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=191.00641645513517 stress="-14.125729736404347 0.7127315617375155 4.335701263701968 0.7127315617375155 -12.174682957787798 2.558900548690178 4.335701263701968 2.558900548690178 -18.94493381571616" pbc="F F T" W 0.29874826 0.05835534 -0.25354363 -144.06981316 -123.41985020 75.19637811 W 1.48193431 1.42001865 0.20070203 140.13400531 120.76153067 -71.41342194 W 1.20342959 0.28187239 1.51001192 196.38746370 -146.68161302 -30.23793406 W 0.10170120 1.37793365 1.21904386 -192.45165584 149.33993254 26.45497789