../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
O Si
A2B_tP12_92_b_a
a c/a x1 x2 y2 z2
standard
2
5.0168 1.3894714 0.30283022 0.23778777 0.11033928 0.18216985
5.1391 1.4015489 0.28644073 0.24374505 0.078395954 0.16640477
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000