# generated using pymatgen data_NaHfP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.31846598 _cell_length_b 9.31846584 _cell_length_c 3.90014168 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999266 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaHfP7Ru12 _chemical_formula_sum 'Na1 Hf1 P7 Ru12' _cell_volume 293.29177834 _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 Na Na0 1 0.33333300 0.66666700 0.00000000 1.0 Hf Hf1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.60243759 0.72240992 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.27759008 0.88002868 0.50000000 1.0 P P5 1 0.11997132 0.39756241 0.50000000 1.0 P P6 1 0.88788901 0.56989659 0.00000000 1.0 P P7 1 0.43010341 0.31799242 0.00000000 1.0 P P8 1 0.68200758 0.11211099 0.00000000 1.0 Ru Ru9 1 0.55789481 0.96058642 0.50000000 1.0 Ru Ru10 1 0.40269361 0.44210519 0.50000000 1.0 Ru Ru11 1 0.91654401 0.12071793 0.50000000 1.0 Ru Ru12 1 0.20417393 0.08345599 0.50000000 1.0 Ru Ru13 1 0.87928207 0.79582607 0.50000000 1.0 Ru Ru14 1 0.72613521 0.88951577 0.00000000 1.0 Ru Ru15 1 0.11048423 0.83661744 0.00000000 1.0 Ru Ru16 1 0.16338256 0.27386479 0.00000000 1.0 Ru Ru17 1 0.42452707 0.07646893 0.00000000 1.0 Ru Ru18 1 0.92353107 0.34805914 0.00000000 1.0 Ru Ru19 1 0.65194086 0.57547293 0.00000000 1.0 Ru Ru20 1 0.03941358 0.59730639 0.50000000 1.0