# generated using pymatgen data_Na3RuN2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.89652736 _cell_length_b 9.01607197 _cell_length_c 15.13888674 _cell_angle_alpha 89.99999782 _cell_angle_beta 139.89441453 _cell_angle_gamma 117.09819951 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na3RuN2 _chemical_formula_sum 'Na12 Ru4 N8' _cell_volume 615.31663028 _cell_formula_units_Z 4 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 0.50000000 0.62571300 1.0 Na Na1 1 0.00000000 0.00000000 0.62428700 1.0 Na Na2 1 0.00000000 0.50000000 0.87428700 1.0 Na Na3 1 0.00000000 0.00000000 0.37571300 1.0 Na Na4 1 0.45212600 0.50000000 0.47606300 1.0 Na Na5 1 0.54787400 0.50000000 0.02393700 1.0 Na Na6 1 0.45212600 0.00000000 0.22606300 1.0 Na Na7 1 0.54787400 0.00000000 0.77393700 1.0 Na Na8 1 0.54787400 0.04787400 0.02393700 1.0 Na Na9 1 0.45212600 0.95212600 0.47606300 1.0 Na Na10 1 0.54787400 0.54787400 0.77393700 1.0 Na Na11 1 0.45212600 0.45212600 0.22606300 1.0 Ru Ru12 1 0.00000000 0.50000000 0.32530900 1.0 Ru Ru13 1 0.00000000 0.00000000 0.92469100 1.0 Ru Ru14 1 0.00000000 0.50000000 0.17469100 1.0 Ru Ru15 1 0.00000000 0.00000000 0.07530900 1.0 N N16 1 0.36854400 0.68427200 0.57192600 1.0 N N17 1 0.63145600 0.31572800 0.20338200 1.0 N N18 1 0.36854400 0.18427200 0.04661800 1.0 N N19 1 0.63145600 0.81572800 0.67807400 1.0 N N20 1 0.00000000 0.31572800 0.11234500 1.0 N N21 1 0.00000000 0.68427200 0.11234500 1.0 N N22 1 0.00000000 0.81572800 0.13765500 1.0 N N23 1 0.00000000 0.18427200 0.13765500 1.0