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=52.33791689003396 stress="-213.77546947718764 70.66080016759014 -24.188035798666874 70.66080016759014 -278.59887498101136 -33.22101244374764 -24.188035798666874 -33.22101244374764 -180.68239132138376" pbc="F F F" W -0.00206453 0.28187239 0.01001192 -68.23842035 -81.15675705 -85.28948478 W 1.48453339 1.60170120 -0.12206635 58.23611430 45.35599872 -22.44832955 W 1.21904386 0.00082602 1.74624097 116.86639783 -133.15852359 38.96596627 W 0.14302402 1.35498893 1.61042859 -106.86409178 168.95928192 68.77184806