../../td/EquilibriumCrystalStructure__TD_457028483760_002/runner C N AB2_oC12_36_a_2a a b/a c/a y1 z1 y2 z2 y3 z3 standard 1 2.481 2.5961306 1.8476421 0.88747 0.22046 0.92442 0.5479 0.73734 0.67879 Sim_LAMMPS_ReaxFF_StrachanVanDuinChakraborty_2003_CHNO__SM_107643900657_001