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=129876.0404447019 stress="-19621.34140346234 -5877.35947318973 -5134.580318114361 -5877.35947318973 -20890.801645687454 4964.817231266927 -5134.580318114361 4964.817231266927 -17691.621898403566" pbc="T T T" K 0.28573211 -0.01336556 0.22064473 -315966.86896054 -244106.58634886 -106095.90428309 K 1.30994063 1.20939468 0.15177104 231054.87951855 345327.07151801 -132220.27216655 K 1.57445392 0.02632905 1.28211217 179021.75811047 -154585.86710326 227002.25059739 K 0.30137175 1.30624087 1.66477742 -94109.76866848 53365.38193411 11313.92585226