../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner Al O Si A2B5C_oP32_58_eg_3gh_g a b/a c/a z1 x2 y2 x3 y3 x4 y4 x5 y5 x6 y6 x7 y7 z7 standard 1 7.8719 1.0133767 0.71291556 0.24176195 0.87068038 0.36093363 0.92416589 0.13720313 0.57597379 0.63624326 0.89745818 0.59946173 0.75417182 0.74788881 0.76895855 0.86603863 0.23957634 Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000