../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner C Nb AB2_oP12_62_c_2c a b/a c/a x1 z1 x2 z2 x3 z3 standard 1 11.017 0.28244531 0.45461559 0.37551846 0.0083189479 0.045338881 0.25390772 0.2039061 0.76315541 LJ_ElliottAkerson_2015_Universal__MO_959249795837_003