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=0.22415790557185697 stress="-0.4432842575243978 -0.01815789860717207 -0.00594746006784061 -0.01815789860717207 -0.43529740561805624 -0.008611340821598201 -0.00594746006784061 -0.008611340821598201 -0.5092347852058563" pbc="F F F"
H      -0.12320595      -0.04105180       0.20259391      -0.18774309      -0.14509405      -0.12268054 
H       1.56504129       1.20865944      -0.13449789       0.15234994       0.10928824      -0.18204888 
H       1.28802619       0.22277084       1.68584377       0.15865662      -0.16057083       0.19901303 
H       0.18362810       1.69581920       1.64685009      -0.12326347       0.19637663       0.10571639