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:Z:I:1:forces:R:3 energy=-1532.64214435 pbc="T T T" H 0.27309356 -0.09015778 0.18827503 1 1410.16363618 1669.85853122 3818.97011099 H 1.27177432 1.68896274 0.17175145 1 1796.53455373 -2343.52074324 -478.40626597 H 1.03533336 -0.16384249 1.15328567 1 -3142.49594652 617.18197242 -3451.71402945 H 0.09863756 1.65510341 1.36589988 1 -64.20224339 56.48023961 111.15018444