# generated using pymatgen data_Mg(CuO)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.22400499 _cell_length_b 7.63557803 _cell_length_c 3.22400556 _cell_angle_alpha 78.29413500 _cell_angle_beta 59.01288658 _cell_angle_gamma 65.93726733 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg(CuO)2 _chemical_formula_sum 'Mg1 Cu2 O2' _cell_volume 62.12383926 _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 0.13825180 0.16802417 0.30627597 1.0 Cu Cu1 1 0.19981274 0.78049539 0.98030813 1.0 Cu Cu2 1 0.10685684 0.53154909 0.63840592 1.0 O O3 1 0.37854382 0.26013439 0.63867820 1.0 O O4 1 0.42653481 0.88479697 0.31133177 1.0