../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner O V A5B2_oP14_31_a2b_b a b/a c/a y1 z1 x2 y2 z2 x3 y3 z3 x4 y4 z4 standard 1 11.6222 0.39502848 0.31104266 0.50307456 0.012613974 0.85474025 0.96160804 0.0097763456 0.68153747 0.49240796 0.010042906 0.85089611 0.61179483 0.0095237619 Sim_LAMMPS_ReaxFF_ChenowethVanDuinPersson_2008_CHOV__SM_429148913211_001