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=-0.6766564783209023 stress="2.9247826686166123 0.6399812608873491 -0.6651213561078068 0.6399812608873491 2.6398499120661865 -0.26487240438424364 -0.6651213561078068 -0.26487240438424364 2.656515063775755" pbc="F F F"
H      -0.17769156      -0.08950840      -0.27713580       0.84834195       0.91099309       0.49432859 
H       1.43858073       1.25205420       0.15488783      -1.61399219      -1.30806421       1.20753285 
H       1.55988540      -0.29754255       1.66431082      -0.17756787       0.84634496      -0.74487943 
H      -0.18574270       1.48844065       1.53277713       0.94321811      -0.44927384      -0.95698202