../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
O Si
A2B_tP48_126_fik_k
a c/a x2 x3 y3 z3 x4 y4 z4
standard
1
11.2802 0.45787309 0.48190928 0.11664651 0.84097387 0.15112788 0.056886411 0.86952041 0.87299833
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000