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=32576.015921008064 stress="-160485.6342290277 43606.53792850568 -126902.65237905807 43606.53792850568 -64655.91188725995 19305.645887727376 -126902.65237905807 19305.645887727376 -173221.57080312906" pbc="F F F" Np 0.17008104 0.12766755 0.02797804 -114741.69989048 12248.17839247 -124726.71379402 Np 1.75105327 1.66166009 -0.15903239 9140.36579339 9919.89968502 -4569.33220928 Np 1.38885939 -0.20402375 1.30060286 119470.15356983 -47993.85093660 110524.63710263 Np 0.13926851 1.42558483 1.71728449 -13868.81947273 25825.77285911 18771.40890067