# generated using pymatgen data_PrMgP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.37495878 _cell_length_b 9.37495754 _cell_length_c 3.91854326 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999907 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrMgP7Ru12 _chemical_formula_sum 'Pr1 Mg1 P7 Ru12' _cell_volume 298.25927521 _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 Pr Pr0 1 0.33333300 0.66666700 0.00000000 1.0 Mg Mg1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.60607890 0.71690548 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28309452 0.88917442 0.50000000 1.0 P P5 1 0.11082558 0.39392110 0.50000000 1.0 P P6 1 0.88854320 0.57629857 0.00000000 1.0 P P7 1 0.42370143 0.31224563 0.00000000 1.0 P P8 1 0.68775437 0.11145680 0.00000000 1.0 Ru Ru9 1 0.56039654 0.95688464 0.50000000 1.0 Ru Ru10 1 0.39648910 0.43960346 0.50000000 1.0 Ru Ru11 1 0.91437737 0.11801993 0.50000000 1.0 Ru Ru12 1 0.20364255 0.08562263 0.50000000 1.0 Ru Ru13 1 0.88198007 0.79635745 0.50000000 1.0 Ru Ru14 1 0.72730429 0.88793791 0.00000000 1.0 Ru Ru15 1 0.11206209 0.83936539 0.00000000 1.0 Ru Ru16 1 0.16063461 0.27269571 0.00000000 1.0 Ru Ru17 1 0.42774083 0.07436254 0.00000000 1.0 Ru Ru18 1 0.92563746 0.35337928 0.00000000 1.0 Ru Ru19 1 0.64662072 0.57225917 0.00000000 1.0 Ru Ru20 1 0.04311536 0.60351090 0.50000000 1.0