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=1.8562487694091896 stress="-4.359761414805574 -0.05285627503574675 -0.3668078852656522 -0.05285627503574675 -10.610917437925256 -5.5490671428399665 -0.3668078852656522 -5.5490671428399665 -9.474945512010773" pbc="F F F" Ne -0.14459490 0.11115480 0.11044915 -1.63321677 -6.27314513 -6.07021447 Ne 1.70960170 1.18822856 0.04092907 1.51154230 1.30566590 -1.13209172 Ne 1.28829595 -0.16490224 1.64041416 1.03728018 -1.31391443 2.00143486 Ne -0.22187219 1.51878885 1.32834452 -0.91560572 6.28139366 5.20087133