../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
O Si
A2B_mP12_7_4a_2a
a b/a c/a beta x1 y1 z1 x2 y2 z2 x3 y3 z3 x4 y4 z4 x5 y5 z5 x6 y6 z6
standard
1
4.2961 0.98950211 1.9382696 120.3224 0.66434967 0.28960781 0.4282055 0.33782167 0.31314343 0.60853798 0.86224246 0.21007071 0.11602385 0.0063323049 0.24773648 0.83575737 0.98277966 0.44807756 0.9954746 0.69910424 0.14268027 0.62081069
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000