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=51.92479452342953 stress="-8.589464772315674 0.33158147152532386 -0.04463204381249431 0.33158147152532386 -3.9985278624007767 0.1828899099922207 -0.04463204381249431 0.1828899099922207 -3.6922903850771225" pbc="T F F" Si -0.00058651 0.09073906 0.27219963 -4.94608885 -40.42499089 -41.42639743 Si 1.43381326 1.63132919 0.25978669 7.22251941 35.00055252 -34.55881305 Si 1.22592512 0.18365717 1.70288723 15.58742151 -42.70977209 38.90316287 Si 0.08343331 1.29585403 1.44809454 -17.86385206 48.13421045 37.08204761