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=0.3495753581746961 stress="-0.8253011694111314 0.0441724337073473 -0.06950489777653396 0.0441724337073473 -0.8859780054702753 -0.15215901640146 -0.06950489777653396 -0.15215901640146 -0.866848190423327" pbc="F F F"
H      -0.14459490       0.11115480       0.11044915      -0.29773217      -0.38683548      -0.42731411 
H       1.70960170       1.31143450      -0.16166483       0.24794409       0.16728007      -0.17216175 
H       1.28829595      -0.16490224       1.64041416       0.24461618      -0.22340289       0.28808216 
H      -0.22187219       1.51878885       1.32834452      -0.19482811       0.44295830       0.31139370