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=-0.7045255594847396 stress="0.03729319917865999 -0.002062119918636074 -0.0070449064730110245 -0.002062119918636074 0.04637771918834856 -0.02333896552639942 -0.0070449064730110245 -0.02333896552639942 0.07107969990938319" pbc="F F T"
user07       0.12489690       0.22883630      -0.08126828       0.27973967       0.71417679      -0.59493772 
user07       1.54652875       1.76499171       0.39937487      -0.24975432      -0.31167450       0.10163551 
user07       1.67411065       0.13922891       1.64071166      -0.43048034       0.33995373       0.01798620 
user07       0.16247133       1.22950916       1.71175639       0.40049499      -0.74245602       0.47531601