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=2.168353639202402 stress="-0.6033720566546066 0.0006346835250215921 -0.1340087588420829 0.0006346835250215921 -0.5756275266350206 -0.06212500962324952 -0.1340087588420829 -0.06212500962324952 -0.5308980275316385" pbc="F T F"
H       0.15720406      -0.23435154       0.29768454      -9.38173728       1.55772943      -6.41203575 
H       1.48273691       1.36065667       0.17089611       3.25622509      -3.78032979      -6.22035148 
H       1.47011124      -0.29779682       1.21755886       9.38161467       3.94127838       8.72296520 
H       0.26235339       1.34838096       1.71005355      -3.25610248      -1.71867802       3.90942203