# generated using pymatgen data_CeHfP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.35142152 _cell_length_b 9.35142083 _cell_length_c 3.89764881 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999464 _symmetry_Int_Tables_number 1 _chemical_formula_structural CeHfP7Ru12 _chemical_formula_sum 'Ce1 Hf1 P7 Ru12' _cell_volume 295.18113263 _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 Ce Ce0 1 0.33333300 0.66666700 0.00000000 1.0 Hf Hf1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.60324129 0.71871674 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28128326 0.88452655 0.50000000 1.0 P P5 1 0.11547345 0.39675871 0.50000000 1.0 P P6 1 0.88545256 0.57065107 0.00000000 1.0 P P7 1 0.42934893 0.31480149 0.00000000 1.0 P P8 1 0.68519851 0.11454744 0.00000000 1.0 Ru Ru9 1 0.55730258 0.95351022 0.50000000 1.0 Ru Ru10 1 0.39620765 0.44269742 0.50000000 1.0 Ru Ru11 1 0.91389454 0.12104142 0.50000000 1.0 Ru Ru12 1 0.20714689 0.08610546 0.50000000 1.0 Ru Ru13 1 0.87895858 0.79285311 0.50000000 1.0 Ru Ru14 1 0.72598590 0.89055897 0.00000000 1.0 Ru Ru15 1 0.10944103 0.83542492 0.00000000 1.0 Ru Ru16 1 0.16457508 0.27401410 0.00000000 1.0 Ru Ru17 1 0.42813447 0.07653787 0.00000000 1.0 Ru Ru18 1 0.92346213 0.35159760 0.00000000 1.0 Ru Ru19 1 0.64840240 0.57186553 0.00000000 1.0 Ru Ru20 1 0.04648978 0.60379235 0.50000000 1.0