../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
C
A_oC16_65_pq
a b/a c/a x1 y1 x2 y2
standard
1
4.2547 2.0610619 0.59089948 0.18519352 0.16660457 0.18446938 0.41082374
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000