32 Lattice="7.69785992417321 0.0 0.0 0.0 7.69785992417321 0.0 0.0 0.0 7.69785992417321" Properties=species:S:1:pos:R:3:forces:R:3 energy=-199.227524911933 stress="-0.02251772000646286 -0.0006793514676747572 0.002933206134335955 -0.0006793514676747572 -0.023530927553465676 0.004155088297667885 0.002933206134335955 0.004155088297667885 -0.023634828791950564" free_energy=-199.227524911933 pbc="F F F" Ta 0.03457472 0.00390923 0.00350922 1.04856077 1.07933494 1.08614906 Ta 1.89543129 1.93861294 0.02174505 0.22600841 -0.15745703 -2.24429285 Ta 1.89526805 0.01265810 1.91471202 0.37509646 -2.21595659 -0.07982358 Ta 0.02689297 1.88948607 1.89907295 -2.09710597 0.43622371 0.26791040 Ta 3.88213189 0.03395937 0.04192699 -0.82381845 -0.14410296 -0.24208110 Ta 5.80338125 1.89434011 0.02310657 -0.06716747 0.91425766 -0.28825127 Ta 5.78944196 0.06835294 1.90191785 0.28796972 -0.29803721 0.82533013 Ta 3.81531235 1.93576040 1.92345932 0.66106745 -0.25274088 -0.28723838 Ta 0.01332552 3.85407530 0.04827158 -0.25250322 -0.62107591 -0.32336606 Ta 1.88973544 5.76596464 0.02382920 0.92087770 0.07468118 -0.14412182 Ta 1.94984204 3.85672840 1.95903162 -0.59969840 0.00205244 -0.32046565 Ta 0.02490723 5.74049712 1.89189863 -0.29182377 0.50946798 0.84040860 Ta 3.83228302 3.85179307 0.00383835 0.45395754 0.18131726 -1.62881523 Ta 5.75478584 5.77975259 0.02657540 -1.42223315 -1.42693109 1.44607277 Ta 5.80271025 3.81523528 1.90571179 1.43348264 0.38760929 -0.08461550 Ta 3.83748656 5.78149088 1.95109090 0.65317757 1.70190983 -0.55171454 Ta 0.01578350 0.03486986 3.82913322 -0.51898163 -0.39645137 -0.29836045 Ta 1.93105246 1.86998848 3.88947489 -0.41671071 1.00600242 -0.52474394 Ta 1.93918720 0.03171155 5.72407037 0.43181178 -0.67075674 0.72090706 Ta 0.01622191 1.93473675 5.76374489 -0.15188358 0.60726136 0.10925746 Ta 3.85932111 0.03055451 3.83569174 0.38418929 -2.26901399 0.02833743 Ta 5.74947050 1.90709679 3.88044008 2.08738635 0.17880603 0.05328674 Ta 5.77252009 0.00236660 5.77806133 -1.55782296 1.39705116 -1.34055526 Ta 3.83931982 1.95688053 5.76078907 0.25913078 -0.32416701 2.19313876 Ta 0.00182816 3.85250152 3.81504488 -1.61803238 0.03801705 0.39973499 Ta 1.94730687 5.80345588 3.83656702 -0.38585785 1.73209891 0.59377783 Ta 1.90613320 3.86953598 5.75767254 0.11688114 0.31426939 1.50241231 Ta 0.02762635 5.77774508 5.78728582 1.40108885 -1.47488727 -1.48624717 Ta 3.86530936 3.84462771 3.82518431 0.07925858 0.41930259 0.64258263 Ta 5.77322538 5.74429957 3.88686109 0.02001140 0.05604535 -0.86713745 Ta 5.71366983 3.87998910 5.79269169 0.35274159 -0.69797355 0.22708971 Ta 3.88439520 5.78581449 5.78766867 -0.98905845 -0.08615696 -0.22456562