# generated using pymatgen data_Mg(CuO)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.92819330 _cell_length_b 2.92819330 _cell_length_c 7.21848770 _cell_angle_alpha 79.08353549 _cell_angle_beta 79.08353549 _cell_angle_gamma 89.96844297 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg(CuO)2 _chemical_formula_sum 'Mg1 Cu2 O2' _cell_volume 59.63381016 _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 0.84836445 0.15163555 0.25000000 1.0 Cu Cu1 1 0.19429352 0.50011217 0.56777125 1.0 Cu Cu2 1 0.49988783 0.80570648 0.93222875 1.0 O O3 1 0.34821810 0.65178190 0.25000000 1.0 O O4 1 0.60923610 0.39076390 0.75000000 1.0