# generated using pymatgen data_NaMg6Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.95540600 _cell_length_b 6.29261500 _cell_length_c 10.77013400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaMg6Ni _chemical_formula_sum 'Na2 Mg12 Ni2' _cell_volume 335.83929555 _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 0.50000000 0.16755700 1.0 Na Na1 1 0.50000000 0.00000000 0.66755700 1.0 Mg Mg2 1 0.00000000 0.24160200 0.07810700 1.0 Mg Mg3 1 0.00000000 0.75839800 0.07810700 1.0 Mg Mg4 1 0.00000000 0.50000000 0.83444300 1.0 Mg Mg5 1 0.50000000 0.23335800 0.90749300 1.0 Mg Mg6 1 0.50000000 0.76664200 0.90749300 1.0 Mg Mg7 1 0.50000000 0.50000000 0.66394700 1.0 Mg Mg8 1 0.00000000 0.74160200 0.57810700 1.0 Mg Mg9 1 0.00000000 0.25839800 0.57810700 1.0 Mg Mg10 1 0.00000000 0.00000000 0.33444300 1.0 Mg Mg11 1 0.50000000 0.73335800 0.40749300 1.0 Mg Mg12 1 0.50000000 0.26664200 0.40749300 1.0 Mg Mg13 1 0.50000000 0.00000000 0.16394700 1.0 Ni Ni14 1 0.00000000 0.50000000 0.36285300 1.0 Ni Ni15 1 0.00000000 0.00000000 0.86285300 1.0