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:Z:I:1:forces:R:3 energy=85.1013612155 pbc="F T F" W -0.09481051 -0.17769156 -0.18978866 74 -117.96854133 -2.56627958 -60.05490575 W 1.22286420 1.31224209 -0.02980687 74 122.43326270 4.80628666 -199.36783213 W 1.65488783 -0.17295391 1.20245745 74 143.33424086 -5.51673353 89.64965249 W 0.35841318 1.31425730 1.48844065 74 -147.79896223 3.27672645 169.77308538