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=2.2557109227133667 stress="-12.53967605508267 -0.1947089185154387 -4.9930577786039105 -0.1947089185154387 -8.577745917054449 -1.506359944490221 -4.9930577786039105 -1.506359944490221 -10.939496205454795" pbc="F F F"
H       0.18220204      -0.10637159       0.23573857      -7.09592059      -4.41532236      -6.53257016 
H       1.52724172       1.27538150      -0.29703668       1.34914895       2.27439124      -2.43539556 
H       1.34887301       0.22083292       1.28984966       8.69966944      -1.79746481       7.35660057 
H      -0.01264569       1.42299150       1.40698366      -2.95289780       3.93839593       1.61136515