# generated using pymatgen data_Mg(CuO2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.57501060 _cell_length_b 6.57501060 _cell_length_c 6.57501060 _cell_angle_alpha 131.34237459 _cell_angle_beta 131.34237459 _cell_angle_gamma 71.26967911 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg(CuO2)2 _chemical_formula_sum 'Mg2 Cu4 O8' _cell_volume 156.83438154 _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 0.50000000 0.50000000 -0.00000000 1.0 Mg Mg1 1 0.25000000 0.75000000 0.50000000 1.0 Cu Cu2 1 0.87500000 0.12500000 0.25000000 1.0 Cu Cu3 1 0.37500000 0.12500000 0.25000000 1.0 Cu Cu4 1 0.87500000 0.62500000 0.75000000 1.0 Cu Cu5 1 0.87500000 0.12500000 0.75000000 1.0 O O6 1 0.64605903 0.87225097 0.77380806 1.0 O O7 1 0.12774903 0.90155708 0.77380806 1.0 O O8 1 0.12774903 0.35394097 0.22619194 1.0 O O9 1 0.10394097 0.37774903 0.72619194 1.0 O O10 1 0.65155708 0.37774903 0.27380806 1.0 O O11 1 0.62225097 0.34844292 0.72619194 1.0 O O12 1 0.09844292 0.87225097 0.22619194 1.0 O O13 1 0.62225097 0.89605903 0.27380806 1.0