# generated using pymatgen data_LaLuP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.39554469 _cell_length_b 9.39554382 _cell_length_c 3.93490423 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999617 _symmetry_Int_Tables_number 1 _chemical_formula_structural LaLuP7Ru12 _chemical_formula_sum 'La1 Lu1 P7 Ru12' _cell_volume 300.82138039 _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 La La0 1 0.33333300 0.66666700 0.00000000 1.0 Lu Lu1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.60768004 0.71855059 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28144941 0.88913045 0.50000000 1.0 P P5 1 0.11086955 0.39231996 0.50000000 1.0 P P6 1 0.88711734 0.57119970 0.00000000 1.0 P P7 1 0.42880030 0.31591664 0.00000000 1.0 P P8 1 0.68408336 0.11288266 0.00000000 1.0 Ru Ru9 1 0.56044919 0.95740750 0.50000000 1.0 Ru Ru10 1 0.39695831 0.43955081 0.50000000 1.0 Ru Ru11 1 0.91451503 0.11831968 0.50000000 1.0 Ru Ru12 1 0.20380465 0.08548497 0.50000000 1.0 Ru Ru13 1 0.88168032 0.79619535 0.50000000 1.0 Ru Ru14 1 0.72872991 0.89168133 0.00000000 1.0 Ru Ru15 1 0.10831867 0.83704658 0.00000000 1.0 Ru Ru16 1 0.16295342 0.27127009 0.00000000 1.0 Ru Ru17 1 0.42283092 0.07178529 0.00000000 1.0 Ru Ru18 1 0.92821471 0.35104763 0.00000000 1.0 Ru Ru19 1 0.64895237 0.57716908 0.00000000 1.0 Ru Ru20 1 0.04259250 0.60304169 0.50000000 1.0