256 Lattice="15.509835122409392 0.0 0.0 0.0 15.509835122409392 0.0 0.0 0.0 15.509835122409392" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1383.5289817815906 stress="0.006790041055829437 0.004279240328354791 0.04009983874026221 0.004279240328354791 0.026923213062606605 0.014047718358975024 0.04009983874026221 0.014047718358975024 0.08170280767526554" free_energy=-1383.5289817815906 pbc="F F F" Nb 0.04033915 0.01503986 0.05885995 1.49654577 1.63620111 1.65738522 Al 1.92715287 1.94309581 0.02366706 -0.25832275 -0.42140518 -0.67190115 Nb 1.91713117 0.06542788 1.92900859 0.97141854 0.99077811 -1.46341549 Nb 0.01558869 1.91106923 1.90017688 0.88894369 0.86148020 -2.46973805 Nb 3.88686480 0.01745641 0.03314020 -1.18682045 0.84782463 -0.03507222 Nb 5.83829750 1.89757562 0.01271394 1.09241032 -0.85303838 -2.33100795 Ti 5.81743239 0.03229035 1.91017405 0.99099632 -2.43521115 0.30074228 Al 3.88146462 1.93658469 1.92159974 -0.69162969 -0.15323377 0.47537730 Al 7.78006065 0.01251319 0.02643870 0.24365036 0.42900008 0.29051880 Nb 9.74546201 1.95060162 0.02551017 -0.52621138 0.11872359 1.12413690 Nb 9.71847060 0.03635333 1.91858594 0.88595307 1.61172218 0.62395114 Al 7.72649373 1.87318142 1.94458419 0.79389574 0.50670142 0.00651055 Al 11.60967564 0.00624703 0.04226887 -0.83637703 0.67702814 0.39876307 Ti 13.56694599 1.90558853 0.03576306 0.79229509 -0.66031779 -0.15573004 Al 13.55769245 0.00786485 1.92805741 -0.39769850 0.12393696 0.26729657 Al 11.66295613 1.97397568 1.90713994 -0.50746483 -0.20024931 0.41462117 Nb 0.07110412 3.94857548 0.06169523 -1.00470931 -2.98474068 -0.49621618 Ti 1.98241035 5.83761962 0.03941887 0.12522987 -0.97573846 -2.42872813 Al 1.87578003 3.92863327 1.92832922 1.20309264 -1.72732631 0.10153072 Ti 0.03654238 5.77749349 1.97411283 -2.02652305 1.80755382 0.92319099 Ti 3.87985963 3.83824117 0.00572965 -1.25275795 1.41438435 -0.21083165 Ti 5.82009714 5.76891070 0.01825913 0.14601020 -1.42376713 -1.50767064 Ti 5.80711676 3.93798513 1.95614437 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-1.45627552 0.86096429 0.84124972 Ti 5.78817696 9.74161851 0.03148085 2.09557577 1.45997120 -2.82136544 Nb 5.86595064 7.74402094 1.90941020 0.37813487 1.61872372 0.20721821 Nb 3.82004365 9.71657630 1.93580934 1.97118249 -1.56377343 -1.68812843 Al 7.75611133 7.75425099 0.03762616 -0.70402635 -0.17132220 -0.74940946 Ti 9.72934938 9.66203392 0.00588718 -0.84239284 0.43808597 -0.04930140 Ti 9.69064981 7.75424355 1.91240887 1.09262649 0.61118362 -0.21680388 Al 7.77026139 9.65664489 1.92865205 2.56346138 68.71021860 30.57923135 Al 11.58022566 7.78537373 0.02996722 1.06635384 -1.45383739 -1.28572085 Ti 13.51504013 9.68176660 0.01348860 0.49503315 0.31731058 -1.08448229 Nb 13.57700951 7.75135466 1.95965047 -0.06528526 -1.96025708 2.17050278 Ti 11.58175791 9.71434091 1.94913154 -0.30669975 0.30723924 1.59904476 Ti 0.01559435 11.67929374 0.00888951 -0.08810888 -0.57674906 -0.07108403 Al 1.95788100 13.55401074 0.02124430 -0.04166683 0.32944032 0.33316863 Ti 1.97806097 11.61800589 1.90381056 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3.84928188 -1.19384659 -1.18424403 2.91315610 Al 1.91348412 1.93878822 3.88311809 1.33017204 0.24969406 -0.97433485 Ti 1.93904984 0.00365457 5.82005220 -1.78986843 -2.35291673 -1.00013508 Ti 0.02586089 1.97885925 5.81030852 -1.58372820 -0.43041775 -3.16673845 Nb 3.89766105 0.03431992 3.87193398 0.24042615 1.24463760 0.32955169 Al 5.81246368 1.90363326 3.86139436 -7.77857441 -3.77602692 -3.67749046 Nb 5.83500686 0.05029872 5.82745830 -2.61205062 0.07061699 -0.63114537 Nb 3.91714096 1.91726672 5.79460046 1.83574386 -0.88754511 -1.30792995 Nb 7.75071317 0.02581303 3.92227906 1.45716688 -0.68111558 -0.30831435 Al 9.67346096 2.00010048 3.89296165 -2.17330623 -2.35547851 2.68859693 Al 9.68971035 0.06223838 5.81674817 0.07874822 -1.59479599 -0.27391121 Ti 7.82296385 1.94247079 5.80141995 0.60150942 -0.25486792 1.18147145 Al 11.64222381 0.04130578 3.83598102 -0.54264506 -0.43979762 -0.24320381 Al 13.58519923 1.99554944 3.90431071 0.51373546 0.07604259 -0.26906491 Ti 13.56862296 0.04793344 5.81747777 0.25724798 -0.63301431 -1.32586031 Ti 11.57505583 1.94412430 5.79860601 0.57174023 0.67445752 -2.21809644 Ti 0.03059987 3.93199554 3.91183774 0.02193096 -0.55488521 0.69564360 Ti 1.97344702 5.83651173 3.86317235 1.45260393 -2.27711365 -0.70465606 Ti 1.96979231 3.86339651 5.77392790 0.29833804 -0.71159079 -2.54565051 Nb 0.03649604 5.76800016 5.85975249 -1.42896137 3.95453062 3.42688129 Al 3.89822134 3.83729458 3.90423679 0.09607880 -0.78485273 -0.49971964 Ti 5.81833811 5.80747489 3.90550529 -3.61615396 -0.09102598 -0.83033319 Nb 5.85476448 3.82913797 5.83365391 -0.45005624 -0.66413191 -0.23236548 Ti 3.86978459 5.80744321 5.77789065 1.41914033 1.17940076 -0.79079140 Al 7.75628879 3.91854862 3.83552010 1.86229541 0.31323829 -0.01706490 Nb 9.72821884 5.77161962 3.86878537 -2.33672028 0.37494904 -0.68934550 Nb 9.64638114 3.94344719 5.78226301 5.47877308 3.86580836 3.00249637 Nb 7.75813913 5.81936144 5.82609882 -0.72257813 1.85285795 -1.01761888 Ti 11.61418512 3.89797897 3.91628755 0.79613847 -2.36475352 -1.62041101 Nb 13.52801415 5.77898561 3.90548559 1.57217750 1.93737202 -1.46593629 Al 13.52378547 3.91730153 5.75583702 1.33594598 -0.14798861 0.97673520 Ti 11.62133874 5.80584865 5.81139573 -0.20317322 -0.30660658 2.35322237 Al 0.03699608 7.75298646 3.88921837 -1.02843609 0.34537009 0.50994108 Ti 1.94466587 9.72569497 3.84532405 0.47429732 -0.52492539 0.95538663 Nb 1.94961020 7.71977446 5.80493875 -19.78815901 13.20850921 -20.48134114 Nb 0.02705872 9.69130790 5.79412278 -0.81974486 -1.79241690 -0.84843871 Ti 3.91820119 7.80261196 3.87654475 0.53064670 -1.42106980 3.95457302 Al 5.80983188 9.65408733 3.88203511 1.37156987 1.45007577 0.35094500 Al 5.82382626 7.75027216 5.79210386 0.45899078 0.44584807 0.67479712 Al 3.86869065 9.73791281 5.81244856 0.10625090 -0.86501900 -0.94812690 Nb 7.72703631 7.72957387 3.88788151 1.34912625 0.96348238 1.39750658 Al 9.72518396 9.71928887 3.84015007 -0.70480594 -1.03351751 1.14614329 Al 9.69724292 7.78178193 5.78697369 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11.59151994 0.02926126 11.63384011 0.34609626 -2.23577161 1.66391292 Al 13.52706749 1.93851107 11.62815011 0.98515377 0.31884321 0.16228879 Al 13.59637910 0.01780821 13.57788138 -1.42400906 0.91201163 -0.61075501 Nb 11.64683489 1.92758550 13.57548747 1.18209238 -1.61260179 2.11661165 Al 0.00395876 3.90764150 11.63187451 -0.41348518 -0.36730141 -0.17641045 Al 1.95488591 5.84480507 11.67003009 0.35987861 -0.53280593 -0.12618519 Nb 1.97120930 3.84650105 13.60665601 -1.14172344 -0.00942546 0.05593687 Ti 0.03420105 5.83423295 13.56150623 -1.20064201 -0.46159055 1.04162279 Ti 3.88070308 3.84818854 11.67478873 -0.29004056 -0.52107878 -3.05968328 Nb 5.74405238 5.81057192 11.62677456 0.06614880 2.81275469 -1.88808404 Ti 5.77096126 3.88446585 13.54762248 0.18109842 -1.21292944 1.38950203 Al 3.89819861 5.81136985 13.55405994 -0.74522728 0.42158505 0.90466824 Al 7.71087147 3.85077639 11.65198415 0.84073414 0.36640365 -0.69667060 Nb 9.68983608 5.79908996 11.61588880 -1.14146380 0.67951448 -0.18806257 Nb 9.66918632 3.87936100 13.57203239 -0.37272189 0.02199782 1.58085342 Ti 7.75675977 5.82223292 13.55993001 -1.10581171 1.60207105 2.33006342 Ti 11.63090047 3.84205078 11.65031095 -1.47382996 -1.01438002 -2.87212476 Nb 13.55713964 5.86126097 11.62127999 1.96014954 -1.49766838 -1.53621065 Nb 13.57728351 3.86789134 13.56227075 -0.25807552 0.10930209 -0.04438470 Nb 11.61048286 5.79591706 13.60822604 -1.12529627 -1.51749656 2.05684918 Nb 0.00764456 7.76953270 11.68526054 -4.12648809 12.21623146 3.94252947 Al 1.93181229 9.68034186 11.64320773 -0.04980205 -0.19825383 0.05330442 Al 1.89006702 7.79209080 13.55042956 0.31795198 0.29128368 0.50030915 Nb 0.03342703 9.68996018 13.57084233 0.60834828 -0.38447844 -2.25933747 Nb 3.88381068 7.70347868 11.63485001 0.61725594 0.66958171 2.10863534 Al 5.80348832 9.66628660 11.63077698 0.07046516 0.21706808 0.21243036 Ti 5.83530617 7.71677580 13.59661539 2.04006574 0.68849063 2.80848162 Al 3.91271598 9.69157258 13.57460012 -0.25185871 0.28940588 0.31438907 Al 7.75750151 7.79646305 11.65111081 0.06276963 -0.39325299 -0.63926663 Nb 9.69155118 9.67880364 11.69093747 -9.53893957 1.77821959 8.39237528 Al 9.69257962 7.76366383 13.55144838 0.44893843 -0.14524588 0.46944650 Al 7.73483399 9.68222822 13.51061695 0.22588252 0.23367715 1.00913001 Ti 11.63105910 7.74461346 11.58168706 2.49987455 0.33021162 -0.64833947 Al 13.58812207 9.71719861 11.65189266 0.59185120 -0.26525641 -0.27345827 Ti 13.55512288 7.75401448 13.56612270 1.19760871 0.43589105 0.72853071 Nb 11.66172207 9.65257203 13.55908006 -3.07415154 1.00023574 1.49465550 Al 0.02318739 11.64031280 11.65431312 -1.61611213 -0.51829677 -0.04168847 Ti 1.94682331 13.53361395 11.67403450 1.84066082 0.25234015 -0.03026488 Ti 1.93923598 11.69169298 13.56205653 1.66335264 -0.86427492 -0.11811026 Nb 0.04807206 13.58255426 13.55868280 -0.58743383 -0.31408296 -0.51278176 Ti 3.87016342 11.65341942 11.60502764 -2.00111167 -0.50090419 -1.38932045 Al 5.78224895 13.54575551 11.63533519 0.75776130 0.75736170 -0.17959334 Nb 5.87647196 11.64729679 13.55133921 -0.57946590 0.17198065 0.73323212 Al 3.87812707 13.58253979 13.51837366 0.35581397 -0.11013330 0.54824687 Ti 7.78574050 11.66526007 11.67088638 -1.06519295 -1.30493686 -1.87806639 Nb 9.67595621 13.57011514 11.63893141 0.36383175 2.48501791 0.72613037 Al 9.63758178 11.62884848 13.54243453 0.83232496 0.01793751 1.13816283 Al 7.78368615 13.60140081 13.55499626 0.08469487 -0.16876130 -0.50662074 Ti 11.69047906 11.68816125 11.63916842 1.05256240 -2.03280471 -1.88466757 Ti 13.51361635 13.52273025 11.61032545 2.32914891 0.09186243 0.52803752 Ti 13.56809770 11.66889106 13.58744916 1.20751101 0.18371008 -0.30721784 Nb 11.67274919 13.55717607 13.50773693 -3.52049192 1.47241248 1.16834993