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=10473.6466019322 stress="-0.6090384223793782 -0.15598641139073133 0.04137574170430364 -0.15598641139073133 -0.5430072191083128 0.10974988779488132 0.04137574170430364 0.10974988779488132 -0.6188678987713553" pbc="F F F" Rb 21.14044101 21.05729035 20.88034387 -1324.60173086 -1191.88155981 -1390.53517475 Rb 22.39786097 22.42572050 22.55928898 3435.09887072 7289.82801542 -5691.92161156 Rb 23.95919078 21.21840085 20.94662027 1117.67443324 -1118.09251531 -1455.18835005 Rb 25.68912268 22.55264677 22.80182042 2064.35909279 12.35861786 -1404.94064073 Rb 21.24890471 24.09258953 20.74804010 -1741.14442025 -169.53361642 -1694.87713770 Rb 22.34345397 25.24019943 22.73017814 2814.15833834 4919.84379754 -2564.86374364 Rb 23.91751501 24.07136556 20.71208618 965.02686014 196.97409779 -757.90583768 Rb 25.43959364 25.54432230 22.68435189 1277.51012868 1454.43790286 -2727.01892676 Rb 21.13183245 21.22843610 23.92902047 -6226.76725217 -5756.91931330 5423.61917462 Rb 22.64469211 22.50135868 25.74689866 -402.76167102 -194.35570187 1646.37221895 Rb 23.87999172 21.02431090 23.77975890 1990.17952989 -3600.37946717 2268.97093356 Rb 25.53486778 22.78730700 25.54745765 2449.63754049 -2087.28595016 2676.98035485 Rb 20.83889013 24.02202644 23.98574328 -4760.08289283 -2262.42620200 2930.72075775 Rb 22.28686305 25.48015642 25.71411783 -4.04174660 837.02471087 938.48575909 Rb 24.06929586 24.05567244 24.14847460 -4978.79862708 -2289.07089958 -2352.27327630 Rb 25.46596778 25.56775094 25.20014041 3324.55354653 3959.47808327 4154.37550035