../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner O Si A2B_oP24_54_abcd_f a b/a c/a y3 z4 x5 y5 z5 standard 1 7.1307 0.66198269 1.3705948 0.33541082 0.83999636 0.076103389 0.77328691 0.89786568 Sim_LAMMPS_ReaxFF_ManzanoMoeiniMarinelli_2012_CaSiOH__SM_714124634215_000