../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner N O AB_mP8_14_e_e a b/a c/a beta x1 y1 z1 x2 y2 z2 standard 1 6.7939 0.58596682 0.97222508 126.6975 0.23828438 0.12511969 0.20101465 0.16010558 0.89661593 0.24269826 Sim_LAMMPS_ReaxFF_StrachanVanDuinChakraborty_2003_CHNO__SM_107643900657_001