../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
O Si
A2B_oC48_63_defg_h
a b/a c/a x2 y3 z3 x4 y4 x5 y5 z5
standard
1
9.6444 1.0811766 0.93911493 0.21216613 0.8413267 0.452511 0.19886684 0.87098576 0.83557118 0.13445924 0.57489414
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000