# generated using pymatgen data_Mg6FeW _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.68448200 _cell_length_b 5.84998200 _cell_length_c 10.90667000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6FeW _chemical_formula_sum 'Mg12 Fe2 W2' _cell_volume 298.88786122 _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 Mg Mg0 1 0.00000000 0.26204600 0.08138600 1.0 Mg Mg1 1 0.00000000 0.73795400 0.08138600 1.0 Mg Mg2 1 0.00000000 0.00000000 0.32639200 1.0 Mg Mg3 1 0.50000000 0.74198700 0.42311000 1.0 Mg Mg4 1 0.50000000 0.25801300 0.42311000 1.0 Mg Mg5 1 0.50000000 0.00000000 0.17060700 1.0 Mg Mg6 1 0.00000000 0.76204600 0.58138600 1.0 Mg Mg7 1 0.00000000 0.23795400 0.58138600 1.0 Mg Mg8 1 0.00000000 0.50000000 0.82639200 1.0 Mg Mg9 1 0.50000000 0.24198700 0.92311000 1.0 Mg Mg10 1 0.50000000 0.75801300 0.92311000 1.0 Mg Mg11 1 0.50000000 0.50000000 0.67060700 1.0 Fe Fe12 1 0.00000000 0.50000000 0.30221900 1.0 Fe Fe13 1 0.00000000 0.00000000 0.80221900 1.0 W W14 1 0.50000000 0.50000000 0.19179000 1.0 W W15 1 0.50000000 0.00000000 0.69179000 1.0