../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner Cl O A2B_tI24_141_h_e a c/a z1 y2 z2 standard 1 7.9676 1.2305964 0.094491096 0.43054064 0.19196707 LJ_ElliottAkerson_2015_Universal__MO_959249795837_003