../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Fe P AB4_oC20_20_a_2c a b/a c/a x1 x2 y2 z2 x3 y3 z3 standard 1 10.295 0.48907237 0.54206897 0.8270546 0.318953 0.3195738 0.6130011 0.4830168 0.78953358 0.94826365 LJ_ElliottAkerson_2015_Universal__MO_959249795837_003