../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
Fe O
A3B4_cF56_227_ad_e
a x3
standard
2
8.5658 0.74434794
8.1218 0.25464885
Sim_LAMMPS_Buckingham_Vaari_2015_FeO__SM_672759489721_000