# generated using pymatgen data_Mg6FeCu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.76329000 _cell_length_b 6.08972300 _cell_length_c 10.36266000 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg6FeCu _chemical_formula_sum 'Mg12 Fe2 Cu2' _cell_volume 300.59088762 _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 0.50000000 0.74886100 0.08364500 1.0 Mg Mg1 1 0.50000000 0.25113900 0.08364500 1.0 Mg Mg2 1 0.00000000 0.75267100 0.91039700 1.0 Mg Mg3 1 0.00000000 0.24732900 0.91039700 1.0 Mg Mg4 1 0.00000000 0.50000000 0.17410200 1.0 Mg Mg5 1 0.00000000 0.50000000 0.67272100 1.0 Mg Mg6 1 0.50000000 0.24886100 0.58364500 1.0 Mg Mg7 1 0.50000000 0.75113900 0.58364500 1.0 Mg Mg8 1 0.00000000 0.25267100 0.41039700 1.0 Mg Mg9 1 0.00000000 0.74732900 0.41039700 1.0 Mg Mg10 1 0.00000000 0.00000000 0.67410200 1.0 Mg Mg11 1 0.00000000 0.00000000 0.17272100 1.0 Fe Fe12 1 0.50000000 0.50000000 0.33190000 1.0 Fe Fe13 1 0.50000000 0.00000000 0.83190000 1.0 Cu Cu14 1 0.50000000 0.50000000 0.83319800 1.0 Cu Cu15 1 0.50000000 0.00000000 0.33319800 1.0