../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner H A_hP2_194_c a c/a standard 4 4.651 0.79916147 3.302 1.6282556 3.446 1.6268717 3.5577 1.6337803 Sim_LAMMPS_ReaxFF_ChenowethVanDuinGoddard_2008_CHO__SM_584143153761_001