4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=8.181103676486115 stress="-34.64211140931693 -6.644255614448355 -2.94160444440079 -6.644255614448355 -25.120604665956662 2.779822196902895 -2.94160444440079 2.779822196902895 -35.10251325919427" pbc="F F F" Mo 0.27219963 -0.06618674 0.13132919 -15.37653960 -13.20041283 -9.52753211 Mo 1.75978669 1.22592512 -0.21495266 10.28772131 12.72918335 -11.43562821 Mo 1.68365717 0.20288723 1.58343331 11.52782619 -6.39210974 15.85907213 Mo -0.20414597 1.44809454 1.72094491 -6.43900790 6.86333921 5.10408818