../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Au O
A2B3_oF40_43_b_ab
a b/a c/a z1 x2 y2 z2 x3 y3 z3
standard
1
12.9784 0.81956173 0.30815817 0.80751768 0.54590386 0.36631138 0.49633412 0.91790654 0.26747974 0.12845704
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000