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=25.797013648723784 stress="-1.7725628010071746 -0.017862262928570845 0.08271755147835573 -0.017862262928570845 -2.609258937207745 0.24151499421097408 0.08271755147835573 0.24151499421097408 -1.9190846860034985" pbc="F T F" S 0.29768454 -0.01726309 0.17089611 -18.66397637 -9.61740815 -15.84256207 S 1.47011124 1.20220318 0.26235339 25.04339866 13.09232940 -21.26544595 S 1.34838096 0.21005355 1.71211731 17.56552521 -14.13252596 21.62917994 S 0.29594673 1.51397658 1.49042854 -23.94494750 10.65760471 15.47882808