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=-0.5516120207674727 stress="0.09452384682222581 -0.006289377683336821 -0.0976379222517486 -0.006289377683336821 0.011723207815526934 -0.006528369935498008 -0.0976379222517486 -0.006528369935498008 0.0986574819897491" free_energy=-0.5516120207674727 pbc="T T F"
H       -0.07167693       0.16431082       0.03277713      -0.00401643       0.10706882      -0.09139369
H        1.12586504       1.37366136       0.21813893      -2.62708091      -0.26118477       2.74552096
H        1.28819214       0.19410236       1.33096497      -0.00522477       0.37593129      -0.19434361
H        0.06421401       1.43300593       1.22002482       2.63632211      -0.22181534      -2.45978367