../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner C N A3B4_hR7_160_b_ab a c/a x1 x2 z2 x3 z3 standard 1 4.7808966 2.1576985 0.66253263 0.48714429 0.016681115 0.16742874 0.65664018 Sim_LAMMPS_ReaxFF_StrachanVanDuinChakraborty_2003_CHNO__SM_107643900657_001