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:Z:I:1:forces:R:3 energy=-7.955500829068098 pbc="T T T"
H      -0.14459490       0.11115480       0.11044915        1      -0.20715652      -0.58636448      -1.25638185 
H       0.95960170       0.56143450      -0.16166483        1      -0.18967194      -0.12997199       0.18264387 
H       0.53829595      -0.16490224       0.89041416        1       0.79584201      -0.43182826       0.52066264 
H      -0.22187219       0.64558290       0.57834452        1      -0.39901354       1.14816472       0.55307534