../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Fe
A_hP2_194_c
a c/a
standard
1
2.4403 1.5759538
Sim_LAMMPS_ReaxFF_AryanpourVanDuinKubicki_2010_FeHO__SM_222964216001_001