32 Lattice="7.60283475880351 0.0 0.0 0.0 7.60283475880351 0.0 0.0 0.0 7.60283475880351" Properties=species:S:1:pos:R:3:forces:R:3 energy=-195.58371759740731 stress="-0.014478448252975397 0.0006117223400306148 -0.0004953790566685894 0.0006117223400306148 -0.014569156480379644 -0.0014704498717129394 -0.0004953790566685894 -0.0014704498717129394 -0.01502121397543777" free_energy=-195.58371759740731 pbc="F F F" Ta 0.03212630 0.00949113 0.00216439 0.35045847 0.32076877 0.16245815 Ta 1.92536597 1.93485701 0.00758423 0.89449611 0.37744703 -1.10045990 Ta 1.89962861 0.00543142 1.89939355 1.04310830 -0.97794110 0.75310570 Ta 0.02375636 1.88426775 1.86810503 -1.24073286 0.71707811 1.10763802 Ta 3.82905882 0.02207166 0.01108506 -1.09961549 -0.13577262 -0.20020855 Ta 5.69851904 1.93705527 0.03505860 0.20693428 0.80720860 -0.26891231 Ta 5.68209526 0.01132840 1.92404296 0.40751670 -0.39834816 0.76395491 Ta 3.82203233 1.88907617 1.94014464 -0.62772797 0.45433331 -0.31210270 Ta 0.00052989 3.77754564 0.00450611 -0.20901353 -0.75871276 -0.36917528 Ta 1.91775099 5.68957495 0.00793657 0.73900153 0.13097767 -0.22306846 Ta 1.86495418 3.77937843 1.91433752 0.58884806 0.08616238 0.05286159 Ta 0.01210333 5.67627108 1.87310669 -0.18636885 0.33095928 1.10093362 Ta 3.80511773 3.83599959 0.02234747 -0.96540931 -1.20746582 -0.94360199 Ta 5.69473079 5.64553433 0.02693782 -0.16129910 0.12285474 0.13797115 Ta 5.68534170 3.82274898 1.89401600 1.08644039 -1.08702033 1.36004817 Ta 3.77812782 5.69232242 1.92702542 -0.72510465 1.21073566 0.46640067 Ta 0.00661693 0.01205499 3.79805167 -0.31019327 -0.34009493 -1.01180785 Ta 1.89058234 1.87403785 3.83743194 0.16480928 0.35503291 -0.54810768 Ta 1.88365497 0.01465608 5.71703664 1.33820428 -0.35986909 0.25544402 Ta 0.01050425 1.86272380 5.70543710 -0.40644169 1.36596122 0.27701011 Ta 3.81992295 0.03257445 3.83123907 -1.39008452 -1.56656444 -0.94813108 Ta 5.67708585 1.87429110 3.81202276 1.54419342 1.40139633 -1.01559407 Ta 5.65011049 0.01758978 5.69158411 0.05033134 0.07860835 0.06895484 Ta 3.83184637 1.93319439 5.66639096 -1.42696113 0.68135548 1.47357717 Ta 0.01071005 3.79925506 3.79096633 -1.12693561 -0.85165750 -0.58087487 Ta 1.90772553 5.72394457 3.81787797 0.34377304 1.11834037 -0.99651801 Ta 1.88258659 3.82577899 5.67829875 0.72894244 -1.05896494 1.24969648 Ta 0.00472779 5.69724452 5.68805375 0.22417528 -0.23691533 -0.30457752 Ta 3.74791627 3.81451139 3.78875737 0.48768694 -0.26761411 0.08308658 Ta 5.67023091 5.68684443 3.79749084 0.23069181 0.18967272 -0.75068594 Ta 5.70433993 3.77214217 5.69047268 0.14567802 -0.50402084 0.03954978 Ta 3.78750900 5.70948702 5.70051694 -0.69940171 0.00206906 0.22113523