# generated using pymatgen data_Mg2Cu9O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.13480282 _cell_length_b 5.13480282 _cell_length_c 16.22009226 _cell_angle_alpha 81.90681956 _cell_angle_beta 81.90681956 _cell_angle_gamma 33.41154247 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2Cu9O13 _chemical_formula_sum 'Mg2 Cu9 O13' _cell_volume 232.93390534 _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 0.78500400 0.78500400 0.22761700 1.0 Mg Mg1 1 0.21499600 0.21499600 0.77238300 1.0 Cu Cu2 1 0.50000000 0.50000000 0.50000000 1.0 Cu Cu3 1 0.35489200 0.35489200 0.04061500 1.0 Cu Cu4 1 0.64510800 0.64510800 0.95938500 1.0 Cu Cu5 1 0.25017400 0.25017400 0.41849600 1.0 Cu Cu6 1 0.74982600 0.74982600 0.58150400 1.0 Cu Cu7 1 0.06538000 0.06538000 0.12400200 1.0 Cu Cu8 1 0.93462000 0.93462000 0.87599800 1.0 Cu Cu9 1 0.00791300 0.00791300 0.33140100 1.0 Cu Cu10 1 0.99208700 0.99208700 0.66859900 1.0 O O11 1 0.00000000 0.00000000 0.00000000 1.0 O O12 1 0.14219500 0.14219500 0.22724900 1.0 O O13 1 0.85780500 0.85780500 0.77275100 1.0 O O14 1 0.70091600 0.70091600 0.07113400 1.0 O O15 1 0.29908400 0.29908400 0.92886600 1.0 O O16 1 0.41574700 0.41574700 0.14596600 1.0 O O17 1 0.58425300 0.58425300 0.85403400 1.0 O O18 1 0.37027200 0.37027200 0.31461200 1.0 O O19 1 0.62972800 0.62972800 0.68538800 1.0 O O20 1 0.60895900 0.60895900 0.38762300 1.0 O O21 1 0.39104100 0.39104100 0.61237700 1.0 O O22 1 0.86805900 0.86805900 0.46984700 1.0 O O23 1 0.13194100 0.13194100 0.53015300 1.0