# generated using pymatgen data_BaGd2CoO5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.77423250 _cell_length_b 6.77423250 _cell_length_c 6.77423250 _cell_angle_alpha 147.57291770 _cell_angle_beta 128.58206116 _cell_angle_gamma 62.11428639 _symmetry_Int_Tables_number 1 _chemical_formula_structural BaGd2CoO5 _chemical_formula_sum 'Ba1 Gd2 Co1 O5' _cell_volume 129.02637920 _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 Ba Ba0 1 0.00000000 0.50000000 0.50000000 1.0 Gd Gd1 1 0.70271800 0.70271800 0.00000000 1.0 Gd Gd2 1 0.29728200 0.29728200 0.00000000 1.0 Co Co3 1 0.50000000 0.00000000 0.50000000 1.0 O O4 1 0.40663000 0.14739500 0.25923400 1.0 O O5 1 0.59337000 0.85260500 0.74076600 1.0 O O6 1 0.11183900 0.85260500 0.25923400 1.0 O O7 1 0.88816100 0.14739500 0.74076600 1.0 O O8 1 0.50000000 0.50000000 0.00000000 1.0