# generated using pymatgen data_Co3O5F _symmetry_space_group_name_H-M 'P 1' _cell_length_a 2.91112300 _cell_length_b 4.51436600 _cell_length_c 13.53853304 _cell_angle_alpha 86.99120248 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co3O5F _chemical_formula_sum 'Co6 O10 F2' _cell_volume 177.67643741 _cell_formula_units_Z 2 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 0.00000000 0.00000000 0.00000000 1.0 Co Co1 1 0.00000000 0.02276700 0.34344000 1.0 Co Co2 1 0.00000000 0.97723300 0.65656000 1.0 Co Co3 1 0.50000000 0.47623000 0.15799000 1.0 Co Co4 1 0.50000000 0.50000000 0.50000000 1.0 Co Co5 1 0.50000000 0.52377000 0.84201000 1.0 O O6 1 0.50000000 0.81999400 0.93778200 1.0 O O7 1 0.50000000 0.78288400 0.59515400 1.0 O O8 1 0.00000000 0.69187600 0.76971400 1.0 O O9 1 0.00000000 0.68696000 0.09933600 1.0 O O10 1 0.00000000 0.69689400 0.43654800 1.0 O O11 1 0.00000000 0.30310600 0.56345200 1.0 O O12 1 0.00000000 0.30812400 0.23028600 1.0 O O13 1 0.00000000 0.31304000 0.90066400 1.0 O O14 1 0.50000000 0.18000600 0.06221800 1.0 O O15 1 0.50000000 0.21711600 0.40484600 1.0 F F16 1 0.50000000 0.81245200 0.26989000 1.0 F F17 1 0.50000000 0.18754800 0.73011000 1.0