# generated using pymatgen data_LuCoO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.06722900 _cell_length_b 5.45033600 _cell_length_c 7.30563900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LuCoO3 _chemical_formula_sum 'Lu4 Co4 O12' _cell_volume 201.76787313 _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 Lu Lu0 1 0.02412000 0.57995900 0.25000000 1.0 Lu Lu1 1 0.47588000 0.07995900 0.25000000 1.0 Lu Lu2 1 0.97588000 0.42004100 0.75000000 1.0 Lu Lu3 1 0.52412000 0.92004100 0.75000000 1.0 Co Co4 1 0.50000000 0.50000000 0.50000000 1.0 Co Co5 1 0.50000000 0.50000000 0.00000000 1.0 Co Co6 1 0.00000000 0.00000000 0.00000000 1.0 Co Co7 1 0.00000000 0.00000000 0.50000000 1.0 O O8 1 0.81322400 0.69463500 0.55611500 1.0 O O9 1 0.38522900 0.53729100 0.75000000 1.0 O O10 1 0.31322400 0.80536500 0.05611500 1.0 O O11 1 0.81322400 0.69463500 0.94388500 1.0 O O12 1 0.31322400 0.80536500 0.44388500 1.0 O O13 1 0.61477100 0.46270900 0.25000000 1.0 O O14 1 0.18677600 0.30536500 0.05611500 1.0 O O15 1 0.68677600 0.19463500 0.55611500 1.0 O O16 1 0.18677600 0.30536500 0.44388500 1.0 O O17 1 0.11477100 0.03729100 0.75000000 1.0 O O18 1 0.88522900 0.96270900 0.25000000 1.0 O O19 1 0.68677600 0.19463500 0.94388500 1.0