# generated using pymatgen data_GdFeO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.35764278 _cell_length_b 5.64185001 _cell_length_c 7.68223768 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural GdFeO3 _chemical_formula_sum 'Gd4 Fe4 O12' _cell_volume 232.21112874 _cell_formula_units_Z 4 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 0.98335955 0.06581878 0.25000000 1.0 Gd Gd1 1 0.48335955 0.43418122 0.75000000 1.0 Gd Gd2 1 0.51664045 0.56581878 0.25000000 1.0 Gd Gd3 1 0.01664045 0.93418122 0.75000000 1.0 Fe Fe4 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe5 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe6 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe7 1 0.00000000 0.50000000 0.50000000 1.0 O O8 1 0.30563835 0.69634460 0.55454939 1.0 O O9 1 0.39433416 0.96448063 0.25000000 1.0 O O10 1 0.19436165 0.19634460 0.94545061 1.0 O O11 1 0.69436165 0.30365540 0.05454939 1.0 O O12 1 0.69436165 0.30365540 0.44545061 1.0 O O13 1 0.80563835 0.80365540 0.44545061 1.0 O O14 1 0.30563835 0.69634460 0.94545061 1.0 O O15 1 0.19436165 0.19634460 0.55454939 1.0 O O16 1 0.89433416 0.53551937 0.75000000 1.0 O O17 1 0.60566584 0.03551937 0.75000000 1.0 O O18 1 0.80563835 0.80365540 0.05454939 1.0 O O19 1 0.10566584 0.46448063 0.25000000 1.0