# generated using pymatgen data_Co2O3F _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.07837400 _cell_length_b 6.55114917 _cell_length_c 6.75550658 _cell_angle_alpha 90.00010529 _cell_angle_beta 63.26024325 _cell_angle_gamma 89.99989629 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co2O3F _chemical_formula_sum 'Co8 O12 F4' _cell_volume 240.23881284 _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 0.75038800 0.46456900 0.49925400 1.0 Co Co1 1 0.25038700 0.53542000 0.49925000 1.0 Co Co2 1 0.99968800 0.00002400 0.50060600 1.0 Co Co3 1 0.49969800 0.99998100 0.50061400 1.0 Co Co4 1 0.99961300 0.96456600 0.00074900 1.0 Co Co5 1 0.49961200 0.03544600 0.00074500 1.0 Co Co6 1 0.75030100 0.50001900 0.99938900 1.0 Co Co7 1 0.25031100 0.49997600 0.99939700 1.0 O O8 1 0.14625900 0.99976900 0.20735800 1.0 O O9 1 0.64626600 0.00021900 0.20735200 1.0 O O10 1 0.10372900 0.50023000 0.29266500 1.0 O O11 1 0.60372100 0.49978000 0.29267300 1.0 O O12 1 0.50111400 0.31926000 0.99771000 1.0 O O13 1 0.74888600 0.18072600 0.50229100 1.0 O O14 1 0.00111600 0.68075800 0.99771300 1.0 O O15 1 0.24888500 0.81925600 0.50228600 1.0 O O16 1 0.35328400 0.00018600 0.79350400 1.0 O O17 1 0.85329400 0.99980700 0.79350500 1.0 O O18 1 0.39671800 0.50019200 0.70646800 1.0 O O19 1 0.89672900 0.49981500 0.70646900 1.0 F F20 1 0.99925400 0.28166600 0.00165000 1.0 F F21 1 0.25074400 0.21832900 0.49835300 1.0 F F22 1 0.49926700 0.71833900 0.00162700 1.0 F F23 1 0.75073800 0.78166600 0.49837000 1.0