../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
C
A_hR4_166_2c
a c/a x1 x2
standard
1
2.467734 14.757233 0.94637264 0.72030293
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000