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=40.35513052847268 stress="-3.081848006366902 -0.023402457646518802 0.015629796305809164 -0.023402457646518802 -1.9233911455242068 0.053820078520241225 0.015629796305809164 0.053820078520241225 -3.102225010425205" free_energy=40.35513052847268 pbc="T F T"
F       0.07166715       0.17379638       2.90411058      -4.36844817     -19.70774553       3.65747609 
F       1.45742157       1.37252202       0.05505238       3.47681628      18.90449983       2.17875937 
F       1.44057204       0.20040666       1.55646809       3.31412118     -19.10205943      -3.17557832 
F       0.03502127       1.66980798       1.61447158      -2.42248930      19.90530514      -2.66065714