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=398.4689299958076 stress="-40.70436678848134 2.569872903986702 -0.0017951184159912589 2.569872903986702 -41.32629516572809 0.7733906887919906 -0.0017951184159912589 0.7733906887919906 -40.41056745192805" pbc="T T T" Si -0.14459490 0.11115480 0.11044915 12.04919770 12.30005450 5.86694918 Si 1.70960170 1.18822856 0.04092907 -4.87991402 5.01889204 -3.42810649 Si 1.28829595 -0.16490224 1.64041416 -4.89654587 -17.05289886 8.98870682 Si -0.22187219 1.51878885 1.32834452 -2.27273781 -0.26604768 -11.42754951