# generated using pymatgen data_Sc2Ta3Co9P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.59987814 _cell_length_b 9.08131268 _cell_length_c 9.08131196 _cell_angle_alpha 119.99999028 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Ta3Co9P7 _chemical_formula_sum 'Sc2 Ta3 Co9 P7' _cell_volume 257.10806382 _cell_formula_units_Z 1 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 Sc Sc0 1 0.00000000 0.66666700 0.33333300 1.0 Sc Sc1 1 0.50000000 0.33333300 0.66666700 1.0 Ta Ta2 1 0.50000000 0.77220343 0.89817902 1.0 Ta Ta3 1 0.50000000 0.12597659 0.22779657 1.0 Ta Ta4 1 0.50000000 0.10182098 0.87402341 1.0 Co Co5 1 0.00000000 0.56548795 0.93288280 1.0 Co Co6 1 0.00000000 0.36739585 0.43451205 1.0 Co Co7 1 0.00000000 0.06711720 0.63260415 1.0 Co Co8 1 0.00000000 0.87777418 0.16516409 1.0 Co Co9 1 0.00000000 0.28739091 0.12222582 1.0 Co Co10 1 0.00000000 0.83483591 0.71260909 1.0 Co Co11 1 0.50000000 0.94610193 0.39006258 1.0 Co Co12 1 0.50000000 0.44396066 0.05389807 1.0 Co Co13 1 0.50000000 0.60993742 0.55603934 1.0 P P14 1 0.00000000 0.00000000 0.00000000 1.0 P P15 1 0.50000000 0.71155770 0.13183806 1.0 P P16 1 0.50000000 0.42028036 0.28844230 1.0 P P17 1 0.50000000 0.86816194 0.57971964 1.0 P P18 1 0.00000000 0.57586888 0.69019637 1.0 P P19 1 0.00000000 0.11432749 0.42413112 1.0 P P20 1 0.00000000 0.30980363 0.88567251 1.0