 Energy: 2.4459753369796915 Energy: 5.880799668400729 Energy: 5.8860391959389 Energy: 7.6358905518885285 Energy: 7.487277643549455 Energy: 0.7432479843624018 Energy: 5.879667693220366 Energy: 5.887317022860095 Energy: 2.4435143840620506 Energy: 7.484852488324085 Energy: 0.7369470648843922 Energy: 8.497906838284683 Energy: 1.5296909784716042 Energy: 0.74657485763814 Energy: 2.438320757779171 Energy: 2.4804408135626463 Energy: 8.505293055695352 Energy: 0.6665910860538069 Energy: 0.7451751885988709 Energy: 2.4546938929146167 Energy: 2.485014262046894 Energy: 0.733204416296467 Energy: 8.496889735289145 Energy: 7.443018885617217 Energy: 7.442149256380366 Energy: 7.622167493966376 Energy: 0.7259474459548162 Energy: 8.50534607798657 Energy: 7.445669092452989 Energy: 5.802927295332772 Energy: 7.621501701727828 Energy: 7.621658050396868 Energy: 1.5923156633136477 Energy: 5.8614109693876895 Energy: 0.748018788998982 Energy: 8.50300064040892 Energy: 7.639198876924329 Energy: 1.5924990536143067 Energy: 7.634537498153125 Energy: 0.7493042686492712 Energy: 8.495720629751188 Energy: 2.3612910759910575 Energy: 0.7310107316314077 Energy: 7.58422905506227 Energy: 5.869951677092617 Energy: 2.358898548680046 Energy: 2.361628682351429 Energy: 7.585611253955885 Energy: 7.5759776228672235 Energy: 2.3617047049602955 Energy: 2.3585585442368227 Energy: 2.356096863833451 Energy: 0.603950615748259 Energy: 7.585989514991216 Energy: 7.722147212447793 Energy: 0.6343834212296992 Energy: 2.3490257787406708 Energy: 0.6033786931035958 Energy: 0.6315516048763123 Energy: 2.354530441231124 Energy: 0.6544078398243801 Energy: 2.481043096696662 Energy: 2.450224928248727 Energy: 0.729439740879746 Energy: 5.8831588499822285 Energy: 5.873640261331065 Energy: 2.468446957262447 Energy: 2.444026140078953 Energy: 0.7689631712588509 Energy: 5.890504727225459 Energy: 5.883497241402089 Energy: 0.7383925603986636 Energy: 7.484306657527225 Energy: 2.4506065381100086 Energy: 5.879937067576141 Energy: 5.87485686628832 Energy: 7.48401741645287 Energy: 7.485833329145076 Energy: 7.6646319319032505 Energy: 0.7100195266875461 Energy: 5.882073455840925 Energy: 2.5387859421685786 Energy: 2.54568177488521 Energy: 1.1743222130249507 Energy: 1.050236425607309 Energy: 0.7665579179389943 Energy: 2.535979934339486 Energy: 2.449291006792544 Energy: 8.536999922088269 Energy: 1.5275981214213918 Energy: 0.776623597619277 Energy: 7.443773829587616 Energy: 1.1585414764558921 Energy: 7.666028305099764 Energy: 7.6219881499148 Energy: 1.1677529658095442 Energy: 7.442677538972173 Energy: 1.585400904477874 Energy: 7.6971047434730995 Energy: 7.6209077704925585 Energy: 0.7343829709897012 Energy: 2.4195738376125977 Energy: 0.7448052831665514 Energy: 7.623485300454864 Energy: 7.673560493947665 Energy: 5.873152102183054 Energy: 2.422149335904098 Energy: 1.62720028714974 Energy: 7.621734820371981 Energy: 8.536602285203887 Energy: 5.861373788494812 Energy: 5.855796639996835 Energy: 2.3531138131977154 Energy: 2.3508335061444448 Energy: 5.95909647310635 Energy: 7.583403961705692 Energy: 5.855473356068639 Energy: 2.365189709023304 Energy: 2.3581887991420287 Energy: 5.907910493397648 Energy: 7.581952526595042 Energy: 5.952313633259008 Energy: 2.3406298581973113 Energy: 2.3479268062502587 Energy: 5.8631428620203 Energy: 7.5821216014464445 Energy: 5.921438648036701 Energy: 2.355097789505151 Energy: 2.3614579476969815 Energy: 5.855820954658517 Energy: 7.581661267435702 Energy: 5.8834194167949345 Energy: 5.9043768380296315 Energy: 0.6225599194095629 Energy: 2.451923993958228 Energy: 2.452004857802757 Energy: 5.864805448465512 Energy: 5.884268349396156 Energy: 0.7045682755827821 Energy: 2.4427470653595633 Energy: 2.444738386076785 Energy: 5.899842937341062 Energy: 0.7154925288938833 Energy: 7.659460894910902 Energy: 7.485846689839878 Energy: 0.7384731803881112 Energy: 5.868854245298679 Energy: 5.884034968762825 Energy: 2.4614013686816687 Energy: 7.484348287064495 Energy: 0.7380219121546265 Energy: 2.4266820677463192 Energy: 0.6108274145847116 Energy: 0.7147275819212003 Energy: 2.4532128319813338 Energy: 2.48526800758706 Energy: 1.468265421311556 Energy: 0.6165474259034891 Energy: 0.6967412823709623 Energy: 2.440895156405059 Energy: 2.4626351266849515 Energy: 0.7132065149877819 Energy: 9.376334671484152 Energy: 7.445450684070946 Energy: 5.808866214635713 Energy: 7.624196729133979 Energy: 0.7004595211482222 Energy: 8.505021810744589 Energy: 7.446543492724899 Energy: 5.806529837836223 Energy: 7.645925649027624 minimum gb energy = 0.6033786931035958 eV minimum distance = 0.000579223369299532 Angstroms sigma value = 75 ======================================== theta = 34.04773236999154 ======================================== Energy: 10.687993245252576 Energy: 3.4553974927004787 Energy: 11.047303454592852 Energy: 11.046988742998607 Energy: 0.6655880214373713 Energy: 10.638078260378501 Energy: 2.3770783171225616 Energy: 11.04714413891966 Energy: 11.047052753358326 Energy: 0.7480345583965503 Energy: 3.5151423092374436 Energy: 8.64047766764278 Energy: 11.365041260841602 Energy: 0.7200045862662822 Energy: 2.4023908566923877 Energy: 2.4071942363769385 Energy: 8.626002301889597 Energy: 11.357560577489808 Energy: 0.7285731526784655 Energy: 3.457140366564694 Energy: 3.4325297385674407 Energy: 0.6769426483730752 Energy: 0.7147951740643664 Energy: 11.421855318383686 Energy: 0.7059094840668942 Energy: 3.4196649817774816 Energy: 0.7177705387823243 Energy: 0.7069275486577777 Energy: 3.4184203018760937 Energy: 0.6978183423495796 Energy: 3.427716289412567 Energy: 8.6189433352353 Energy: 8.64022742646314 Energy: 3.418795754376561 Energy: 0.7120667220996282 Energy: 3.419046266916179 Energy: 8.615550061046799 Energy: 8.634779582789493 Energy: 3.4254374554822955 Energy: 0.7120728307231692 Energy: 2.1848023125888987 Energy: 0.6786768563924331 Energy: 2.2039627633693617 Energy: 8.413712502349984 Energy: 3.4216630877398133 Energy: 2.390272408658693 Energy: 0.6757295769491994 Energy: 2.4890220734792865 Energy: 8.410398318964386 Energy: 3.4246284464052597 Energy: 0.6689962973295573 Energy: 10.635687825066478 Energy: 2.1859892403490644 Energy: 11.041145516739608 Energy: 3.4413138790611724 Energy: 10.642622598418805 Energy: 10.645842250412905 Energy: 2.381210778985981 Energy: 11.046590308002777 Energy: 0.7232025601580506 Energy: 2.2230953606781347 Energy: 2.2041206700648823 Energy: 8.631803600138928 Energy: 8.618742925576381 Energy: 0.6902033642507538 Energy: 2.407180043624333 Energy: 2.4463452106722987 Energy: 8.63069025942513 Energy: 11.370395062477028 Energy: 0.7099302548122451 Energy: 0.711055658992818 Energy: 3.4260985526736407 Energy: 0.806081154241752 Energy: 0.7996752835629379 Energy: 3.423672051764734 Energy: 0.6940236211199318 Energy: 11.462813590260982 Energy: 0.7263277358577357 Energy: 0.7995732690700154 Energy: 3.427186063174777 Energy: 0.7106768566506982 Energy: 3.4291392376920835 Energy: 8.625046315498377 Energy: 8.639582797064861 Energy: 3.4298646135790745 Energy: 0.7068593050361671 Energy: 3.428416981779475 Energy: 8.630570847120055 Energy: 8.646785012235286 Energy: 3.4259400923495167 Energy: 0.7162635737423623 Energy: 0.6750977590680433 Energy: 10.616686429312079 Energy: 1.8613433214148813 Energy: 8.386193896854863 Energy: 0.7173527764210498 Energy: 0.6720460387052417 Energy: 0.6666294676867277 Energy: 0.7905415019006661 Energy: 8.386117220442703 Energy: 0.7145218657348587 Energy: 10.615952322454966 Energy: 10.615914199876638 Energy: 1.7644823721223515 Energy: 11.044396059982422 Energy: 0.708628095400357 Energy: 10.612039183734131 Energy: 10.612370666446635 Energy: 1.7474247084941499 Energy: 11.04075215419978 Energy: 0.7006074381739811 Energy: 3.4310894721686003 Energy: 1.7956275023729722 Energy: 8.640379216505965 Energy: 8.650000089709334 Energy: 0.6996452636859259 Energy: 3.4389143472969437 Energy: 1.803781035574958 Energy: 8.646502546585905 Energy: 8.646210526732519 Energy: 3.4197523017070246 Energy: 0.6949707445040838 Energy: 11.468788908058992 Energy: 0.7156445552711573 Energy: 8.647413580992268 Energy: 3.4312422248419745 Energy: 0.6943290018521259 Energy: 11.481370604255456 Energy: 0.704532673450112 Energy: 8.650171463813864 Energy: 3.43152021129565 Energy: 3.425881230047042 Energy: 3.4176694827388037 Energy: 8.648810758786121 Energy: 8.662377039879532 Energy: 3.4319763882179934 Energy: 3.4322915678389894 Energy: 2.0041449442517965 Energy: 8.642162766602272 Energy: 8.642490913453567 Energy: 8.385448760025216 Energy: 2.3926797916593494 Energy: 10.64203059202048 Energy: 10.6422436142043 Energy: 0.7884587296811373 Energy: 8.384034001285654 Energy: 1.9663489739977966 Energy: 10.620698160761203 Energy: 0.6792230982941917 Energy: 0.7928276764053291 Energy: 3.4258030341007957 Energy: 2.4145881901649897 Energy: 10.642334177453424 Energy: 10.642244912215212 Energy: 0.7071134941479673 Energy: 3.4452677810556875 Energy: 1.9634366158407628 Energy: 10.621264731522507 Energy: 0.6794015807294542 Energy: 0.7075754470266689 Energy: 8.635868630568137 Energy: 3.4410362220460975 Energy: 3.4394542836776703 Energy: 8.639722837756482 Energy: 0.7002925039919832 Energy: 8.639942736549543 Energy: 3.4354936390073667 Energy: 3.4272080157729405 Energy: 8.644241642424921 Energy: 0.6976503686037275 Energy: 8.642908424984896 Energy: 0.71403591499515 Energy: 0.7127782432184859 Energy: 11.483748766641652 Energy: 0.706980533002923 Energy: 8.636726977337895 Energy: 0.7094698557714195 Energy: 0.7067084364501912 Energy: 8.637346337495494 Energy: 0.7155733373815779 Energy: 0.6979973028923314 Energy: 3.4348322269645517 Energy: 3.440019575759894 Energy: 2.6626284401343874 Energy: 8.630086505851583 Energy: 0.7251953958768568 Energy: 3.4332803266390353 Energy: 3.4289905807233243 Energy: 2.455926502920513 Energy: 8.626376030136884 Energy: 0.751538568963365 Energy: 11.0425110860589 Energy: 2.6087190913661256 Energy: 10.651328306613015 Energy: 0.6712196150231318 Energy: 8.418387422500846 Energy: 8.81686125058191 Energy: 2.395893794501267 Energy: 10.642471869517154 Energy: 0.666681102211835 Energy: 0.6629362762979053 Energy: 3.4380099832768356 Energy: 2.617970498309943 Energy: 10.647196428703221 Energy: 0.6728677136890644 Energy: 3.422295159474198 Energy: 3.4583879785485943 Energy: 2.3947564488745603 Energy: 10.639074641897516 Energy: 2.3971985592647904 Energy: 0.7012660313495414 Energy: 8.627399637829757 Energy: 3.441053455494771 Energy: 3.4260673829970325 Energy: 8.634704589707667 Energy: 0.6983185753801291 Energy: 8.640585531181902 Energy: 3.439288402448264 Energy: 3.4304250189961576 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6.272144951107571 Energy: 4.42833821104419 Energy: 4.611867707191707 Energy: 3.126512790061376 Energy: 0.6999882918267646 Energy: 4.454534693101225 Energy: 1.6633295621932394 Energy: 6.112479160450758 Energy: 3.1092787697661466 Energy: 0.696004567791737 Energy: 4.457457439387406 Energy: 1.6651927937061792 Energy: 3.5846956671116077 Energy: 7.545071932563929 Energy: 3.0081337513395554 Energy: 3.00835101201707 Energy: 9.434523611925176 Energy: 3.5726452928409835 Energy: 7.059432741455123 Energy: 3.0081905367429664 Energy: 3.0085985375454984 Energy: 6.474911582754889 minimum gb energy = 0.6913542430524421 eV minimum distance = 9.93739962173631e-05 Angstroms sigma value = 165 ======================================== theta = 44.41530859719298 ======================================== Energy: 0.858008542893463 Energy: 10.572174706307266 Energy: 10.327301143004805 Energy: 10.326877765307128 Energy: 7.264632953259374 Energy: 0.8570321229955316 Energy: 10.572387408589643 Energy: 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Energy: 0.6598161995948777 Energy: 7.172105405113001 Energy: 7.362646250029445 Energy: 3.847382058575322 Energy: 3.846699022253105 Energy: 7.1726404706081075 Energy: 7.172162524254302 Energy: 7.362789421354264 Energy: 3.8470165142004293 Energy: 3.8462300167629797 Energy: 7.362803050440005 Energy: 7.170837107839565 Energy: 10.573857819514643 Energy: 0.6366801684770845 Energy: 3.845702190271812 Energy: 7.363464093006999 Energy: 7.187910369620022 Energy: 10.573920829439931 Energy: 0.6358302297947422 Energy: 3.8456169873173147 Energy: 7.260556981188034 Energy: 4.055393716890762 Energy: 7.167621380353642 Energy: 10.333151330538822 Energy: 3.952754041618374 Energy: 7.259709528783964 Energy: 4.0559094296711695 Energy: 7.167857910523123 Energy: 10.333202244832641 Energy: 10.540553643328998 minimum gb energy = 0.6357410945760552 eV minimum distance = 0.00305182226395739 Angstroms sigma value = 41 ======================================== theta = 52.20027756457278 ======================================== Energy: 8.320684292386922 Energy: 9.218127646860845 Energy: 4.327865208844837 Energy: 4.3283852339535045 Energy: 8.178224620085123 Energy: 8.252148915131574 Energy: 8.178160688581157 Energy: 4.326623522829354 Energy: 4.325807880986203 Energy: 4.481865835879858 Energy: 9.191504830816701 Energy: 5.426359438554083 Energy: 4.391811144249482 Energy: 1.5104297994546678 Energy: 4.501033223063052 Energy: 8.177941858415455 Energy: 0.5642396573633055 Energy: 4.382227664527172 Energy: 1.5551315591388133 Energy: 5.487104261706529 Energy: 5.446817792218272 Energy: 3.4748108251027254 Energy: 3.476892516814894 Energy: 5.395709883435087 Energy: 8.244759881073973 Energy: 5.46931965313522 Energy: 3.4777965606955252 Energy: 3.475275046494028 Energy: 5.395473018070052 Energy: 8.23719095189529 Energy: 8.232461125669683 Energy: 3.4630769573709173 Energy: 3.4593208901675014 Energy: 5.477951903755712 Energy: 4.502002556342099 Energy: 4.489396484371083 Energy: 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Energy: 6.2139887302129235 Energy: 3.037509001619673 Energy: 3.0076254774517603 Energy: 0.5351408796734819 Energy: 3.6427322994925575 Energy: 6.164055862564184 Energy: 4.809597200158258 Energy: 4.809197712514427 Energy: 6.218197324180902 Energy: 5.582845065742191 Energy: 6.1619732030539325 Energy: 4.807408871691866 Energy: 4.807094227133661 Energy: 6.221831071231858 Energy: 5.586491538053066 Energy: 5.517249585064748 Energy: 0.5390223771737155 Energy: 3.018681181533859 Energy: 6.16065175186823 Energy: 5.644715280628749 Energy: 8.04039760002751 Energy: 3.0139339658334534 Energy: 3.0210298300767136 Energy: 8.67909499757503 Energy: 5.481469980305859 Energy: 5.550002677837952 Energy: 2.966120661704791 Energy: 1.146664669241915 Energy: 3.296781253650206 Energy: 6.246221201898722 Energy: 2.9880225209963256 Energy: 2.9683956293738905 Energy: 1.149078609251825 Energy: 3.517564277444949 Energy: 6.243352291049632 Energy: 2.3449833117387855 Energy: 4.872081008263982 Energy: 5.845320210071579 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Energy: 5.4462184040012405 Energy: 7.439893081552606 Energy: 5.528229777430385 Energy: 4.897447281098661 Energy: 1.1633465738020965 Energy: 1.1706338486036132 Energy: 7.438610607689223 Energy: 5.546551446683526 Energy: 2.4284850977311065 Energy: 1.1600976633568374 Energy: 1.1791226199809004 Energy: 7.424007822573075 Energy: 5.503971881047268 Energy: 5.517838711025735 Energy: 5.477337187206155 Energy: 6.106833107948426 Energy: 5.539591801262873 Energy: 3.058187649642065 Energy: 3.097427868821004 Energy: 5.483642933189729 Energy: 3.6508059916089546 Energy: 2.425230751441151 Energy: 2.430981817993389 Energy: 1.1721455440014017 Energy: 5.478425222021892 Energy: 3.6497881779366166 Energy: 2.42683610186881 Energy: 2.4316168876247155 Energy: 1.1716699308123375 Energy: 5.477850941330132 Energy: 3.6481417860422662 Energy: 5.56065058335763 Energy: 4.870598230056276 Energy: 3.6509359804888404 Energy: 3.6418443556169087 Energy: 4.912075222930482 Energy: 5.562118121472951 Energy: 4.907113493284803 Energy: 3.6703140062019437 Energy: 3.6408784903940723 Energy: 4.891305822823238 Energy: 5.535806685885031 Energy: 3.02935046017735 Energy: 5.47610331597218 Energy: 3.03692335785754 Energy: 4.907084811436021 Energy: 5.535384853856329 Energy: 3.03474734257705 Energy: 5.476100564658241 Energy: 5.519074491816211 Energy: 4.876624512833186 Energy: 2.428664947802869 Energy: 0.5360518778804686 Energy: 6.1485104238704205 Energy: 3.6512000609259876 Energy: 4.906620838281567 Energy: 0.5346734439715691 Energy: 0.5343599303512714 Energy: 6.124064590571967 Energy: 3.649002491650833 Energy: 4.904520154982054 Energy: 4.879444252084571 Energy: 6.213479685827073 Energy: 5.51922185788817 Energy: 2.403780032928842 Energy: 5.424668757062689 Energy: 4.879974827599839 Energy: 6.2128328633702585 Energy: 5.518855278168747 Energy: 4.8491572853686495 Energy: 5.424136519337236 Energy: 2.4066460303130204 Energy: 5.519279735092428 Energy: 5.5196419285251705 Energy: 3.641087576891127 Energy: 4.9134090771142285 Energy: 0.5467727072983224 Energy: 5.521030897402433 Energy: 5.51949058243707 Energy: 1.1758389037700034 Energy: 4.910139147572996 Energy: 0.5317186761594361 Energy: 3.641852781835129 Energy: 3.6807074796413564 Energy: 4.81255828980027 Energy: 3.0234154110030302 Energy: 0.535673581591623 Energy: 3.6422734608566767 Energy: 3.6519939706264744 Energy: 4.805348741057706 Energy: 3.0358288121909442 Energy: 8.085713905323248 Energy: 3.013916150478204 Energy: 6.165859497061985 Energy: 4.81182601988863 Energy: 4.811837560996115 Energy: 8.094007049516511 Energy: 5.518021869944935 Energy: 5.565760086348404 Energy: 4.809610596115307 Energy: 2.374728965116827 Energy: 8.040416038884329 Energy: 3.039524558189894 Energy: 6.283456616072036 Energy: 1.141584427521257 Energy: 1.1424098042400435 Energy: 8.0403911804534 Energy: 5.56565800912938 Energy: 3.7589280912117267 Energy: 1.1573743857479117 Energy: 0.5373645181019144 Energy: 8.77050128891851 Energy: 1.168148854405999 Energy: 2.3466523191146775 Energy: 2.9636669887829257 Energy: 3.0331912843189133 Energy: 8.084237410117481 Energy: 1.1637143804159416 Energy: 2.3376855011945423 Energy: 2.9635868504154184 Energy: 3.697872720703685 Energy: 5.528443684598196 Energy: 8.703887792815916 Energy: 2.3478753634352216 Energy: 2.3474247319885397 Energy: 5.514789711620011 Energy: 5.5095617540256 Energy: 8.048802175160137 Energy: 2.3379393422111323 Energy: 2.3382354956725675 Energy: 8.054449388113197 minimum gb energy = 0.5249485582327619 eV minimum distance = 8.20688023871182e-07 Angstroms sigma value = 219 ======================================== theta = 78.46304096718453 ======================================== Energy: 6.011229794265484 Energy: 8.886821347825542 Energy: 8.748665848709882 Energy: 8.748436346834646 Energy: 6.1090180406725025 Energy: 6.011868236023616 Energy: 8.886070368673293 Energy: 8.74915463974488 Energy: 8.748309429437938 Energy: 6.109008326990377 Energy: 9.049799350534691 Energy: 3.4842924861504567 Energy: 3.3850907091619153 Energy: 3.386481388821027 Energy: 8.89885533648788 Energy: 8.995713861070392 Energy: 3.4340853434463723 Energy: 3.385417155029449 Energy: 3.386293532378492 Energy: 8.89911790388621 Energy: 11.603137677025227 Energy: 0.6777553965600244 Energy: 6.1450260963169745 Energy: 6.205401932467671 Energy: 6.149320373735698 Energy: 6.179742768065347 Energy: 0.6782907087542244 Energy: 6.143300583282987 Energy: 6.13378916765622 Energy: 6.148117723286139 Energy: 6.064750020039143 Energy: 3.3404027500986633 Energy: 3.3417456215377825 Energy: 6.178003082953945 Energy: 6.068293665788355 Energy: 11.602852705196467 Energy: 3.3406017449106873 Energy: 3.3400148585061413 Energy: 11.602661245949848 Energy: 6.14815496829601 Energy: 0.6759433801949483 Energy: 3.341800863504175 Energy: 6.082553968900346 Energy: 0.6766277622025134 Energy: 6.2613647210037335 Energy: 0.6765281221820619 Energy: 0.6666221042543711 Energy: 0.6635831630612695 Energy: 6.149804727179945 Energy: 6.200238436472894 Energy: 3.465126805539377 Energy: 3.4444995247032115 Energy: 6.065566436452 Energy: 6.047642271619042 Energy: 6.065954464624903 Energy: 3.4631929586844055 Energy: 3.412293702652792 Energy: 6.065956813493193 Energy: 6.04755379298654 Energy: 6.066017660878703 Energy: 6.0113971686292595 Energy: 6.011098965955575 Energy: 3.3964725564419287 Energy: 6.0707485158832375 Energy: 6.0665449836326975 Energy: 6.011335810187255 Energy: 6.0112755194428 Energy: 8.920359375846838 Energy: 0.6740005345312671 Energy: 6.066343689164937 Energy: 8.775786703036006 Energy: 6.011681954313401 Energy: 3.4088898331272603 Energy: 3.443424701309487 Energy: 0.6754961153863099 Energy: 8.775431206130106 Energy: 6.011996773705362 Energy: 8.909150120199584 Energy: 3.4432268731007896 Energy: 0.6762112397594529 Energy: 6.243311926446693 Energy: 8.899023401965291 Energy: 6.048522583881328 Energy: 6.048865197484752 Energy: 8.989388004736066 Energy: 6.2437602379534045 Energy: 3.4498666382985324 Energy: 6.048341657557042 Energy: 6.049218985841331 Energy: 8.989407714512296 minimum gb energy = 0.6635831630612695 eV minimum distance = 0.00126567819777064 Angstroms sigma value = 15 ======================================== theta = 88.83061719438597 ======================================== Energy: 3.962140409873085 Energy: 8.078109985849903 Energy: 4.794890814640223 Energy: 4.796404196505439 Energy: 6.730393066830503 Energy: 3.7385245862382024 Energy: 7.828826131344944 Energy: 4.792808801781083 Energy: 4.800145740331537 Energy: 6.749540940474763 Energy: 8.166661806159734 Energy: 5.2367684768796865 Energy: 4.991416996995775 Energy: 4.989862763984885 Energy: 4.791037348113652 Energy: 7.9185317573026754 Energy: 4.971444802511329 Energy: 4.994310403900674 Energy: 4.99381530838616 Energy: 8.105071264544792 Energy: 6.485288032033726 Energy: 0.8196059547377132 Energy: 2.0172091226414923 Energy: 4.803322836927947 Energy: 6.718750118622449 Energy: 6.48273436754967 Energy: 0.7799542390860063 Energy: 2.027195886026498 Energy: 6.487686446578839 Energy: 6.717817204261901 Energy: 6.483259172147161 Energy: 6.728239958988486 Energy: 6.751995915683415 Energy: 7.792009495360998 Energy: 6.713641692604852 Energy: 6.480690906236036 Energy: 6.747976287939222 Energy: 6.753185576616612 Energy: 6.482588117744184 Energy: 6.71268993326828 Energy: 0.7832032394554571 Energy: 6.738008099323167 Energy: 3.781785589400194 Energy: 2.047072061882582 Energy: 4.8152158139247465 Energy: 0.7815543200268927 Energy: 6.750583870069381 Energy: 6.749256272937536 Energy: 0.796039698192589 Energy: 4.8108546765773825 Energy: 3.6035169190977174 Energy: 8.003755465632413 Energy: 2.082938976540296 Energy: 3.493197618273561 Energy: 4.760255625924775 Energy: 3.616310758263482 Energy: 7.839173733219111 Energy: 2.096747630193344 Energy: 3.492019262655292 Energy: 4.760757531182765 Energy: 6.782092695443488 Energy: 6.746518027356518 Energy: 6.570349584117995 Energy: 4.748757743343379 Energy: 0.7946551104194227 Energy: 3.767724471078562 Energy: 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0.804808639322718 Energy: 4.7881805884957185 Energy: 5.09907421240019 Energy: 6.743071862970444 Energy: 6.7500686478454455 Energy: 0.803973700406581 Energy: 2.014420160659586 Energy: 0.7960324955110432 Energy: 8.019740830692932 Energy: 5.042513074345442 Energy: 4.761177805973605 Energy: 2.017065894486077 Energy: 0.7870991171842888 Energy: 8.020630506259216 Energy: 5.031253030393344 Energy: 4.758866919898521 Energy: 0.7710965154107434 Energy: 6.735748824835548 Energy: 6.754438303548389 Energy: 3.562640587396509 Energy: 3.512443900934292 Energy: 0.7714027388823976 Energy: 6.7600033314506005 Energy: 6.756930589004179 Energy: 0.7911410278463777 Energy: 3.5139477378404598 Energy: 4.999652716172051 Energy: 6.745884170498363 Energy: 6.754568201558583 Energy: 4.844893435538053 Energy: 6.698746373273768 Energy: 4.998186135721157 Energy: 6.755788577038039 Energy: 6.755401360557155 Energy: 5.000627458947984 Energy: 6.698084272929222 Energy: 5.000764008281083 Energy: 3.5017479062955466 Energy: 3.5926537548057396 Energy: 4.997655761680332 Energy: 6.697638770371278 Energy: 5.002599628101231 Energy: 0.7815488797644318 Energy: 0.786063651281778 Energy: 5.015514305270979 Energy: 6.697641664545131 Energy: 3.5146887388094474 Energy: 6.456288843292086 Energy: 1.7867827178320397 Energy: 7.831986867370649 Energy: 4.750084204550235 Energy: 3.5114795334210056 Energy: 6.458278170559941 Energy: 0.7862034357657459 Energy: 7.837733619815422 Energy: 4.748867066053232 Energy: 3.500829037774804 Energy: 4.791127180570696 Energy: 7.802033393475858 Energy: 3.740051150208479 Energy: 6.741912785753822 Energy: 3.5158173036910734 Energy: 4.79329073882599 Energy: 7.801954673325211 Energy: 3.740020737459013 Energy: 6.729687508016511 Energy: 2.012880219440779 Energy: 4.980471409887749 Energy: 2.0105378204183406 Energy: 6.730206112033913 Energy: 7.80272711564714 Energy: 2.0108939902621623 Energy: 4.98103445197785 Energy: 4.799037380949177 Energy: 6.859128648350006 Energy: 7.803504150595686 Energy: 2.023525851656779 Energy: 2.002906282167266 Energy: 6.489219999516497 Energy: 6.482273714562499 Energy: 0.8114320776570935 Energy: 2.014115694071244 Energy: 2.0028073119562633 Energy: 6.488025493722251 Energy: 6.4821119333002555 Energy: 0.8095355986722792 Energy: 6.753913427449799 Energy: 5.0057318825893 Energy: 6.713986642631707 Energy: 6.715925846501803 Energy: 4.9887921810549045 Energy: 6.754143455713836 Energy: 4.852476789477436 Energy: 6.712119088139544 Energy: 3.757064109857426 Energy: 4.989138662718369 Energy: 3.7722520005144746 Energy: 5.002130541750154 Energy: 3.5773299240110545 Energy: 3.60229265649636 Energy: 7.981133044230176 Energy: 3.773569263969172 Energy: 5.017109438364097 Energy: 3.576953458726068 Energy: 3.603352980749475 Energy: 6.74733557641054 Energy: 5.103726763745597 Energy: 3.489342237114497 Energy: 4.751427805379144 Energy: 2.0271059061176877 Energy: 7.93270849162934 Energy: 5.105531045191398 Energy: 3.498936579083534 Energy: 4.752777258874051 Energy: 0.7881629194948282 Energy: 8.005397912862442 Energy: 6.798409042367188 Energy: 3.4989022521023085 Energy: 3.498289777566865 Energy: 9.564391136647048 Energy: 6.752468417705041 Energy: 9.573520615471862 Energy: 3.496800514518453 Energy: 3.4908385642658026 Energy: 9.563020444864708 Energy: 6.8123198252336685 Energy: 9.561893742084154 Energy: 4.967525145749853 Energy: 3.7383895848992097 Energy: 6.571494187028891 Energy: 6.813437428668078 Energy: 9.56320753443652 Energy: 4.977507073344161 Energy: 4.975654728479384 Energy: 9.562273572269477 Energy: 6.81272042329444 Energy: 0.7963663251944135 Energy: 4.978988738134695 Energy: 4.981992711359362 Energy: 3.5564433285989447 Energy: 3.5074540802282157 Energy: 0.7937679276118241 Energy: 4.981293420196133 Energy: 4.979048471401333 Energy: 3.5537571451886145 Energy: 0.796714025987955 Energy: 5.178823520768836 Energy: 8.16582946713142 Energy: 3.4995833705782227 Energy: 3.75061263092788 Energy: 6.474126298541922 Energy: 5.1782720390522154 Energy: 8.020621109622166 Energy: 3.500194372158617 Energy: 3.7485524741742715 Energy: 6.476474436735884 Energy: 6.75037441995583 Energy: 6.739518347612262 Energy: 8.014679936077348 Energy: 6.462283597392595 Energy: 3.497053793091583 Energy: 3.761515792712762 Energy: 6.741876490452937 Energy: 5.084299822104811 Energy: 6.4617734301889005 Energy: 3.4968477444854864 Energy: 5.042380864175797 Energy: 6.75244868878218 Energy: 2.096335502185184 Energy: 2.0120319295955933 Energy: 2.0214314735356016 Energy: 8.015946434507862 Energy: 6.7533030402882135 Energy: 0.7731295240172186 Energy: 2.0126345806849417 Energy: 2.023978709798973 Energy: 6.815670037589209 Energy: 6.537630014418565 Energy: 3.501862251115245 Energy: 4.773554726269873 Energy: 6.518977802631169 Energy: 6.815606328520041 Energy: 6.5353333668920195 Energy: 3.505455561030732 Energy: 2.0038292488678477 Energy: 6.518728575719583 Energy: 3.751315093163905 Energy: 6.532523393927551 Energy: 5.000060781404907 Energy: 5.025684598651737 Energy: 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6.730468762397703 Energy: 2.004627547575958 Energy: 4.98507095946527 Energy: 2.0159343000068697 Energy: 6.730256899453565 Energy: 6.731070479051067 Energy: 2.002626592945459 Energy: 4.983308035558498 Energy: 4.803490941320224 Energy: 6.575769151076172 Energy: 0.7950290182754589 Energy: 0.7861679803702943 Energy: 2.0105899657570623 Energy: 4.801587494200705 Energy: 6.502818849232998 Energy: 0.8041067976139004 Energy: 2.023996396790323 Energy: 2.0128354475107897 Energy: 6.484217249226497 Energy: 6.708874677342805 Energy: 6.486333020625323 Energy: 5.102001101350681 Energy: 5.028188202058392 Energy: 3.7608072196164697 Energy: 6.710344364467692 Energy: 4.870115435851384 Energy: 7.98182438194852 Energy: 5.028632055377163 Energy: 3.52841433105762 Energy: 6.507296057723652 Energy: 5.00247830873768 Energy: 3.774475807868328 Energy: 6.738491810554407 Energy: 3.522853128867851 Energy: 6.503221302705336 Energy: 5.003084617395115 Energy: 3.772712883210308 Energy: 6.7427487748953645 Energy: 3.497590425743826 Energy: 2.0271668186351604 Energy: 0.7809240530135481 Energy: 5.052376570854184 Energy: 4.989769403885295 Energy: 3.4966207782609047 Energy: 2.0255110595715897 Energy: 0.7842020156201914 Energy: 5.100527753090581 Energy: 4.989696702903956 Energy: 3.4909910523454655 Energy: 0.7907172323469229 Energy: 3.784134402100447 Energy: 6.7947165353790355 Energy: 3.5010081747100092 Energy: 3.493184447397922 Energy: 3.6014943126959156 Energy: 3.7743729906017096 Energy: 6.796971924103429 Energy: 3.497120885011016 Energy: 4.97459344269839 Energy: 4.80509948276096 Energy: 6.753089033140222 Energy: 3.7718366048414835 Energy: 2.036281777641058 Energy: 4.9742033621323625 Energy: 7.851501004122873 Energy: 6.751040327875792 Energy: 3.7722911773021153 Energy: 2.0330042363403513 Energy: 3.7357542164241293 Energy: 2.046568391013234 Energy: 3.5358611355872505 Energy: 3.613732076064801 Energy: 4.984775609601089 Energy: 3.7371973636493334 Energy: 2.03206539269868 Energy: 6.549650739941563 Energy: 3.618471202321034 Energy: 4.981577467344522 Energy: 2.019140995886074 Energy: 6.472861102467977 Energy: 3.7513127359309157 Energy: 0.7958006983536221 Energy: 5.135483459010551 Energy: 2.0191432366401094 Energy: 3.7558580468625244 Energy: 3.7533536729826933 Energy: 0.7963760542106835 Energy: 5.113891191919099 Energy: 6.763298745997008 Energy: 6.461079893971696 Energy: 6.461301776945884 Energy: 8.014000640919837 Energy: 6.7412322718927244 Energy: 6.750572840060493 Energy: 6.461327498855043 Energy: 6.462090243618283 Energy: 8.013259249260004 Energy: 6.740144477340597 Energy: 8.014369884069254 Energy: 2.006808152772009 Energy: 2.012995116280613 Energy: 5.06112883532869 Energy: 3.8053514488159803 Energy: 5.036680088387244 Energy: 2.013579594485468 Energy: 2.013047752065498 Energy: 5.0458716077395565 Energy: 3.8289740231954563 Energy: 0.7885555437636937 Energy: 3.5159070082350934 Energy: 2.0059641325883586 Energy: 6.751267580276749 Energy: 6.557819951523584 Energy: 0.7827535327439255 Energy: 4.759305439262704 Energy: 4.877930505506268 Energy: 6.752023989244734 Energy: 6.538016635163853 Energy: 5.000185140301704 Energy: 5.017646212342456 Energy: 6.528907700072662 Energy: 3.7491993375997494 Energy: 6.744705172328065 Energy: 5.005632707167375 Energy: 5.01415817956014 Energy: 6.522792967552196 Energy: 3.7608920890256523 Energy: 6.731854293106952 Energy: 5.012384399202306 Energy: 6.691561207274566 Energy: 4.996948739100567 Energy: 6.629326765493741 Energy: 3.665065882559804 Energy: 3.7637105247269362 Energy: 6.693718288797928 Energy: 2.0281759368025494 Energy: 6.638466914060972 Energy: 3.6649047792068172 Energy: 5.042101851859391 Energy: 5.003634653053122 Energy: 3.5115855883067884 Energy: 3.5118380382873764 Energy: 0.8157667538238308 Energy: 5.041645798885756 Energy: 4.994752751403738 Energy: 6.467233230169872 Energy: 3.5093325206475057 Energy: 0.8256278461584159 Energy: 3.791638557024053 Energy: 8.0865995911641 Energy: 6.472687364191829 Energy: 3.513832141667154 Energy: 7.8035348726673535 Energy: 3.7598431453158145 Energy: 7.806873616391176 Energy: 6.4662361784384546 Energy: 3.5014801395354933 Energy: 9.779357031445386 minimum gb energy = 0.7710965154107434 eV minimum distance = 0.00109162158044928 Angstroms sigma value = 293 ======================================== theta = 91.16938280561406 ======================================== Energy: 5.63643919338373 Energy: 8.134882003469972 Energy: 8.173756683584934 Energy: 8.107700695634449 Energy: 5.659464480629683 Energy: 5.637162293519698 Energy: 8.135060237468444 Energy: 8.173077772472439 Energy: 8.107932052294322 Energy: 10.496246223753037 Energy: 8.205712893697566 Energy: 8.135283245043073 Energy: 3.17978722077867 Energy: 3.186125086750089 Energy: 8.13478837467071 Energy: 8.134559391017495 Energy: 3.352647644004039 Energy: 3.1806203231965275 Energy: 3.185889370469448 Energy: 8.134770661273848 Energy: 5.650982723855838 Energy: 0.8144366285020307 Energy: 3.1812641580579375 Energy: 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5.650287930139881 Energy: 10.552889892269826 Energy: 8.075140978010223 Energy: 0.7985664574457706 Energy: 5.648428179652073 Energy: 5.651348999171781 Energy: 5.675160308379032 Energy: 8.077008900501152 Energy: 0.7866020310070878 Energy: 10.553080281348832 Energy: 5.647596870542031 Energy: 8.235635223027014 Energy: 5.604400668994163 Energy: 8.049125137061296 Energy: 10.552859016878106 Energy: 5.6478776727596465 Energy: 8.236642462405179 Energy: 5.604598618427382 Energy: 3.220819126064198 Energy: 5.622667686220898 Energy: 0.7652048500729774 Energy: 0.7621668507583151 Energy: 8.049404244781657 Energy: 3.217909326425238 Energy: 5.6224364294825255 Energy: 0.7624291358018581 Energy: 3.221060856745781 Energy: 5.601721496262263 Energy: 8.180209606538853 Energy: 0.7795699823540286 Energy: 5.622145212807305 Energy: 8.134854231986525 Energy: 8.136944559749086 Energy: 5.622421825596073 Energy: 5.620566859659072 Energy: 5.623946764654771 Energy: 5.659640027943464 Energy: 8.137985096443842 Energy: 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3.1868377203078673 Energy: 3.2419209464409033 Energy: 8.133385693668703 Energy: 0.7618252239145106 Energy: 3.1787848965040646 Energy: 3.1867203666115596 Energy: 3.242286657003329 Energy: 5.651776211451225 Energy: 0.8129887501445932 Energy: 3.249250491574019 Energy: 5.650930408199904 Energy: 5.623337591457986 Energy: 5.654096763719922 Energy: 0.8141302926184243 Energy: 3.248941388707236 Energy: 5.651419028596548 Energy: 5.622476573559265 Energy: 5.651070582780227 Energy: 5.640826092982011 Energy: 5.6389800301106074 Energy: 8.210105821491203 Energy: 5.6254811712136155 Energy: 5.650172061049141 Energy: 5.641907376141887 Energy: 5.639130142167438 Energy: 5.6506360730652005 Energy: 5.625968308136105 Energy: 0.8139960540471711 Energy: 5.640233937014108 Energy: 5.638680544923446 Energy: 3.213980883615428 Energy: 3.2189181078813376 Energy: 0.8149913407053421 Energy: 5.6395659506212885 Energy: 5.638535623645005 Energy: 0.7766044637088075 Energy: 3.198790766646814 Energy: 5.828204162234772 Energy: 10.553861102567609 Energy: 0.7798493360721458 Energy: 5.62507765281133 Energy: 8.080356620182503 Energy: 5.76079334932232 Energy: 10.553766321829928 Energy: 0.7834314519624519 Energy: 5.625099862380944 Energy: 8.079962786372292 Energy: 5.64858655401439 Energy: 5.649314766686556 Energy: 10.552963264478002 Energy: 3.2152962255404502 Energy: 3.223516550707643 Energy: 5.649024142805997 Energy: 5.65044329636131 Energy: 5.676252491114095 Energy: 3.214682022676962 Energy: 3.2240926175384055 Energy: 5.707445368587805 Energy: 10.55478952375241 Energy: 8.224454100527609 Energy: 5.604289567126275 Energy: 5.6013921495357915 Energy: 10.552972754335617 Energy: 10.552248344009357 Energy: 3.2178634718361203 Energy: 5.60214085311582 Energy: 8.049105614314694 Energy: 5.622518642724082 Energy: 0.7624884994311667 Energy: 0.7612422571126258 Energy: 3.2193644519210767 Energy: 8.179282296685289 Energy: 5.622483770990425 Energy: 0.7624114500608098 Energy: 0.7662118486472868 Energy: 3.218597840920599 Energy: 8.178560430224438 Energy: 5.621932710971262 Energy: 5.621321585071717 Energy: 10.4954201540113 Energy: 5.659585401966523 Energy: 5.623239979034826 Energy: 5.622841248125677 Energy: 5.623466278843189 Energy: 10.495397999437833 Energy: 5.65962815507309 Energy: 5.62261540608879 Energy: 3.179531607978899 Energy: 3.2387444855219245 Energy: 5.637962362187082 Energy: 5.638849529804517 Energy: 3.186313861373294 Energy: 3.1794324622181303 Energy: 8.135111313718244 Energy: 5.6434444517927425 Energy: 5.637606727122839 Energy: 3.185528660638125 Energy: 3.1801934299017773 Energy: 3.185920140947109 Energy: 10.685214741311096 Energy: 8.135746032021782 Energy: 3.179612019077815 Energy: 3.181111472225986 Energy: 3.185378209093176 Energy: 10.646751932856334 Energy: 3.283146164612511 Energy: 3.1794716410280874 Energy: 0.7861429686585737 Energy: 5.618965213757251 Energy: 5.624521678424923 Energy: 5.651034239311703 Energy: 3.259904697821487 Energy: 0.7876562310010549 Energy: 5.619034517537472 Energy: 5.626866764839823 Energy: 0.7749987312901462 Energy: 3.250562080436819 Energy: 5.638928745298647 Energy: 5.6503299075090405 Energy: 10.494661795228819 Energy: 8.0695419182252 Energy: 5.642427715006352 Energy: 8.069114150661512 Energy: 5.650856341989062 Energy: 10.494513859071946 Energy: 8.070843721708831 Energy: 5.641687193466474 Energy: 8.069305673927822 Energy: 3.219277612634209 Energy: 3.1963694269829497 Energy: 3.2372685767861933 Energy: 5.638471941063971 Energy: 8.06973716930509 Energy: 3.2187939815760855 Energy: 3.2015835383357016 Energy: 8.070208100282004 Energy: 5.638385618128871 Energy: 5.625869451583229 Energy: 5.625758380147212 Energy: 3.200874280482927 Energy: 10.552548840050223 Energy: 10.553934267665344 Energy: 5.625563503430009 Energy: 5.626228087193463 Energy: 8.193241985870817 Energy: 10.554393419586951 Energy: 5.707284676892154 Energy: 3.214097923853449 Energy: 3.2182259656293852 Energy: 5.676294080856116 Energy: 5.650480216534109 Energy: 5.648501322980102 Energy: 3.214035094642615 Energy: 3.218479185188376 Energy: 10.552995705372785 Energy: 5.649142896224994 Energy: 5.6479190145321345 Energy: 8.048963023158892 Energy: 5.602342761357362 Energy: 3.221773729893738 Energy: 10.555059061397916 Energy: 5.761994234416937 Energy: 5.601309653935811 Energy: 5.604391352145802 Energy: 3.223029255812091 Energy: 10.555215908380578 Energy: 5.828647237068052 Energy: 3.2191661540891117 Energy: 3.2217458719269554 Energy: 5.622158029214178 Energy: 5.622731252284292 Energy: 0.763058911259761 Energy: 3.22428030611975 Energy: 3.217340937907307 Energy: 5.622225606830906 Energy: 5.6226661046556154 Energy: 0.861972279061105 Energy: 5.6379518291477 Energy: 8.134083170748957 Energy: 5.6288984135366045 Energy: 5.621359360252132 Energy: 8.136257682559748 Energy: 5.637211136932293 Energy: 8.135364572411056 Energy: 5.626618437002427 Energy: 5.621817673787201 Energy: 5.661094514697983 minimum gb energy = 0.7507428924495294 eV minimum distance = 0.0014273725000544 Angstroms sigma value = 293 ======================================== theta = 101.5369590328155 ======================================== Energy: 0.758671346388813 Energy: 7.362865657781689 Energy: 20.78672482446998 Energy: 20.786741399977142 Energy: 0.7504719627843387 Energy: 0.7548157744191754 Energy: 7.362721948561575 Energy: 20.786732417973813 Energy: 20.786856569320513 Energy: 0.7500726075319955 Energy: 7.366305614966411 Energy: 7.363622134838266 Energy: 7.512375324147767 Energy: 7.513474065206506 Energy: 7.362106842157765 Energy: 7.365097471069767 Energy: 7.364516733564056 Energy: 0.752165736245592 Energy: 7.51389738586219 Energy: 7.362677123472942 Energy: 14.113299266084768 Energy: 0.7611404158483542 Energy: 7.510694562853381 Energy: 20.848103048858153 Energy: 14.112871794515735 Energy: 14.113912640612735 Energy: 0.7591823195977679 Energy: 7.511127774309668 Energy: 20.787325923829464 Energy: 14.113062168978397 Energy: 14.1137977966794 Energy: 0.7420532763958461 Energy: 0.7512093414853427 Energy: 14.035840801437729 Energy: 14.114782595668618 Energy: 14.114268899442935 Energy: 0.74387681341566 Energy: 0.7504211742725829 Energy: 14.113264305915788 Energy: 0.7547941078708443 Energy: 7.526331786312951 Energy: 0.7552019688791151 Energy: 0.7497777181940389 Energy: 7.36318425231396 Energy: 7.5121392426897735 Energy: 7.524444798550602 Energy: 0.7529358671324559 Energy: 0.7484857902106634 Energy: 7.364511855482814 Energy: 7.511873950697602 Energy: 7.510776074546356 Energy: 21.755822177423813 Energy: 7.363045178235803 Energy: 7.523062152532087 Energy: 0.7611470790219702 Energy: 7.511284251242693 Energy: 21.745106941138285 Energy: 7.363139642032397 Energy: 7.521875298778292 Energy: 0.7603910967214184 Energy: 14.113691399493344 Energy: 0.7495002313695511 Energy: 14.113491382670405 Energy: 7.365107886086082 Energy: 7.3639455125385345 Energy: 14.1135655502475 Energy: 0.7481957240348928 Energy: 0.7677715122809556 Energy: 7.364554787073475 Energy: 7.363889900702491 Energy: 14.113593170806443 Energy: 14.112952096501806 Energy: 7.363421926867502 Energy: 0.7511653900911367 Energy: 0.7510167701928513 Energy: 14.11394842654871 Energy: 14.113316271225486 Energy: 7.363340563737696 Energy: 0.7543992053405093 Energy: 0.7510720046881334 Energy: 7.5122535582835965 Energy: 0.7520635161622309 Energy: 7.37961967380053 Energy: 0.750264490315865 Energy: 7.364371040079985 Energy: 7.51161902656884 Energy: 7.510313774647206 Energy: 7.379729669568601 Energy: 0.7485449119614513 Energy: 7.364903983818493 Energy: 7.522371191573342 Energy: 7.511081484789281 Energy: 14.113070952552679 Energy: 14.113977400220024 Energy: 0.7697218411412884 Energy: 7.521014663887749 Energy: 7.511117362669369 Energy: 14.112923160107805 Energy: 14.114320629702036 Energy: 0.7610004718908179 Energy: 0.7410325539164501 Energy: 7.363249598668663 Energy: 14.11298243232924 Energy: 14.113354077949927 Energy: 7.364538160761447 Energy: 0.7417183915268869 Energy: 7.363132369052244 Energy: 0.7481395712303515 Energy: 14.113530013547965 Energy: 7.364609377595605 Energy: 0.7584963653976102 Energy: 7.362706864150275 Energy: 20.847833635289287 Energy: 20.7871146767502 Energy: 0.7505334288762114 Energy: 0.755282568619891 Energy: 7.362855946926967 Energy: 20.847344897742012 Energy: 7.52089459458624 Energy: 0.7501851823162314 Energy: 7.365675995265231 Energy: 7.364144583384291 Energy: 7.51189403562706 Energy: 7.514210325732816 Energy: 7.3803923883111455 Energy: 7.364649268664239 Energy: 7.365113183181935 Energy: 0.7525540094866144 Energy: 7.5145067410278195 Energy: 7.364256045498152 Energy: 14.11327370430763 Energy: 0.7610814354036617 Energy: 7.510551584709254 Energy: 20.847404451370476 Energy: 14.113005059675391 Energy: 14.1133531654646 Energy: 0.7593126767102351 Energy: 7.511029406291991 Energy: 20.787179389287587 Energy: 14.112923614166114 Energy: 14.114509126814964 Energy: 0.7416935257694109 Energy: 0.7526344348687994 Energy: 14.03543579362819 Energy: 14.113323124781294 Energy: 14.114594836704406 Energy: 0.7434178751177184 Energy: 0.7503269868447323 Energy: 14.113594525569864 Energy: 14.11391738466553 Energy: 7.526050000559671 Energy: 0.7507718484986395 Energy: 0.7492716873217163 Energy: 7.362927327514054 Energy: 7.514320974789436 Energy: 7.5252698178052135 Energy: 0.7532906503531022 Energy: 0.7476698708547851 Energy: 7.363691317184724 Energy: 7.5119022369312685 Energy: 7.510847059628374 Energy: 14.047311390321958 Energy: 7.363247355111608 Energy: 7.523199783530858 Energy: 0.7615319884833833 Energy: 7.51119459032955 Energy: 21.744822341812455 Energy: 7.362987475585219 Energy: 7.522155946300516 Energy: 0.7605578175204378 Energy: 14.113485786938961 Energy: 0.7497835817878052 Energy: 14.113653758684391 Energy: 7.364100542739127 Energy: 7.3629428352484085 Energy: 14.113368886398643 Energy: 0.7481073733244702 Energy: 0.7679421437248475 Energy: 7.364317751902888 Energy: 7.362958271962516 Energy: 14.11398246557348 Energy: 14.113192609122589 Energy: 7.3630384377445885 Energy: 0.751496086868252 Energy: 0.7509056472488868 Energy: 14.11395603871825 Energy: 14.11362566506814 Energy: 7.362284202344087 Energy: 0.7545695349520855 Energy: 0.7508673182674905 Energy: 7.511547910971097 Energy: 0.7520704697546418 Energy: 15.093556839565663 Energy: 0.748893278661246 Energy: 7.364566290923104 Energy: 7.511076039686152 Energy: 7.510250427051843 Energy: 7.379939093810531 Energy: 0.7486088904003365 Energy: 7.365083060416724 Energy: 7.522420514777507 Energy: 7.5110338689348985 Energy: 14.113494238885714 Energy: 14.11423099399561 Energy: 0.7685326408964531 Energy: 7.521065961474506 Energy: 7.510566784484019 Energy: 14.11291547543688 Energy: 14.113912763738286 Energy: 0.7614535036631326 Energy: 0.7412534029154481 Energy: 7.362533456754184 Energy: 14.113625428175322 Energy: 14.113300891112754 Energy: 7.364606736134678 Energy: 0.7421378996101349 Energy: 7.36325795144635 Energy: 0.7481670082455512 Energy: 14.113731191099642 Energy: 7.364223951363839 minimum gb energy = 0.7410325539164501 eV minimum distance = 0.00533378109155573 Angstroms sigma value = 15 ======================================== theta = 110.02717248395858 ======================================== Energy: 4.962605477392373 Energy: 10.323548234887332 Energy: 5.850268355720842 Energy: 5.851403213052272 Energy: 8.748507366330974 Energy: 4.90674254724501 Energy: 9.807511511376035 Energy: 5.848321635524752 Energy: 5.848250822168032 Energy: 4.7669719633220335 Energy: 10.32192300297709 Energy: 6.303692079164938 Energy: 4.748715882250296 Energy: 4.749441119977191 Energy: 5.7839758091906495 Energy: 9.806051363424446 Energy: 1.7737453519475812 Energy: 4.746683868936445 Energy: 6.259094521632397 Energy: 6.304885703291434 Energy: 4.253970692911167 Energy: 0.793112499794687 Energy: 2.2841672417821073 Energy: 2.283101172691767 Energy: 4.263933304300406 Energy: 4.257809029693649 Energy: 0.7850189351516722 Energy: 2.2862540063710277 Energy: 5.807870350736518 Energy: 4.2594285816095425 Energy: 4.253606751164202 Energy: 4.845705378174082 Energy: 8.765925005122138 Energy: 4.434152345997477 Energy: 4.264903479701987 Energy: 4.257144600397442 Energy: 4.844877250518547 Energy: 4.775662136933493 Energy: 4.255834117967932 Energy: 4.260926478177288 Energy: 2.2940537381458204 Energy: 8.768415235230929 Energy: 4.78872227872543 Energy: 5.851838955441516 Energy: 4.779151959460633 Energy: 2.252923131826098 Energy: 8.771555618687803 Energy: 8.774660587341222 Energy: 5.8587227108027395 Energy: 4.779470088962647 Energy: 4.777767618744968 Energy: 4.416952741213701 Energy: 4.413208965081261 Energy: 6.273920048683675 Energy: 4.780832096408241 Energy: 6.273396140298865 Energy: 4.41798843179427 Energy: 4.410261736673275 Energy: 6.272956001877882 Energy: 4.78081875207831 Energy: 2.2878752541023726 Energy: 5.772893670921824 Energy: 2.260705134930638 Energy: 4.279475438598393 Energy: 2.322419407985615 Energy: 4.253233940602577 Energy: 5.773269233169683 Energy: 2.2601067197074687 Energy: 4.272823502468013 Energy: 2.249773364789582 Energy: 0.7599483276251936 Energy: 2.3175633907089437 Energy: 4.269278156127067 Energy: 4.782124605441642 Energy: 4.861194237807772 Energy: 0.7568200415033587 Energy: 2.307403338823383 Energy: 4.27199732514561 Energy: 4.781636811068149 Energy: 8.270148013954483 Energy: 4.766482832228096 Energy: 4.784084538044998 Energy: 9.943202350520469 Energy: 4.781382980636731 Energy: 8.269905313982612 Energy: 4.767219157919963 Energy: 4.784681842738858 Energy: 5.881190071950123 Energy: 4.781461736821412 Energy: 8.27025986246813 Energy: 6.2708381620388085 Energy: 8.754860581831872 Energy: 6.265313612922658 Energy: 2.2384435546969024 Energy: 2.2414872679353435 Energy: 4.7682154420046095 Energy: 8.754859008059904 Energy: 2.292135490749919 Energy: 2.2416515548119587 Energy: 2.2445100514865515 Energy: 4.2691633514405245 Energy: 0.7702909259632779 Energy: 0.7654000939953101 Energy: 2.243144408506158 Energy: 5.817164235527195 Energy: 4.27103879436352 Energy: 0.7693160862474758 Energy: 0.7638958827014033 Energy: 2.2447221211567716 Energy: 5.816141286059191 Energy: 4.754421499506575 Energy: 4.283940963374444 Energy: 6.048422249191237 Energy: 6.114329015553133 Energy: 4.281610850048904 Energy: 4.754179794139255 Energy: 4.281496761600404 Energy: 5.899853259568057 Energy: 5.831593180750435 Energy: 4.285580178069707 Energy: 5.850729264212816 Energy: 6.0536712897363865 Energy: 4.773710720298046 Energy: 4.764045557534551 Energy: 2.101140770957387 Energy: 5.850200820012926 Energy: 5.784209101529683 Energy: 4.770790548829335 Energy: 4.762161329784024 Energy: 1.7922028153216139 Energy: 4.74430684705277 Energy: 2.2781260079670687 Energy: 10.086127136612586 Energy: 10.087155966962591 Energy: 2.2786979436281576 Energy: 4.7441580447566105 Energy: 2.2802353875969086 Energy: 8.748224207406649 Energy: 9.83015854255314 Energy: 2.281499601825048 Energy: 6.240768029080041 Energy: 5.805960284339584 Energy: 4.253061400009761 Energy: 0.8512729459908089 Energy: 2.2890972769268223 Energy: 6.237978388038067 Energy: 5.805955616163123 Energy: 4.255102847055271 Energy: 0.8388339457285047 Energy: 2.285923371509023 Energy: 8.28413112781354 Energy: 4.253839428977099 Energy: 4.252822927420764 Energy: 8.283507550506865 Energy: 8.768077164754718 Energy: 8.286237949072424 Energy: 4.264833556561183 Energy: 4.254554384698304 Energy: 8.285437034471158 Energy: 8.76697174956312 Energy: 4.773493120030748 Energy: 6.274788055807036 Energy: 6.27675111869801 Energy: 8.289981606210944 Energy: 4.861513631409452 Energy: 4.773627616206808 Energy: 6.275387552546789 Energy: 6.27623101065256 Energy: 8.32846214557165 Energy: 4.78131095562031 Energy: 4.416104334869322 Energy: 4.784547796095297 Energy: 4.7802517944631795 Energy: 2.2769124186120586 Energy: 8.347555479468191 Energy: 0.8285425904982434 Energy: 4.783213532352944 Energy: 4.782379400046778 Energy: 0.7599430558225708 Energy: 8.285528078752032 Energy: 0.7810582934828467 Energy: 5.860387889900971 Energy: 2.287164276416744 Energy: 4.2499744223325555 Energy: 5.77331358632793 Energy: 0.786655517206914 Energy: 5.818228519342408 Energy: 2.294058265374694 Energy: 4.252518009372236 Energy: 2.2595972523696575 Energy: 8.271265886550045 Energy: 4.858876287241691 Energy: 4.3319891552212235 Energy: 0.75498007331246 Energy: 0.7548520425262772 Energy: 4.801701134700937 Energy: 4.858111683404109 Energy: 4.358882371857184 Energy: 2.322386685966613 Energy: 0.754609380486853 Energy: 8.269996582273954 Energy: 4.781523033296919 Energy: 5.799995288916391 Energy: 8.754860083747168 Energy: 4.768790671034932 Energy: 8.270811813844583 Energy: 4.7812875509837385 Energy: 9.864364431748873 Energy: 4.785642588933317 Energy: 6.30993208678809 Energy: 2.239092298273137 Energy: 2.2384532826528516 Energy: 2.318407182776666 Energy: 4.785469570997804 Energy: 4.796025551584667 Energy: 2.2390630943434844 Energy: 2.2388824430619505 Energy: 6.266491155028331 Energy: 4.785394278320801 Energy: 4.767809364071688 Energy: 2.25068950627918 Energy: 2.246781087863031 Energy: 4.279725189746713 Energy: 5.816699770001201 Energy: 0.7678779781886415 Energy: 2.2449359088757257 Energy: 2.2489772794902585 Energy: 4.308526756550783 Energy: 5.827062768057808 Energy: 0.7615415723151918 Energy: 5.904109937929057 Energy: 1.8052541422026205 Energy: 4.7570173013467505 Energy: 4.759670758579535 Energy: 1.8669542618680806 Energy: 5.872626991089841 Energy: 0.7787616083401135 Energy: 4.755908058228992 Energy: 8.226517392777641 Energy: 5.848316054971072 Energy: 4.7700324904963445 Energy: 9.851367451708784 Energy: 4.2596285710403095 Energy: 4.279055075311946 Energy: 8.74920621459156 Energy: 4.910353212009245 Energy: 9.851435256587052 Energy: 4.260217825389462 Energy: 4.308017887191279 Energy: 4.7644742500803545 Energy: 4.7628047158114235 Energy: 5.785331763746753 Energy: 4.742471936240949 Energy: 6.238686374229708 Energy: 5.78144426610948 Energy: 4.7629464950771645 Energy: 5.786214431929652 Energy: 4.742205965011917 Energy: 6.24105366594833 Energy: 5.7821313579316795 Energy: 4.254377821905838 Energy: 0.7820567207449769 Energy: 2.2750828178443383 Energy: 2.2752428848647375 Energy: 4.253697423671646 Energy: 4.255762496040578 Energy: 0.8087779140172556 Energy: 6.232913300427427 Energy: 2.2750966195026003 Energy: 4.253312922359345 Energy: 4.253366065911574 Energy: 8.28686119117768 Energy: 4.786407630108899 Energy: 0.8406231341016798 Energy: 4.257108443713355 Energy: 4.253869054011338 Energy: 8.282111263561388 Energy: 4.773995738069084 Energy: 4.254175553374821 Energy: 4.256563726926071 Energy: 2.3095021340082345 Energy: 8.767159738156261 Energy: 4.783026451789012 Energy: 5.850484985570033 Energy: 6.277106101747151 Energy: 2.3090258481123764 Energy: 4.781319961649492 Energy: 4.782945757660753 Energy: 5.85250455825175 Energy: 6.277330965914669 Energy: 4.778033883415057 Energy: 4.394435830120092 Energy: 8.28152107113193 Energy: 6.27555224185776 Energy: 4.778290913063147 Energy: 6.278040418498886 Energy: 8.344351861775424 Energy: 8.281710984768816 Energy: 6.275505261321484 Energy: 4.778851674548696 Energy: 2.285475925363028 Energy: 5.769825862180902 Energy: 2.2603591906073346 Energy: 0.7791459011530403 Energy: 6.277300279834384 Energy: 5.802969893974915 Energy: 5.768709473367871 Energy: 2.2810824422323397 Energy: 5.825738699181752 Energy: 6.276098851762281 Energy: 0.7614774526299103 Energy: 4.245450450703569 Energy: 4.278098222719931 Energy: 4.783325069306835 Energy: 8.271451778772178 Energy: 0.7567293580697664 Energy: 4.2461330762786025 Energy: 4.2698698776624395 Energy: 4.782640826343544 Energy: 8.268447884183356 Energy: 6.2666760836011255 Energy: 8.756222214980994 Energy: 9.947501366579749 Energy: 4.865917210671192 Energy: 8.269529014411317 Energy: 4.76722757226621 Energy: 8.756248842127723 Energy: 5.8880774470668555 Energy: 4.866942923135806 Energy: 8.269798086004974 Energy: 4.916162902193244 Energy: 4.784542053748367 Energy: 6.268282228087858 Energy: 2.2402003972492524 Energy: 2.2425688802970094 Energy: 4.915581875276733 Energy: 4.785302597359003 Energy: 2.288796809504791 Energy: 2.239910017860303 Energy: 0.7725345575889934 Energy: 4.272253466056001 Energy: 2.340641319292152 Energy: 0.7668170815387174 Energy: 2.240172843929452 Energy: 2.2412376022388947 Energy: 4.25936862283295 Energy: 2.325040487933784 Energy: 0.7658346556202167 Energy: 2.2387923055415535 Energy: 2.2402659125017936 Energy: 4.754563173646195 Energy: 4.283140865171383 Energy: 5.901954040773454 Energy: 5.847630591199991 Energy: 4.284089757022232 Energy: 4.754363377455456 Energy: 4.360138691308184 Energy: 6.167399231647566 Energy: 6.10912920706586 Energy: 4.283019592812248 Energy: 4.283756646039476 Energy: 1.750311841717192 Energy: 4.7731913670251815 Energy: 4.762182933896621 Energy: 4.281057997491214 Energy: 4.2674517187643675 Energy: 6.049813268820972 Energy: 4.773924791426352 Energy: 4.907268460475619 Energy: 4.2795284741776705 Energy: 4.747742021649154 Energy: 2.279964247974467 Energy: 8.939650502825847 Energy: 8.748298773611143 Energy: 2.2765946797335945 Energy: 4.747125408613381 Energy: 2.2792875427444432 Energy: 4.794963347615205 Energy: 8.754241488802013 Energy: 2.2872371448533695 Energy: 6.238123764320753 Energy: 5.805587018941647 Energy: 4.255174306481988 Energy: 0.8403313215727425 Energy: 2.285027452054821 Energy: 6.23984472558606 Energy: 5.8042322692129185 Energy: 4.253981899544669 Energy: 0.8480708899109658 Energy: 2.284292624817817 Energy: 8.281200246350203 Energy: 4.263513209803327 Energy: 4.2579956156671015 Energy: 4.352869200096454 Energy: 4.77703211127993 Energy: 8.284410422671362 Energy: 4.2591995437103884 Energy: 4.258582425337994 Energy: 8.283405963014848 Energy: 4.8378265419188065 Energy: 4.772471381145882 Energy: 2.261037866201245 Energy: 6.276613802994527 Energy: 8.356087295075893 Energy: 4.852211544452649 Energy: 4.771769449496929 Energy: 2.249864565614202 Energy: 2.2889249852725095 Energy: 8.35207223962922 Energy: 4.850857663085901 Energy: 4.406544542163054 Energy: 4.783749117301777 Energy: 4.779720098240715 Energy: 2.291230651856477 Energy: 8.34558819308603 Energy: 4.363293720149942 Energy: 4.783248685419487 Energy: 4.781488663929724 Energy: 5.922127902282324 Energy: 8.283771909019288 Energy: 0.7839223947299869 Energy: 2.2507779222875812 Energy: 6.274142241296006 Energy: 4.250517634108014 Energy: 2.271900222938328 Energy: 0.7854697787857302 Energy: 6.275342904448061 Energy: 6.273913084054664 Energy: 4.252274385473994 Energy: 2.265811563978597 Energy: 8.267475732266416 Energy: 4.8660056522780435 Energy: 4.270963066844939 Energy: 4.251357088880613 Energy: 0.7536974638750784 Energy: 8.268127294647309 Energy: 4.864399447300162 Energy: 4.3662910956044065 Energy: 4.251108410504078 Energy: 0.7544297578424769 Energy: 8.267347527801608 Energy: 4.782957741306991 Energy: 5.826116320290022 Energy: 8.754796602047687 Energy: 6.264173089152346 Energy: 8.269082008643572 Energy: 4.783951765579745 Energy: 5.802786071393806 Energy: 8.754877833069543 Energy: 6.264375232531396 Energy: 0.7589759615806558 Energy: 2.237865124240807 Energy: 6.288764052954071 Energy: 4.783098004537108 Energy: 4.766676812539375 Energy: 2.2419449000327347 Energy: 2.2429071328172943 Energy: 6.278825029389113 Energy: 4.783066525153659 Energy: 4.767010510822827 Energy: 2.2448860117031213 Energy: 2.2444994709234343 Energy: 4.257739022884924 Energy: 9.870984689347933 Energy: 2.2893923465554713 Energy: 2.244723803730699 Energy: 2.2437349554482946 Energy: 4.28879540731575 Energy: 6.265605705296288 Energy: 0.7640697589033917 Energy: 6.431602902479537 Energy: 0.7463453604800004 Energy: 4.758926290272442 Energy: 4.760007393010064 Energy: 0.7957077164500548 Energy: 5.840288838237172 Energy: 0.7482896976924592 Energy: 4.75689674973217 Energy: 8.25301813763092 Energy: 2.320545555995609 Energy: 4.7838778676578 Energy: 10.364522441942304 Energy: 4.2863523646123705 Energy: 4.301365034677511 Energy: 8.750298729523646 Energy: 4.924980759660989 Energy: 5.7851940549358805 Energy: 4.270443475173472 Energy: 4.286202556010459 Energy: 8.758671010343637 minimum gb energy = 0.7463453604800004 eV minimum distance = 0.000217690395351329 Angstroms sigma value = 437 ======================================== theta = 117.03569178941231 ======================================== Energy: 4.4915935513289815 Energy: 10.096803516218165 Energy: 6.352621349270939 Energy: 6.413918768870772 Energy: 8.19227622316849 Energy: 4.488091348307033 Energy: 10.095951823780233 Energy: 6.352164886899043 Energy: 6.41247053516007 Energy: 4.365464688995382 Energy: 10.09441690017989 Energy: 6.29830902683401 Energy: 4.343851450405602 Energy: 4.345875479865644 Energy: 6.283775553921665 Energy: 10.094697744861564 Energy: 2.556559641332269 Energy: 4.341688066357667 Energy: 6.173024715055151 Energy: 6.283857152720256 Energy: 6.1888976368862645 Energy: 0.7846811863366131 Energy: 6.164873224078796 Energy: 6.16375447962055 Energy: 4.360614242402693 Energy: 2.6690480767518463 Energy: 0.7847157426794688 Energy: 6.164193035055796 Energy: 2.5675128737494135 Energy: 4.362333037354098 Energy: 0.7299669441065723 Energy: 8.101504107064823 Energy: 4.4496171310753585 Energy: 0.7898353611093416 Energy: 4.3582030829781 Energy: 0.7308034425518503 Energy: 4.357375725132516 Energy: 4.4494375511071835 Energy: 0.7886405436893992 Energy: 4.358150690114183 Energy: 6.27734154692025 Energy: 4.446413711457478 Energy: 4.361791914921291 Energy: 10.066798952010192 Energy: 8.005837713430715 Energy: 6.277443167753859 Energy: 4.446744856197099 Energy: 4.363859497871141 Energy: 6.282265025678893 Energy: 8.005947539604648 Energy: 8.006127292769417 Energy: 2.5275542861579736 Energy: 6.3129148450153725 Energy: 6.282049250596486 Energy: 4.492010155537464 Energy: 8.006049505044908 Energy: 6.388234529394234 Energy: 6.313249205727293 Energy: 6.279717080935796 Energy: 4.35110083677356 Energy: 2.5725169138832187 Energy: 2.529156716139388 Energy: 6.186093371898011 Energy: 0.7310646047582708 Energy: 6.282753256576273 Energy: 2.575203408900562 Energy: 2.527152213094449 Energy: 6.188449053989299 Energy: 2.6280775949101725 Energy: 6.268438014330135 Energy: 0.784632973674907 Energy: 6.228386834255724 Energy: 2.5263562347310335 Energy: 7.994990840949635 Energy: 4.347752141904381 Energy: 0.782572459897587 Energy: 6.213861104848724 Energy: 6.234182145363744 Energy: 7.994218732717312 Energy: 4.348045546074009 Energy: 8.100664577221794 Energy: 4.448825803663835 Energy: 8.172563390702763 Energy: 4.426280431360999 Energy: 4.346760198954131 Energy: 8.100547196251018 Energy: 4.447917886220416 Energy: 8.176021540793442 Energy: 4.347273257202246 Energy: 4.347169504926211 Energy: 8.184885961606579 Energy: 4.359646057781685 Energy: 10.100926801171445 Energy: 4.343600496822854 Energy: 6.25414759786914 Energy: 8.092445406459937 Energy: 4.361429810099124 Energy: 6.295531074671123 Energy: 4.3434349590222165 Energy: 6.254526662886173 Energy: 0.7136235075688916 Energy: 2.5415516156869113 Energy: 2.561229213345723 Energy: 7.991502526309936 Energy: 4.384441279887865 Energy: 0.7122126892162596 Energy: 2.54128159615745 Energy: 6.273370253677376 Energy: 7.990483519361062 Energy: 6.175577424350177 Energy: 6.208940079569199 Energy: 2.5443259526339994 Energy: 4.35941387150273 Energy: 6.2804349354051565 Energy: 0.7158279124685428 Energy: 6.206864018597587 Energy: 2.5452333600435617 Energy: 4.358540033157198 Energy: 6.280123594668423 Energy: 0.7146572606015448 Energy: 6.29716572477738 Energy: 0.7136659376553329 Energy: 4.345788131738664 Energy: 4.345552255670208 Energy: 2.641612668082788 Energy: 6.297099129671778 Energy: 4.358513621128725 Energy: 4.3444996606307305 Energy: 4.345913180458601 Energy: 2.642082906081458 Energy: 8.006732585579876 Energy: 10.085988748506935 Energy: 4.379287250590749 Energy: 4.359015559132244 Energy: 8.192407309589875 Energy: 8.123283864852969 Energy: 10.089508265033533 Energy: 4.371630500694936 Energy: 4.359911459896752 Energy: 4.365211442690877 minimum gb energy = 0.7122126892162596 eV minimum distance = 0.00263924483818794 Angstroms sigma value = 33