# generated using pymatgen data_Mg2Al5Cu6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.18632828 _cell_length_b 8.18632828 _cell_length_c 8.18632828 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2Al5Cu6 _chemical_formula_sum 'Mg6 Al15 Cu18' _cell_volume 548.61473622 _cell_formula_units_Z 3 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 0.67921091 0.00000000 0.50000000 1.0 Mg Mg1 1 0.50000000 0.32078909 -0.00000000 1.0 Mg Mg2 1 0.00000000 0.50000000 0.32078909 1.0 Mg Mg3 1 0.50000000 0.67921091 -0.00000000 1.0 Mg Mg4 1 0.00000000 0.50000000 0.67921091 1.0 Mg Mg5 1 0.32078909 0.00000000 0.50000000 1.0 Al Al6 1 0.50000000 0.00000000 0.83311160 1.0 Al Al7 1 0.21787519 0.21787519 0.21787519 1.0 Al Al8 1 0.78212481 0.78212481 0.21787519 1.0 Al Al9 1 0.21787519 0.78212481 0.78212481 1.0 Al Al10 1 0.83311160 0.50000000 -0.00000000 1.0 Al Al11 1 0.78212481 0.78212481 0.78212481 1.0 Al Al12 1 0.21787519 0.21787519 0.78212481 1.0 Al Al13 1 0.78212481 0.21787519 0.21787519 1.0 Al Al14 1 0.21787519 0.78212481 0.21787519 1.0 Al Al15 1 0.00000000 0.83311160 0.50000000 1.0 Al Al16 1 0.50000000 0.00000000 0.16688840 1.0 Al Al17 1 0.00000000 0.16688840 0.50000000 1.0 Al Al18 1 0.16688840 0.50000000 -0.00000000 1.0 Al Al19 1 0.50000000 0.50000000 0.50000000 1.0 Al Al20 1 0.78212481 0.21787519 0.78212481 1.0 Cu Cu21 1 0.50000000 0.24539569 0.33448699 1.0 Cu Cu22 1 0.33448699 0.50000000 0.24539569 1.0 Cu Cu23 1 0.24539569 0.33448699 0.50000000 1.0 Cu Cu24 1 0.75460431 0.66551301 0.50000000 1.0 Cu Cu25 1 0.33448699 0.50000000 0.75460431 1.0 Cu Cu26 1 0.75460431 0.33448699 0.50000000 1.0 Cu Cu27 1 0.66551301 0.50000000 0.24539569 1.0 Cu Cu28 1 0.66551301 0.50000000 0.75460431 1.0 Cu Cu29 1 0.24539569 0.66551301 0.50000000 1.0 Cu Cu30 1 0.50000000 0.75460431 0.66551301 1.0 Cu Cu31 1 0.50000000 0.24539569 0.66551301 1.0 Cu Cu32 1 0.50000000 0.75460431 0.33448699 1.0 Cu Cu33 1 0.77249982 0.00000000 -0.00000000 1.0 Cu Cu34 1 0.00000000 0.77249982 -0.00000000 1.0 Cu Cu35 1 0.00000000 0.00000000 0.22750018 1.0 Cu Cu36 1 0.00000000 0.22750018 -0.00000000 1.0 Cu Cu37 1 0.22750018 0.00000000 -0.00000000 1.0 Cu Cu38 1 0.00000000 0.00000000 0.77249982 1.0