# generated using pymatgen data_Co2O3F _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.29413587 _cell_length_b 5.29413587 _cell_length_c 8.48607876 _cell_angle_alpha 89.09836397 _cell_angle_beta 89.09836397 _cell_angle_gamma 73.69146634 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co2O3F _chemical_formula_sum 'Co8 O12 F4' _cell_volume 228.23248895 _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 Co Co0 1 0.89291000 0.85780900 0.62556000 1.0 Co Co1 1 0.62507700 0.62550600 0.87541600 1.0 Co Co2 1 0.48354000 0.51646000 0.50000000 1.0 Co Co3 1 0.22740200 0.27340600 0.74885300 1.0 Co Co4 1 0.72659400 0.77259800 0.25114700 1.0 Co Co5 1 0.14219100 0.10709000 0.37444000 1.0 Co Co6 1 0.37449400 0.37492300 0.12458400 1.0 Co Co7 1 0.03112000 0.96888000 0.00000000 1.0 O O8 1 0.94456700 0.55400600 0.75013600 1.0 O O9 1 0.22701000 0.21754500 0.97079600 1.0 O O10 1 0.46602000 0.47877400 0.72104700 1.0 O O11 1 0.97732900 0.96931100 0.22253600 1.0 O O12 1 0.71596300 0.72799700 0.47466600 1.0 O O13 1 0.27200300 0.28403700 0.52533500 1.0 O O14 1 0.03068900 0.02267100 0.77746400 1.0 O O15 1 0.78245500 0.77299000 0.02920400 1.0 O O16 1 0.52122600 0.53398000 0.27895300 1.0 O O17 1 0.20459500 0.79540500 0.50000000 1.0 O O18 1 0.44599400 0.05543300 0.24986400 1.0 O O19 1 0.30936900 0.69063100 0.00000000 1.0 F F20 1 0.54006700 0.96925700 0.74602300 1.0 F F21 1 0.80597500 0.19402500 0.50000000 1.0 F F22 1 0.72266800 0.27733200 0.00000000 1.0 F F23 1 0.03074300 0.45993300 0.25397700 1.0