# generated using pymatgen data_Gd2CuO4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.51943700 _cell_length_b 5.52385400 _cell_length_c 6.55743089 _cell_angle_alpha 66.44250129 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Gd2CuO4 _chemical_formula_sum 'Gd4 Cu2 O8' _cell_volume 183.26465540 _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 Gd Gd0 1 0.50293800 0.15665400 0.69711700 1.0 Gd Gd1 1 0.99706200 0.65665400 0.69711700 1.0 Gd Gd2 1 0.00293800 0.34334600 0.30288300 1.0 Gd Gd3 1 0.49706200 0.84334600 0.30288300 1.0 Cu Cu4 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu5 1 0.50000000 0.50000000 0.00000000 1.0 O O6 1 0.24899700 0.00397900 0.50274100 1.0 O O7 1 0.27251000 0.22468100 0.00503900 1.0 O O8 1 0.77251000 0.27531900 0.99496100 1.0 O O9 1 0.74899700 0.49602100 0.49725900 1.0 O O10 1 0.25100300 0.50397900 0.50274100 1.0 O O11 1 0.22749000 0.72468100 0.00503900 1.0 O O12 1 0.72749000 0.77531900 0.99496100 1.0 O O13 1 0.75100300 0.99602100 0.49725900 1.0