# generated using pymatgen data_Sc2Co3P7Ru9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.19868592 _cell_length_b 9.19868554 _cell_length_c 3.75942423 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000043 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Co3P7Ru9 _chemical_formula_sum 'Sc2 Co3 P7 Ru9' _cell_volume 275.48853520 _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 0.66666700 0.33333300 0.50000000 1.0 Sc Sc1 1 0.33333300 0.66666700 0.00000000 1.0 Co Co2 1 0.72865083 0.88790979 0.00000000 1.0 Co Co3 1 0.11209021 0.84073903 0.00000000 1.0 Co Co4 1 0.15926097 0.27134917 0.00000000 1.0 P P5 1 0.59651890 0.71526461 0.50000000 1.0 P P6 1 0.00000000 0.00000000 0.00000000 1.0 P P7 1 0.28473539 0.88125330 0.50000000 1.0 P P8 1 0.11874670 0.40348110 0.50000000 1.0 P P9 1 0.88760010 0.58479806 0.00000000 1.0 P P10 1 0.41520194 0.30280204 0.00000000 1.0 P P11 1 0.69719796 0.11239990 0.00000000 1.0 Ru Ru12 1 0.56139261 0.94533987 0.50000000 1.0 Ru Ru13 1 0.38394826 0.43860739 0.50000000 1.0 Ru Ru14 1 0.91474409 0.12029343 0.50000000 1.0 Ru Ru15 1 0.20554935 0.08525591 0.50000000 1.0 Ru Ru16 1 0.87970657 0.79445065 0.50000000 1.0 Ru Ru17 1 0.42705713 0.06461386 0.00000000 1.0 Ru Ru18 1 0.93538614 0.36244427 0.00000000 1.0 Ru Ru19 1 0.63755573 0.57294287 0.00000000 1.0 Ru Ru20 1 0.05466013 0.61605174 0.50000000 1.0