../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Al Pd
AB_cP8_198_a_a
a x1 x2
standard
1
4.8859 0.84377254 0.14788294
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000