../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner B N AB_oP8_62_c_c a b/a c/a x1 z1 x2 z2 standard 1 4.8893 0.52995316 0.87709897 0.34049326 0.092227347 0.67766328 0.10799456 Sim_LAMMPS_ReaxFF_WeismillerVanDuinLee_2010_BHNO__SM_327381922729_001