# generated using pymatgen data_Mg(CuO2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.86500225 _cell_length_b 5.86500225 _cell_length_c 5.86500225 _cell_angle_alpha 118.43467495 _cell_angle_beta 118.31981507 _cell_angle_gamma 92.83448037 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg(CuO2)2 _chemical_formula_sum 'Mg2 Cu4 O8' _cell_volume 145.96150379 _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 0.00000000 0.50000000 0.50000000 1.0 Mg Mg1 1 0.50000000 0.50000000 0.00000000 1.0 Cu Cu2 1 0.13555000 0.88555000 0.25000000 1.0 Cu Cu3 1 0.86445000 0.11445000 0.75000000 1.0 Cu Cu4 1 0.50000000 0.00000000 0.00000000 1.0 Cu Cu5 1 0.50000000 0.50000000 0.50000000 1.0 O O6 1 0.73772100 0.25795300 0.02023100 1.0 O O7 1 0.71849700 0.24278500 0.47571300 1.0 O O8 1 0.73772100 0.71749000 0.47976900 1.0 O O9 1 0.26707200 0.24278500 0.02428700 1.0 O O10 1 0.73292800 0.75721500 0.97571300 1.0 O O11 1 0.28150300 0.75721500 0.52428700 1.0 O O12 1 0.26227900 0.28251000 0.52023100 1.0 O O13 1 0.26227900 0.74204700 0.97976900 1.0