32 Lattice="7.697861597350103 0.0 0.0 0.0 7.697861597350103 0.0 0.0 0.0 7.697861597350103" Properties=species:S:1:pos:R:3:forces:R:3 energy=-199.4066369427575 stress="-0.024324144505122332 0.00024071047170839396 0.0021890519522582605 0.00024071047170839396 -0.022299811869429313 0.000593261680381487 0.0021890519522582605 0.000593261680381487 -0.023316242412672238" free_energy=-199.4066369427575 pbc="F F F" Ta 0.01096511 0.02747082 0.00889050 1.21744068 1.14058607 1.23333955 Ta 1.93160804 1.90098202 0.00869229 -0.66682919 0.26028152 -1.89393502 Ta 1.88599411 0.00931632 1.95132858 0.27171904 -2.06305699 -0.40741071 Ta 0.00420641 1.90196945 1.92349901 -1.88593881 0.63834349 -0.33796198 Ta 3.83494716 0.03931550 0.05510047 -0.55783737 -0.67270646 -0.59468794 Ta 5.78419472 1.89038651 0.01631629 0.19254667 0.70214095 -0.23203917 Ta 5.74350012 0.01402283 1.89798702 0.38622711 -0.12422948 0.96550692 Ta 3.84506725 1.92847634 1.89085126 0.28831233 -0.37020297 0.54507918 Ta 0.00662444 3.88164446 0.01427546 0.29313627 -0.76640969 0.11173165 Ta 1.90767530 5.80879063 0.01165414 0.76761223 -0.28793450 0.13613423 Ta 1.95302868 3.86296631 1.92733096 -0.75635833 0.10221502 -0.76482772 Ta 0.04106119 5.74128108 1.93925182 -0.38000704 0.38280059 0.36117154 Ta 3.85512074 3.81291018 0.01995049 0.19553255 0.85015414 -2.05485932 Ta 5.77840427 5.78435118 0.00166122 -1.57175889 -1.56653357 1.56208899 Ta 5.76556553 3.82517215 1.93328712 1.89405627 0.44283115 -0.42897727 Ta 3.86358104 5.78997949 1.92429877 0.06794756 1.68758237 -0.37481956 Ta 0.02946260 0.03138963 3.83073781 -0.48248735 -0.43246796 -0.17423486 Ta 1.91857971 1.94116346 3.83863789 0.23585588 -0.12924233 0.39125205 Ta 1.91972715 0.03046056 5.75626080 0.75775994 -0.15646150 0.03406900 Ta 0.05838178 1.92966667 5.74384628 -0.53382635 0.53957670 0.42803496 Ta 3.83573528 0.01457735 3.82651419 0.27437604 -1.63166202 0.34405110 Ta 5.76718365 1.94030845 3.86787751 1.78264185 -0.37061628 -0.15702518 Ta 5.78731329 0.01696480 5.74622925 -1.39257158 1.39423488 -1.35345814 Ta 3.88626985 1.93748718 5.78442692 -0.43109245 -0.17491166 1.66990998 Ta 0.00719076 3.85861986 3.85843206 -2.03844170 -0.27591481 -0.27260674 Ta 1.90190641 5.74917775 3.86054911 0.51950900 2.18592640 0.05511367 Ta 1.89716457 3.88347955 5.77885902 0.58734028 -0.25983508 1.90007942 Ta 0.01431895 5.73902754 5.73858563 0.81506585 -0.89117075 -0.95956762 Ta 3.82711739 3.83593955 3.82114170 0.50834985 0.33218022 0.88491252 Ta 5.73852722 5.73225272 3.86489184 0.34969407 0.08410555 -0.56592680 Ta 5.78355627 3.82741192 5.78127737 -0.01292056 -0.36615330 -0.05909901 Ta 3.88581942 5.76193571 5.75818407 -0.69505382 -0.20344971 0.00896228