../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner C Mn A2B5_mC28_15_f_e2f a b/a c/a beta y1 x2 y2 z2 x3 y3 z3 x4 y4 z4 standard 1 13.1364 0.38645291 0.43065832 82.0997 0.57007131 0.60406666 0.20169591 0.91946535 0.60110275 0.43058485 0.60171177 0.70725584 0.92922851 0.67884298 MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_002