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=-39.51083220884202 stress="0.0002952926229352329 -9.065868653934399e-06 8.542011109533767e-07 -9.065868653934399e-06 0.00026237427603649174 1.256321951183106e-05 8.542011109533767e-07 1.256321951183106e-05 0.000244508304531348" pbc="F F F" Fe 20.88201197 20.93300593 20.72002482 0.97536756 1.21190002 1.07105205 Fe 22.40664645 22.63642086 22.46512192 -0.62464372 -0.91413208 -0.63942653 Fe 24.22586561 21.29391194 20.72614529 -0.68980512 0.80172477 0.89579599 Fe 25.52103145 22.27761356 22.68220204 -0.71803773 0.68761232 -0.23052718 Fe 20.89362841 24.23573857 21.02724172 0.42689459 -1.08585875 0.67398728 Fe 22.27538150 25.50273987 22.34887301 1.06128272 -0.83986724 0.76179470 Fe 24.22083292 23.97528771 20.98735431 -0.59218564 -0.42467556 0.88769886 Fe 25.42299150 25.40698366 22.68107110 -0.84949169 -0.81248352 0.35441127 Fe 20.82825321 21.13102478 24.09995250 1.43160980 1.20936155 -0.42747160 Fe 22.71581698 22.51193751 25.75226748 0.06799369 0.66536007 -1.43318392 Fe 23.96431997 21.04396501 24.14564079 -0.74511522 0.78514846 -0.19919161 Fe 25.70379337 22.73854596 25.26922180 -1.21711060 0.45761973 -0.55554953 Fe 20.78229695 24.02031036 24.18745344 1.74169027 -0.59074671 -0.66344095 Fe 22.52015752 25.37970777 25.77711528 0.60789489 -1.13343219 -1.11888222 Fe 23.87871118 23.75213077 23.73125112 -0.11854310 1.06228267 1.26421463 Fe 25.21824351 25.63616082 25.26429260 -0.75780070 -1.07981355 -0.64128122