# generated using pymatgen data_Co3(O2F)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.61867300 _cell_length_b 5.49562884 _cell_length_c 7.44831559 _cell_angle_alpha 84.55207960 _cell_angle_beta 86.23893101 _cell_angle_gamma 83.78229101 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co3(O2F)2 _chemical_formula_sum 'Co6 O8 F4' _cell_volume 186.80340432 _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 0.52842100 0.51633200 0.00981300 1.0 Co Co1 1 0.54532500 0.20148900 0.34882800 1.0 Co Co2 1 0.49382900 0.82730500 0.66257900 1.0 Co Co3 1 0.99299400 0.32932600 0.66045600 1.0 Co Co4 1 0.98228800 0.66251800 0.32773300 1.0 Co Co5 1 0.98653200 0.98023400 0.00076300 1.0 O O6 1 0.81740800 0.38916500 0.43210200 1.0 O O7 1 0.80570500 0.69532300 0.11433900 1.0 O O8 1 0.68773200 0.52942400 0.76894500 1.0 O O9 1 0.69555700 0.20748000 0.10248200 1.0 O O10 1 0.69964800 0.87800100 0.43319400 1.0 O O11 1 0.31254600 0.13621600 0.56183700 1.0 O O12 1 0.30578800 0.46664600 0.23251000 1.0 O O13 1 0.30295800 0.78809400 0.90031200 1.0 F F14 1 0.79693800 0.02329000 0.76697700 1.0 F F15 1 0.17959100 0.94427200 0.23603000 1.0 F F16 1 0.17884600 0.28348300 0.89126200 1.0 F F17 1 0.18789400 0.64140200 0.54983900 1.0