# generated using pymatgen data_Zr2Fe3P7Ru9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.16423903 _cell_length_b 9.16423841 _cell_length_c 3.78919210 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999168 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr2Fe3P7Ru9 _chemical_formula_sum 'Zr2 Fe3 P7 Ru9' _cell_volume 275.59420368 _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 Zr Zr0 1 0.00000000 0.00000000 0.00000000 1.0 Zr Zr1 1 0.33333300 0.66666700 0.50000000 1.0 Fe Fe2 1 0.82527141 0.60443701 0.00000000 1.0 Fe Fe3 1 0.77916460 0.17472859 0.00000000 1.0 Fe Fe4 1 0.39556299 0.22083540 0.00000000 1.0 P P5 1 0.08093501 0.63762336 0.00000000 1.0 P P6 1 0.55668835 0.91906499 0.00000000 1.0 P P7 1 0.36237664 0.44331165 0.00000000 1.0 P P8 1 0.78550915 0.73327674 0.50000000 1.0 P P9 1 0.94776859 0.21449085 0.50000000 1.0 P P10 1 0.26672326 0.05223141 0.50000000 1.0 P P11 1 0.66666700 0.33333300 0.00000000 1.0 Ru Ru12 1 0.09329076 0.39951940 0.00000000 1.0 Ru Ru13 1 0.30622963 0.90670924 0.00000000 1.0 Ru Ru14 1 0.60048060 0.69377037 0.00000000 1.0 Ru Ru15 1 0.05272907 0.77570049 0.50000000 1.0 Ru Ru16 1 0.72297243 0.94727093 0.50000000 1.0 Ru Ru17 1 0.22429951 0.27702757 0.50000000 1.0 Ru Ru18 1 0.87418776 0.42207403 0.50000000 1.0 Ru Ru19 1 0.54788626 0.12581224 0.50000000 1.0 Ru Ru20 1 0.57792597 0.45211374 0.50000000 1.0