../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Si A_hP58_164_2d3i3j a c/a z1 z2 x3 z3 x4 z4 x5 z5 x6 y6 z6 x7 y7 z7 x8 y8 z8 standard 1 10.017 1.6093441 0.42717347 0.57149774 0.13353688 0.49951896 0.20865981 0.62176631 0.20852652 0.37695719 0.38057577 0.3795477 0.29513767 0.00061200299 0.24460663 0.17356382 0.33353138 0.4211924 0.058121322 Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000