# generated using pymatgen data_Mg6FeCu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.79924800 _cell_length_b 6.02591600 _cell_length_c 10.38577200 _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 300.35512739 _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 0.76075600 0.41061000 1.0 Mg Mg1 1 0.00000000 0.23924400 0.41061000 1.0 Mg Mg2 1 0.00000000 0.00000000 0.66534900 1.0 Mg Mg3 1 0.50000000 0.73751400 0.59169900 1.0 Mg Mg4 1 0.50000000 0.26248600 0.59169900 1.0 Mg Mg5 1 0.50000000 0.00000000 0.83464600 1.0 Mg Mg6 1 0.00000000 0.26075600 0.91061000 1.0 Mg Mg7 1 0.00000000 0.73924400 0.91061000 1.0 Mg Mg8 1 0.00000000 0.50000000 0.16534900 1.0 Mg Mg9 1 0.50000000 0.23751400 0.09169900 1.0 Mg Mg10 1 0.50000000 0.76248600 0.09169900 1.0 Mg Mg11 1 0.50000000 0.50000000 0.33464600 1.0 Fe Fe12 1 0.00000000 0.00000000 0.17046400 1.0 Fe Fe13 1 0.00000000 0.50000000 0.67046400 1.0 Cu Cu14 1 0.50000000 0.00000000 0.32492200 1.0 Cu Cu15 1 0.50000000 0.50000000 0.82492200 1.0