../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner B O A2B3_hP15_152_c_ac a c/a x1 x2 y2 z2 x3 y3 z3 standard 1 4.4022 1.9793058 0.82746302 0.22148791 0.82060557 0.55755297 0.12803996 0.53686186 0.46240814 Sim_LAMMPS_ReaxFF_WeismillerVanDuinLee_2010_BHNO__SM_327381922729_001