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=3722.454596330468 stress="-12998.806236545439 -1247.61109647481 3241.616299653535 -1247.61109647481 -17608.19380933843 -6708.1022470615535 3241.616299653535 -6708.1022470615535 -16921.448878108582" pbc="F F F"
Ds       0.28369131       0.27904508       0.13171192   -3548.69987317  -12764.72671868   -9984.63758375 
Ds       1.32915751       1.47726423       0.16391275    8227.11646319    5476.14181385   -4140.06758578 
Ds       1.28688217       0.18130394       1.75625621    3683.13639694   -3554.83385763    2091.35229349 
Ds       0.19964648       1.26573780       1.26666311   -8361.55298696   10843.41876247   12033.35287604