# generated using pymatgen data_NaMg6Bi _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.33249400 _cell_length_b 6.44207400 _cell_length_c 11.56266100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaMg6Bi _chemical_formula_sum 'Na2 Mg12 Bi2' _cell_volume 397.20424174 _cell_formula_units_Z 2 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 0.50000000 0.00000000 0.16731400 1.0 Na Na1 1 0.50000000 0.50000000 0.66731400 1.0 Mg Mg2 1 0.50000000 0.24827300 0.41634700 1.0 Mg Mg3 1 0.50000000 0.75172700 0.41634700 1.0 Mg Mg4 1 0.00000000 0.75365600 0.08001700 1.0 Mg Mg5 1 0.00000000 0.24634400 0.08001700 1.0 Mg Mg6 1 0.00000000 0.00000000 0.33548700 1.0 Mg Mg7 1 0.00000000 0.50000000 0.33843600 1.0 Mg Mg8 1 0.50000000 0.74827300 0.91634700 1.0 Mg Mg9 1 0.50000000 0.25172700 0.91634700 1.0 Mg Mg10 1 0.00000000 0.25365600 0.58001700 1.0 Mg Mg11 1 0.00000000 0.74634400 0.58001700 1.0 Mg Mg12 1 0.00000000 0.50000000 0.83548700 1.0 Mg Mg13 1 0.00000000 0.00000000 0.83843600 1.0 Bi Bi14 1 0.50000000 0.50000000 0.16603100 1.0 Bi Bi15 1 0.50000000 0.00000000 0.66603100 1.0