../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner C V AB2_oP12_60_c_d a b/a c/a y1 x2 y2 z2 standard 1 4.5567 1.2823535 1.1099919 0.62542827 0.75819864 0.11679037 0.92394164 Sim_LAMMPS_ReaxFF_ChenowethVanDuinPersson_2008_CHOV__SM_429148913211_001