../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
C
A_hP12_194_bc2f
a c/a z3 z4
standard
1
2.4678 13.950077 0.86916696 0.13083843
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000