../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner Ca O Si A2B4C_hP14_186_ab_bc_b a c/a z1 z2 z3 z4 x5 z5 standard 1 5.5468 1.3401961 0.55315574 0.82683114 0.55579836 0.33848546 0.16994112 0.27480827 LJ_ElliottAkerson_2015_Universal__MO_959249795837_003