# generated using pymatgen data_PaTaCo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.17667249 _cell_length_b 7.06651250 _cell_length_c 8.05212847 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaTaCo3 _chemical_formula_sum 'Pa4 Ta4 Co12' _cell_volume 294.55507975 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Pa Pa0 1 0.75000000 0.88505540 0.85030065 1.0 Pa Pa1 1 0.75000000 0.38505540 0.64969935 1.0 Pa Pa2 1 0.25000000 0.11494460 0.14969935 1.0 Pa Pa3 1 0.25000000 0.61494460 0.35030065 1.0 Ta Ta4 1 0.75000000 0.94537886 0.41047753 1.0 Ta Ta5 1 0.75000000 0.44537886 0.08952247 1.0 Ta Ta6 1 0.25000000 0.05462114 0.58952247 1.0 Ta Ta7 1 0.25000000 0.55462114 0.91047753 1.0 Co Co8 1 0.75000000 0.59166361 0.37045989 1.0 Co Co9 1 0.75000000 0.09166361 0.12954011 1.0 Co Co10 1 0.25000000 0.40833639 0.62954011 1.0 Co Co11 1 0.25000000 0.90833639 0.87045989 1.0 Co Co12 1 0.98887089 0.26466198 0.37636332 1.0 Co Co13 1 0.51112911 0.76466198 0.12363668 1.0 Co Co14 1 0.48887089 0.73533802 0.62363668 1.0 Co Co15 1 0.01112911 0.23533802 0.87636332 1.0 Co Co16 1 0.01112911 0.73533802 0.62363668 1.0 Co Co17 1 0.48887089 0.23533802 0.87636332 1.0 Co Co18 1 0.51112911 0.26466198 0.37636332 1.0 Co Co19 1 0.98887089 0.76466198 0.12363668 1.0