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=-4.200187447450956 stress="0.2251748242180397 -0.013515375347975688 0.0012686458667094125 -0.013515375347975688 0.31871879067562014 0.05298629539057304 0.0012686458667094125 0.05298629539057304 0.2316328110656807" pbc="F T F"
H       0.06210000       0.13362859       0.07034430       2.12977685       1.13792422       2.78337743 
H       1.54852473       1.55473499       0.13661615      -2.15084360      -0.01789320       2.35776451 
H       1.40480033      -0.03668887       1.29869006      -2.22783693       0.34428067      -2.54212466 
H       0.11041876       1.26735611       1.33533445       2.24890368      -1.46431169      -2.59901729