# generated using pymatgen data_Mg(Cu2O3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.11087204 _cell_length_b 5.11087204 _cell_length_c 14.60466900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 146.21876276 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg(Cu2O3)2 _chemical_formula_sum 'Mg2 Cu8 O12' _cell_volume 212.11669489 _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 0.34098600 0.65901400 0.75000000 1.0 Mg Mg1 1 0.65901400 0.34098600 0.25000000 1.0 Cu Cu2 1 0.13772900 0.86227100 0.04424800 1.0 Cu Cu3 1 0.59411300 0.40588700 0.63589900 1.0 Cu Cu4 1 0.86227100 0.13772900 0.95575200 1.0 Cu Cu5 1 0.40588700 0.59411300 0.36410100 1.0 Cu Cu6 1 0.13772900 0.86227100 0.45575200 1.0 Cu Cu7 1 0.86227100 0.13772900 0.54424800 1.0 Cu Cu8 1 0.40588700 0.59411300 0.13589900 1.0 Cu Cu9 1 0.59411300 0.40588700 0.86410100 1.0 O O10 1 0.50000000 0.50000000 0.50000000 1.0 O O11 1 0.50000000 0.50000000 0.00000000 1.0 O O12 1 0.95118000 0.04882000 0.84070200 1.0 O O13 1 0.04882000 0.95118000 0.15929800 1.0 O O14 1 0.04882000 0.95118000 0.34070200 1.0 O O15 1 0.95118000 0.04882000 0.65929800 1.0 O O16 1 0.21681800 0.78318200 0.92105300 1.0 O O17 1 0.78318200 0.21681800 0.07894700 1.0 O O18 1 0.78318200 0.21681800 0.42105300 1.0 O O19 1 0.21681800 0.78318200 0.57894700 1.0 O O20 1 0.69682800 0.30317200 0.75000000 1.0 O O21 1 0.30317200 0.69682800 0.25000000 1.0