../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner 
Fe O
A3B4_cF56_227_ad_e
a x3
standard
2
8.5658 0.74434794
8.1218 0.25464885
Sim_LAMMPS_ReaxFF_AryanpourVanDuinKubicki_2010_FeHO__SM_222964216001_001