16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=58.097175472886036 stress="-0.0005122654511031477 -6.748275365864393e-05 -0.00011828625669249612 -6.748275365864393e-05 -0.0008387588008755419 -3.5938644571058915e-05 -0.00011828625669249612 -3.5938644571058915e-05 -0.0003729832447828314" free_energy=58.097175472886036 pbc="F F F" Ta 20.90332151 21.19410236 20.96064715 -3.18125910 -4.84966776 -1.57160230 Ta 22.38201197 22.43300593 22.22002482 3.68959136 -2.63538860 13.14949076 Ta 23.77696427 20.91661558 21.18492720 3.23528272 -3.52921105 -1.10250429 Ta 25.68047504 22.79391194 22.22614529 0.88440515 -3.62157857 2.63566029 Ta 21.02103145 23.77761356 21.18220204 -5.72460800 6.24055273 -5.61104180 Ta 22.39362841 25.73573857 22.52724172 5.56949283 2.49284649 -2.34758694 Ta 23.77538150 23.70296332 20.84887301 2.25733365 4.75636009 -3.04436088 Ta 25.72083292 25.28984966 22.56063367 -2.09938776 1.45287712 -0.69899515 Ta 20.92299150 20.90698366 24.18107110 1.80627119 1.64162407 -2.16990499 Ta 22.52815044 22.63102478 25.59995250 -3.46870593 -3.04144708 3.53115663 Ta 24.26120756 21.01193751 24.25226748 -2.73266915 -3.61210814 -4.62119953 Ta 25.46431997 22.67357700 25.57236142 6.47018525 -3.35702438 5.00137333 Ta 21.20379337 24.23854596 23.76922180 -8.00720424 -5.77018018 1.39388674 Ta 22.28229695 25.39456895 25.45310190 2.92846305 3.86241843 4.06988742 Ta 24.02015752 23.76478378 24.27711528 -4.33930273 3.40958932 -11.55592944 Ta 25.37871118 25.25213077 25.23125112 2.71211172 6.56033753 2.94167015