../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
C
A_oP16_62_4c
a b/a c/a x1 z1 x2 z2 x3 z3 x4 z4
standard
1
9.0838 0.27794535 0.45742971 0.80509054 0.074368855 0.18951676 0.70009446 0.5207376 0.90843723 0.46345886 0.56850299
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000