# generated using pymatgen data_Mg11Cu2O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 19.64379805 _cell_length_b 19.64379805 _cell_length_c 19.64379805 _cell_angle_alpha 171.16170127 _cell_angle_beta 167.56728967 _cell_angle_gamma 15.27435577 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg11Cu2O13 _chemical_formula_sum 'Mg11 Cu2 O13' _cell_volume 250.73384859 _cell_formula_units_Z 1 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 0.57692900 0.07692900 0.50000000 1.0 Mg Mg1 1 0.50000000 0.00000000 0.50000000 1.0 Mg Mg2 1 0.42307100 0.92307100 0.50000000 1.0 Mg Mg3 1 0.80801900 0.30801900 0.50000000 1.0 Mg Mg4 1 0.88427500 0.38427500 0.50000000 1.0 Mg Mg5 1 0.73082100 0.23082100 0.50000000 1.0 Mg Mg6 1 0.11572500 0.61572500 0.50000000 1.0 Mg Mg7 1 0.26917900 0.76917900 0.50000000 1.0 Mg Mg8 1 0.96147100 0.46147100 0.50000000 1.0 Mg Mg9 1 0.03852900 0.53852900 0.50000000 1.0 Mg Mg10 1 0.19198100 0.69198100 0.50000000 1.0 Cu Cu11 1 0.65383600 0.15383600 0.50000000 1.0 Cu Cu12 1 0.34616400 0.84616400 0.50000000 1.0 O O13 1 0.84614300 0.84614300 0.00000000 1.0 O O14 1 0.61398600 0.61398600 0.00000000 1.0 O O15 1 0.53839200 0.53839200 0.00000000 1.0 O O16 1 0.46160800 0.46160800 0.00000000 1.0 O O17 1 0.69370700 0.69370700 0.00000000 1.0 O O18 1 0.76938100 0.76938100 0.00000000 1.0 O O19 1 0.15385700 0.15385700 0.00000000 1.0 O O20 1 0.07699100 0.07699100 0.00000000 1.0 O O21 1 0.92300900 0.92300900 0.00000000 1.0 O O22 1 0.00000000 0.00000000 0.00000000 1.0 O O23 1 0.38601400 0.38601400 0.00000000 1.0 O O24 1 0.23061900 0.23061900 0.00000000 1.0 O O25 1 0.30629300 0.30629300 0.00000000 1.0