256 Lattice="15.509836601546343 0.0 0.0 0.0 15.509836601546343 0.0 0.0 0.0 15.509836601546343" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1377.7062568312315 stress="0.2506211155911084 -0.11708625898952671 0.05537347545322943 -0.11708625898952671 0.09246997912966293 -0.054315057149325295 0.05537347545322943 -0.054315057149325295 0.1229641962945014" free_energy=-1377.7062568312315 pbc="F F F" Nb 0.05458568 0.04353243 0.01979583 1.12851492 1.83701601 0.75611298 Nb 1.92162250 1.98746532 0.00976399 -0.19380420 0.56834926 -0.23480024 Ti 1.95713066 0.06319859 1.99372792 1.80973940 -2.07162142 1.27428906 Al 0.02631558 1.90985999 1.95405641 -1.35970659 -0.06063101 -0.61551959 Nb 3.92876275 0.04011392 0.02954255 -0.32627537 1.19810182 -1.52382708 Nb 5.81314203 1.93820334 0.02360212 -0.53228448 0.89039677 0.04490205 Ti 5.86845564 0.01647996 1.98045980 -1.47694157 -2.82542455 0.43985587 Al 3.86446684 1.97286098 1.95471977 53.75412982 -25.77668605 25.50633373 Nb 7.81627787 0.02140628 0.00904814 0.35247625 0.05111011 0.29412560 Ti 9.70736444 1.88842912 0.05415234 1.66112571 3.10604870 -0.89099807 Nb 9.70230084 0.01603883 1.91054470 -1.24212494 -4.63181033 0.28151283 Al 7.81019286 1.89167966 1.93945174 -0.99363287 0.48029487 0.22316121 Nb 11.62667338 0.01258101 0.01740564 -0.62701722 -1.24099707 -1.13042848 Al 13.59668765 1.93814682 0.06574025 -0.23910770 0.02653178 -0.33356133 Ti 13.55715553 0.04490202 1.91442791 1.61881642 -0.89966621 0.00996399 Ti 11.65877115 1.90943609 1.93512018 -1.31781058 2.37869055 -1.25222364 Al 0.03189202 3.83320703 0.04781567 0.41282826 -0.70826178 -0.14053893 Al 1.97843138 5.83838325 0.01282749 -0.03468345 -0.71117651 -0.57826131 Al 1.92649681 3.85360516 1.89094208 0.27274373 0.20041425 0.06881371 Al 0.01062341 5.84053096 1.92020616 -5.02520245 -2.56764049 -2.18099008 Al 3.83889433 3.86407194 0.06289280 0.51130285 -0.37285497 -0.70939758 Al 5.79556156 5.79061838 0.03060868 0.02741997 -0.37507321 -0.43293933 Al 5.81654620 3.88468541 1.97355725 21.46173236 -21.83479849 41.80646580 Nb 3.85114812 5.79428456 1.93603868 56.28054721 -27.99984226 27.73826392 Nb 7.76946350 3.92315831 0.01610895 -1.95296010 0.17602310 0.01080411 Al 9.69327938 5.84230379 0.01621586 0.35290369 -0.14091416 -0.68036621 Ti 9.69025579 3.87149857 1.94346987 -1.08805781 -3.34976362 1.33344487 Al 7.76612710 5.82028935 1.97665777 57.46761008 35.37270933 -31.82971720 Al 11.63757900 3.91019495 0.03115525 -0.32662269 -0.11444536 -0.64626454 Ti 13.52291807 5.86428948 0.00656332 2.49958097 -1.02507826 -1.15600410 Al 13.56253077 3.92265131 1.92173205 1.14448924 1.24406099 -0.01204395 Nb 11.60048055 5.81925292 1.92515651 0.26699635 0.63588445 -1.24143175 Ti 0.02383674 7.78277588 0.00794526 0.49365768 -0.66673652 -0.84445096 Ti 1.97438036 9.67081639 0.01059734 1.32287244 -0.83259832 -1.36593494 Ti 1.91768150 7.73028382 1.96827169 -1.05429467 0.56530243 -0.12933536 Nb 0.02516662 9.68014411 1.94143773 0.55985696 7.68916298 6.30515524 Ti 3.86584693 7.81507704 0.01455632 -0.21484918 0.67750067 -1.95753705 Ti 5.82147080 9.67362051 0.04094115 0.89067911 -0.21063415 -0.31483495 Al 5.82098528 7.78509090 1.92537678 -0.43965256 -1.14614042 0.41366436 Al 3.86532444 9.71192820 1.87190987 -0.00646509 -0.21501017 2.24050236 Ti 7.76090712 7.76478033 0.05724086 -0.17525311 0.71076837 -0.70109210 Ti 9.64533400 9.66751864 0.02942667 -1.11721235 -0.68051040 -1.18943440 Al 9.64572324 7.76505748 1.94172339 1.23312764 -0.21018673 0.70949183 Ti 7.74557707 9.68189114 1.99575769 -2.04047319 0.44360341 -2.85994669 Nb 11.64644399 7.72608831 0.00922122 -54.25393706 -27.33141347 26.79832169 Al 13.54016893 9.66362343 0.02973460 -0.43411982 0.62524843 -0.17617105 Al 13.58454887 7.82362742 1.91920940 0.62544169 -0.13693329 -0.04479902 Ti 11.62372879 9.74148758 1.96977090 0.98861254 -2.40601598 0.47429947 Nb 0.00560094 11.64950307 0.04061030 -0.74213737 -0.47624953 2.22879838 Ti 1.98851636 13.56244790 0.02224802 1.52599397 0.41042021 -0.44070359 Al 1.93309408 11.60628956 1.97383716 -0.55198566 0.46397263 -0.08741299 Nb 0.03055714 13.51091028 1.96466546 0.15487543 -2.41044558 1.12904868 Ti 3.88872432 11.63682891 0.04800358 -1.09505994 0.61370595 -0.93608317 Al 5.87120490 13.54317678 0.05504963 -0.67831381 0.08273386 -0.09219258 Al 5.76758393 11.63070093 1.99384548 0.79653460 -0.15766062 -0.21366820 Ti 3.88520845 13.59268699 1.99176668 -0.91753685 0.50084988 -0.58728213 Al 7.74424863 11.65221496 0.03652582 0.26302259 -0.23910839 -0.73722262 Al 9.69922106 13.54937276 0.01078616 0.96364278 -0.59042981 0.59253674 Nb 9.69093494 11.64961365 1.96651352 -0.15836704 2.11367342 2.37209707 Ti 7.74408687 13.56723014 1.93666068 -0.48992885 1.64327320 0.50210804 Nb 11.64129582 11.62271000 0.01292898 0.39655833 2.02604268 -0.70615917 Nb 13.59158080 13.58606447 0.02308158 -1.75857943 -1.97983784 1.92806597 Nb 13.58093450 11.63770057 1.91362628 0.41695184 1.11554422 -0.03172990 Nb 11.66216639 13.56320692 1.95829247 0.21495907 -0.49389054 -0.14473873 Nb 0.07070982 0.02176209 3.89545440 -3.40421016 -2.05609645 -0.73419085 Ti 1.99205682 1.89317273 3.84646390 0.41997237 1.23466590 0.48699608 Ti 1.95012223 0.03479246 5.81425856 1.02262990 0.01166773 -0.58738502 Ti 0.00376960 1.92054749 5.86459654 -0.93824706 0.31017388 -1.12304698 Ti 3.87471360 0.00742805 3.85608589 -0.99489941 -1.45888840 -0.15257321 Nb 5.76762383 1.93040171 3.83414554 -3.57446190 -5.94929033 3.48877629 Ti 5.80342630 0.04235790 5.81678636 -1.00448093 -2.83822395 1.35240682 Al 3.86209787 1.97806399 5.81475513 0.81370920 0.80393758 -0.01278072 Nb 7.73772153 0.02907812 3.90001741 -50.49209092 26.00158104 -27.05675429 Ti 9.68183584 1.95892769 3.89987049 -0.25750516 3.63980821 -3.61976045 Nb 9.71386577 0.04458766 5.76822605 6.68528613 -5.22501573 -4.13423035 Nb 7.75696142 1.89896461 5.82817495 -77.79144536 53.20303647 -72.07021021 Nb 11.64820218 0.06290688 3.92663497 -1.28518115 -3.43475386 3.18686689 Nb 13.60427404 1.91937071 3.89491287 -57.74304881 31.22726417 30.99715849 Al 13.57955857 0.02569256 5.81656028 -0.49413831 0.50225536 -0.01531703 Nb 11.61995356 1.98965557 5.83576525 6.70561266 -9.64710038 -5.77344727 Ti 0.03810738 3.88161057 3.85265868 -0.71057780 -1.06251530 -1.91934246 Ti 1.97430256 5.83200644 3.86494934 -2.28134724 -0.08686943 -1.44520940 Nb 1.93630589 3.91751002 5.80120566 2.30641375 2.37679281 1.93485732 Nb 0.00341306 5.81901469 5.83044666 -0.51406683 -1.45917343 2.42004313 Al 3.90069913 3.88873742 3.89661626 56.72504251 -29.00685278 28.45994840 Al 5.78950891 5.86175880 3.89895442 -0.14762493 0.08563877 -0.56726475 Ti 5.83899563 3.91699094 5.84732064 -0.36662199 -0.00499139 -1.45089025 Nb 3.89895800 5.83730492 5.80922647 -2.42356781 1.33114619 2.06476891 Al 7.72064060 3.86542621 3.90238170 -54.45286042 26.89189235 -27.80723273 Ti 9.67037528 5.78306833 3.86165852 -0.56103011 -0.34847106 2.02700203 Al 9.70365240 3.85236737 5.79492671 57.19650048 -29.30987338 -26.66045134 Al 7.70730651 5.83051650 5.79732400 0.21578073 0.05981535 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1.83274495 Ti 9.70669288 7.72580150 5.76865232 0.80055586 -3.49258796 1.43785068 Ti 7.74003202 9.66726361 5.81513633 -1.20054506 2.58098905 1.63165636 Ti 11.66741219 7.75374679 3.85726166 0.21925715 -0.09294787 0.19184680 Al 13.58624816 9.69778672 3.91012783 0.86202592 0.50853165 -0.55507037 Ti 13.58615124 7.78451108 5.80991499 0.29360811 -1.15828964 0.41821363 Nb 11.66469310 9.64332509 5.83384513 -3.86147409 3.01196762 1.51365534 Nb 0.00681405 11.61759273 3.86478281 -0.07709627 1.43920662 -1.31927747 Al 1.98548893 13.49848374 3.91704485 -0.94077757 0.78436825 0.36536292 Al 1.94282452 11.64252194 5.81764318 -3.67815575 -3.34184053 -6.16669687 Nb 0.02067583 13.52385128 5.76886196 1.72223331 -1.43214024 -0.23857157 Al 3.83888742 11.61878581 3.91300429 0.14360631 -0.37521207 0.03460803 Ti 5.78402748 13.54781895 3.88867543 0.78672193 1.18805101 -0.08804111 Al 5.84206924 11.61512462 5.84445608 3.18758142 -1.63724007 -1.86430645 Al 3.89673425 13.57030811 5.82917622 -0.55702139 0.57972827 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4.39472674 2.92654277 Ti 5.79917737 0.02467150 9.68924222 1.74751880 -1.03674348 0.08435253 Ti 3.84000086 1.89342317 9.70385334 -0.14937151 2.57977297 0.11105302 Ti 7.72691093 0.01661986 7.78400688 -1.28872914 -3.01548143 -0.20899579 Ti 9.74934705 1.95413946 7.76963735 1.11669894 2.38991157 -0.62750417 Nb 9.67673030 0.06307508 9.72525658 2.34171717 -0.74864206 2.10876072 Nb 7.77795053 1.93576714 9.69432804 3.05750842 6.26788591 -0.93192364 Nb 11.59743235 0.04329932 7.70031282 1.77486952 -1.50753533 0.09466240 Nb 13.50831559 1.90986942 7.70696564 1.52957841 -2.04629547 -1.05915194 Al 13.58869389 0.01223135 9.71038932 -0.49889830 0.78806754 -0.15121505 Al 11.64237280 1.93055403 9.63563921 0.27778975 -0.20055026 0.76033247 Nb 0.01307306 3.86622652 7.74929747 2.00917232 8.92501476 -3.67680202 Al 1.89750770 5.78654497 7.73466294 0.82526308 -0.38476807 -0.21757288 Ti 1.93833244 3.86723095 9.71111346 2.13894206 -0.78819030 -0.38601265 Nb 0.01674933 5.83489188 9.66357101 -2.49646195 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-0.00034952 Ti 13.60467817 11.66746097 9.70463213 1.65735624 0.93850898 1.15816507 Ti 11.62060091 13.59911991 9.69448019 0.04090360 0.30421837 1.67186139 Ti 0.04837517 0.00060853 11.65253360 -0.02978715 -0.46356688 1.13149686 Ti 1.92878506 1.95560006 11.62390321 -0.92410126 0.12956168 -1.19019485 Ti 1.94027404 0.01996472 13.54835420 -1.08066930 0.25346062 0.80293343 Al 0.00899150 1.95083084 13.53927376 -0.20827709 0.39563295 0.45003487 Nb 3.83192770 0.00383972 11.64030282 -0.85772673 -4.44057230 -1.94603198 Ti 5.83926271 1.90086814 11.62325904 0.77441941 1.07645888 0.60962236 Ti 5.78373185 0.03607768 13.58743184 1.52943514 0.72215278 0.21768243 Ti 3.82808693 1.91359682 13.56106530 1.37402481 -0.33009588 2.33004850 Ti 7.72558593 0.01842412 11.61085758 -3.64151690 -3.14146298 1.09778712 Nb 9.70941350 1.89646494 11.62517323 3.30492132 -0.43668603 -2.74273938 Nb 9.69287924 0.00615349 13.50323805 1.68194431 -0.49069559 0.00071234 Ti 7.77216109 1.94653235 13.52885409 -2.98305598 0.88237443 1.53603529 Al 11.58895886 0.02171687 11.58398960 0.05542583 -0.46506585 0.07173118 Nb 13.59805975 1.87479321 11.66302672 -1.06595100 0.61015040 -0.27772783 Ti 13.57266061 0.03771374 13.59843192 -0.84134992 -0.25674208 0.00901140 Al 11.61472939 1.98288551 13.59798468 0.49115585 -0.21283140 0.35572824 Ti 0.03505058 3.87179909 11.62415685 -2.31046518 -0.96876467 0.93200022 Nb 1.95462723 5.82415810 11.61644558 3.04294114 1.38442890 0.95055797 Nb 1.95425851 3.89874485 13.59206658 1.51128378 0.42554997 2.17564423 Ti 0.01331875 5.81735661 13.55271513 -2.04092944 0.27411791 0.89410293 Nb 3.92225091 3.88461602 11.64600061 1.54701461 3.17546410 0.88759945 Nb 5.83111934 5.79331216 11.64880452 -1.74286103 -1.49346924 -0.77535509 Al 5.79947270 3.87261763 13.59654714 -0.20737873 0.70880736 0.69502866 Nb 3.87551499 5.75968699 13.57765196 -0.02201449 -0.75646191 -1.27552861 Al 7.79693155 3.88993600 11.67689760 -1.25009007 0.06224459 -1.30962942 Ti 9.65268549 5.82199124 11.55911126 -0.33171598 1.34261185 -0.19305217 Ti 9.67578539 3.82759761 13.58003421 -0.05362097 -0.12003866 1.01333468 Nb 7.73710075 5.86096637 13.59236538 -1.91036727 0.03627660 2.01428124 Al 11.64970172 3.87120640 11.64391926 -1.54528261 -0.67578426 -0.37009925 Al 13.55185147 5.78354270 11.63755181 -28.13383988 59.03317056 29.03810184 Nb 13.57521705 3.89023136 13.51320795 -1.22848559 0.53580106 -0.95220322 Nb 11.59621786 5.84336777 13.55937123 1.95944829 -0.05171665 1.12910081 Al 0.00819908 7.74202652 11.62784938 -0.68822215 0.37251152 -0.14363199 Al 1.99017696 9.70544332 11.68322563 -1.78247913 -0.53271956 -0.85341452 Al 1.91459540 7.72360576 13.50520184 0.52309965 -0.05772349 0.75008762 Nb 0.00113900 9.68861339 13.54109562 1.47315090 -0.38297320 -0.61349979 Nb 3.87007975 7.81573780 11.61522163 0.51145547 -3.06127340 1.04097255 Al 5.77344982 9.71752759 11.62513457 1.41425685 -0.49728682 -0.20307254 Nb 5.85864800 7.71497956 13.54511493 0.03102927 -0.90943330 0.80452405 Ti 3.85080542 9.67632919 13.52924522 0.93142892 2.05919388 1.42753600 Ti 7.75010788 7.73464895 11.63524736 2.33545099 -0.62789876 -2.96339309 Nb 9.68859448 9.71574476 11.66385768 0.33119432 3.10154853 1.72159669 Al 9.68422119 7.71290899 13.59455017 -0.04611951 0.17971927 0.89625465 Nb 7.71193461 9.69257581 13.57649635 1.83534064 -0.47497761 -0.08876023 Ti 11.64105457 7.73437538 11.61347552 -0.45374366 -0.52247136 0.42123057 Al 13.52418995 9.70001994 11.62259396 0.44181765 0.29700998 0.42507516 Al 13.53956517 7.80659011 13.60907134 -0.80399145 -0.03054091 -0.02914500 Nb 11.64382120 9.70778291 13.51417413 28.38924034 -57.84295418 -28.85361454 Ti 0.04026496 11.69649590 11.67873889 -2.03773757 -0.38067615 0.39212915 Ti 1.89249978 13.51555387 11.70440781 1.34331260 1.86114186 1.54491396 Al 1.95544728 11.56879334 13.55551408 -0.33569232 -0.27882173 1.92736460 Ti 0.04272418 13.53736382 13.57567204 0.21155730 -0.25568526 -0.72984140 Ti 3.86485631 11.68711299 11.63401063 -0.54930000 -1.29031860 1.01119994 Nb 5.87000317 13.59575156 11.67294925 3.88861575 1.45699515 -1.92901092 Ti 5.78272994 11.58019801 13.56011886 -1.67980410 0.29954945 2.06391089 Ti 3.90144379 13.57384702 13.56843945 -0.74087398 -0.81767787 -0.17995628 Nb 7.71975018 11.60878101 11.58494984 -0.76699570 0.34993357 0.44833063 Al 9.74689821 13.60090564 11.62803984 -0.73676378 0.56362667 0.49676708 Al 9.70400476 11.68828445 13.56452671 0.23273524 -0.31264325 0.49737214 Al 7.78637512 13.60720056 13.51089588 -0.54623437 -0.77522380 -0.87222619 Al 11.61483687 11.66664250 11.64193809 -0.93946292 0.26384424 -0.12882954 Al 13.56960340 13.60101960 11.61377614 -0.35569150 -0.26537092 0.87642914 Nb 13.59448842 11.66654258 13.53643819 -2.35933091 0.22721717 -1.39471794 Nb 11.63633857 13.51554411 13.54817181 0.87358715 -1.92692259 -1.51590357