# generated using pymatgen data_Co3OF5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.70046300 _cell_length_b 5.66941478 _cell_length_c 7.84635624 _cell_angle_alpha 87.07456426 _cell_angle_beta 88.36270091 _cell_angle_gamma 88.26612164 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co3OF5 _chemical_formula_sum 'Co6 O2 F10' _cell_volume 208.65193216 _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 0.46621400 0.34230200 0.69151300 1.0 Co Co1 1 0.50000000 0.00000000 0.00000000 1.0 Co Co2 1 0.53378600 0.65769800 0.30848700 1.0 Co Co3 1 0.99998300 0.16949700 0.33671000 1.0 Co Co4 1 0.00000000 0.50000000 0.00000000 1.0 Co Co5 1 0.00001700 0.83050300 0.66329000 1.0 O O6 1 0.71542000 0.69062500 0.09530400 1.0 O O7 1 0.28458000 0.30937500 0.90469600 1.0 F F8 1 0.80185800 0.20633900 0.10397100 1.0 F F9 1 0.80454000 0.86890600 0.43240100 1.0 F F10 1 0.80679100 0.53375900 0.76865200 1.0 F F11 1 0.68834300 0.36947900 0.44306600 1.0 F F12 1 0.69138600 0.04215500 0.76355500 1.0 F F13 1 0.30861400 0.95784500 0.23644500 1.0 F F14 1 0.31165700 0.63052100 0.55693400 1.0 F F15 1 0.19814200 0.79366100 0.89602900 1.0 F F16 1 0.19546000 0.13109400 0.56759900 1.0 F F17 1 0.19320900 0.46624100 0.23134800 1.0