../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner Ca Zn A5B3_tI32_140_cl_ah a c/a x3 x4 z4 standard 1 7.8737 1.9606157 0.61666678 0.82968011 0.14786672 LJ_ElliottAkerson_2015_Universal__MO_959249795837_003