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=94.45269573953134 stress="-9.824628927121369 0.7222440881280273 3.3863988756823935 0.7222440881280273 -8.0784459829787 1.993902604645639 3.3863988756823935 1.993902604645639 -12.622035799733661" pbc="F F T" W 0.29874826 0.05835534 -0.25354363 -101.13466367 -78.71944792 61.96893918 W 1.48193431 1.42001865 0.20070203 92.40310961 77.91937315 -53.11755632 W 1.20342959 0.28187239 1.51001192 143.09828155 -101.23734206 -27.52852487 W 0.10170120 1.37793365 1.21904386 -134.36672750 102.03741683 18.67714201