# generated using pymatgen data_CsMg6W _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.19786000 _cell_length_b 9.81696500 _cell_length_c 9.89527200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CsMg6W _chemical_formula_sum 'Cs2 Mg12 W2' _cell_volume 407.78658044 _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 Cs Cs0 1 0.50000000 0.37670400 0.50000000 1.0 Cs Cs1 1 0.50000000 0.87670400 0.00000000 1.0 Mg Mg2 1 0.50000000 0.11992900 0.25561400 1.0 Mg Mg3 1 0.50000000 0.11992900 0.74438600 1.0 Mg Mg4 1 0.00000000 0.87488800 0.29717900 1.0 Mg Mg5 1 0.00000000 0.87488800 0.70282100 1.0 Mg Mg6 1 0.00000000 0.07890700 0.50000000 1.0 Mg Mg7 1 0.00000000 0.67460500 0.50000000 1.0 Mg Mg8 1 0.50000000 0.61992900 0.75561400 1.0 Mg Mg9 1 0.50000000 0.61992900 0.24438600 1.0 Mg Mg10 1 0.00000000 0.37488800 0.79717900 1.0 Mg Mg11 1 0.00000000 0.37488800 0.20282100 1.0 Mg Mg12 1 0.00000000 0.57890700 0.00000000 1.0 Mg Mg13 1 0.00000000 0.17460500 0.00000000 1.0 W W14 1 0.50000000 0.88015200 0.50000000 1.0 W W15 1 0.50000000 0.38015200 0.00000000 1.0