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=1025.1412683151652 stress="-4516.335858533652 1923.5367725919846 785.6448117657665 1923.5367725919846 -4552.0527309542085 -631.0496605577055 785.6448117657665 -631.0496605577055 -3967.9414990833648" pbc="F F F" Cf -0.22868067 -0.03132600 -0.12179854 -1108.61195982 -439.26604232 -1062.44518136 Cf 1.35084498 1.68274392 -0.11206637 857.54764728 778.83002998 -1319.25115266 Cf 1.46525698 -0.22154928 1.08867338 2557.80114226 -2513.10623594 75.15438979 Cf 0.27893610 1.22884379 1.56462577 -2306.73682972 2173.54224828 2306.54194423