../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
C
A_hR2_166_c
a c/a x1
standard
1
2.4675532 5.0459694 0.83331463
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000