../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
O Si
A2B_hR36_166_fg2h_i
a c/a x1 x2 x3 z3 x4 z4 x5 y5 z5
standard
1
13.70749 1.090689 0.26315745 0.85227209 0.25057069 0.89011196 0.02226603 0.31868613 0.1043425 0.33288518 0.8755116
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000