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=-16.265285097169762 stress="-28.217735446428215 -4.772975124599762 4.542735237304767 -4.772975124599762 -23.599044640672098 2.6970031580955034 4.542735237304767 2.6970031580955034 -24.510359905825112" pbc="F F F" W -0.17769156 -0.08950840 -0.27713580 -8.29994320 -7.77456868 -4.94499934 W 1.43858073 1.25205420 0.15488783 14.46138252 11.41961976 -10.59776199 W 1.55988540 -0.29754255 1.66431082 2.74663141 -7.85596120 7.28177482 W -0.18574270 1.48844065 1.53277713 -8.90807073 4.21091012 8.26098652