../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner N O A2B5_hP14_194_bc_fh a c/a z3 x4 standard 1 5.6013 1.1782086 0.42288663 0.86938668 Sim_LAMMPS_ReaxFF_WeismillerVanDuinLee_2010_BHNO__SM_327381922729_001