4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=396.52432079971516 stress="-1214.6215749992361 1114.1627970415923 -1007.5277780626566 1114.1627970415923 -2700.814909335156 826.3001170232028 -1007.5277780626566 826.3001170232028 -864.030957933468" pbc="F T F" Ne 0.13671235 -0.03355267 -0.09761584 -665.06179228 -2031.59268482 -701.98999742 Ne 0.28380242 0.41577416 0.05762686 667.84325124 2024.73681906 672.75001978 Ne 0.46452956 0.26244879 0.93000633 4467.70822231 -5651.69097717 3626.22703019 Ne 0.21460162 0.57861327 0.72718553 -4470.48968126 5658.54684293 -3596.98705256