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=0.07545718728575088 stress="-0.008966672696251362 -0.0036519117595442577 0.0010765840829607017 -0.0036519117595442577 -0.007549523286488634 -0.003745629044998013 0.0010765840829607017 -0.003745629044998013 -0.0054881130162349676" free_energy=0.07545718728575088 pbc="T T F"
H       -0.15344509      -0.12758765       0.15488783      -0.06346376       0.06103570      -0.15386611
H        1.55988540       1.20245745       0.16431082       0.08820400      -0.13689155       0.04204842
H        1.31425730      -0.01155935       1.53277713       0.03362138       0.04662145       0.02422008
H       -0.10028026       1.37366136       1.46097674      -0.05836162       0.02923440       0.08759760