# generated using pymatgen data_PrHfP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.36536060 _cell_length_b 9.36536049 _cell_length_c 3.91394719 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999601 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrHfP7Ru12 _chemical_formula_sum 'Pr1 Hf1 P7 Ru12' _cell_volume 297.29979750 _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 Hf Hf1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.60498285 0.72024975 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.27975025 0.88473411 0.50000000 1.0 P P5 1 0.11526589 0.39501715 0.50000000 1.0 P P6 1 0.88592365 0.56993689 0.00000000 1.0 P P7 1 0.43006311 0.31598677 0.00000000 1.0 P P8 1 0.68401323 0.11407635 0.00000000 1.0 Ru Ru9 1 0.56095172 0.96097644 0.50000000 1.0 Ru Ru10 1 0.40002572 0.43904828 0.50000000 1.0 Ru Ru11 1 0.91504162 0.12011618 0.50000000 1.0 Ru Ru12 1 0.20507456 0.08495838 0.50000000 1.0 Ru Ru13 1 0.87988382 0.79492544 0.50000000 1.0 Ru Ru14 1 0.72738478 0.89115612 0.00000000 1.0 Ru Ru15 1 0.10884388 0.83622666 0.00000000 1.0 Ru Ru16 1 0.16377334 0.27261522 0.00000000 1.0 Ru Ru17 1 0.42650273 0.07676912 0.00000000 1.0 Ru Ru18 1 0.92323088 0.34973461 0.00000000 1.0 Ru Ru19 1 0.65026539 0.57349727 0.00000000 1.0 Ru Ru20 1 0.03902356 0.59997428 0.50000000 1.0