# generated using pymatgen data_NaLiP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.34249757 _cell_length_b 9.34249717 _cell_length_c 3.87700898 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001334 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaLiP7Ru12 _chemical_formula_sum 'Na1 Li1 P7 Ru12' _cell_volume 293.05784324 _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 0.00000000 0.00000000 0.00000000 1.0 Li Li1 1 0.33333300 0.66666700 0.50000000 1.0 P P2 1 0.66666700 0.33333300 0.00000000 1.0 P P3 1 0.08385832 0.64506190 0.00000000 1.0 P P4 1 0.56120357 0.91614168 0.00000000 1.0 P P5 1 0.35493810 0.43879643 0.00000000 1.0 P P6 1 0.77775110 0.73147585 0.50000000 1.0 P P7 1 0.95372475 0.22224890 0.50000000 1.0 P P8 1 0.26852415 0.04627525 0.50000000 1.0 Ru Ru9 1 0.09711931 0.41004551 0.00000000 1.0 Ru Ru10 1 0.31292720 0.90288069 0.00000000 1.0 Ru Ru11 1 0.58995449 0.68707280 0.00000000 1.0 Ru Ru12 1 0.82151773 0.60674323 0.00000000 1.0 Ru Ru13 1 0.78522650 0.17848227 0.00000000 1.0 Ru Ru14 1 0.39325677 0.21477350 0.00000000 1.0 Ru Ru15 1 0.06045511 0.77321603 0.50000000 1.0 Ru Ru16 1 0.71276092 0.93954489 0.50000000 1.0 Ru Ru17 1 0.22678397 0.28723908 0.50000000 1.0 Ru Ru18 1 0.87111228 0.41989569 0.50000000 1.0 Ru Ru19 1 0.54878341 0.12888772 0.50000000 1.0 Ru Ru20 1 0.58010431 0.45121659 0.50000000 1.0