4
Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=29.834573153948774 stress="-9.24333908774407 0.18015698437371502 -1.602128967363261 0.18015698437371502 -18.018156847774595 -1.0552608656001856 -1.602128967363261 -1.0552608656001856 -18.551240698073755" free_energy=29.834573153948774 pbc="F T T"
H       0.02015752       1.37970777       0.27711528     -33.28969297      -4.60046793      -5.09436544 
H       0.62871118       0.68756882       1.23125112      37.35329024      -8.06644860       4.57621198 
H       0.46824351       0.13616082       0.51429260      26.31681030       8.60552266       7.57784271 
H       0.12968218       0.92441470       1.12305591     -30.38040758       4.06139387      -7.05968925