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=30.23703565043731 stress="-106.83109583911018 -22.95181537767157 -12.050264405328548 -22.95181537767157 -78.59609493964386 10.17672624543674 -12.050264405328548 10.17672624543674 -108.8137533770007" pbc="F F F" W 0.27219963 -0.06618674 0.13132919 -49.41112215 -41.59920062 -29.76981555 W 1.75978669 1.22592512 -0.21495266 31.79209625 40.82248178 -35.36394135 W 1.68365717 0.20288723 1.58343331 35.98379978 -19.81413907 50.68504362 W -0.20414597 1.44809454 1.72094491 -18.36477388 20.59085791 14.44871328