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=-10.606479446185187 stress="-44.65771162063171 -13.835070226998438 -7.046163000264325 -13.835070226998438 -33.1478809022198 6.292811595096307 -7.046163000264325 6.292811595096307 -44.10481889874103" pbc="F F F" W 0.27219963 -0.06618674 0.13132919 -23.20937439 -18.35359934 -11.76248017 W 1.75978669 1.22592512 -0.21495266 14.38473776 18.86580053 -14.68529266 W 1.68365717 0.20288723 1.58343331 14.54745892 -7.66681393 21.97797731 W -0.20414597 1.44809454 1.72094491 -5.72282229 7.15461275 4.46979552