# generated using pymatgen data_Fe5O7F3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.66987300 _cell_length_b 4.67468191 _cell_length_c 15.21695466 _cell_angle_alpha 89.60903658 _cell_angle_beta 89.92484540 _cell_angle_gamma 87.25550329 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe5O7F3 _chemical_formula_sum 'Fe10 O14 F6' _cell_volume 331.79980977 _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 Fe Fe0 1 0.99726100 0.00387700 0.99079200 1.0 Fe Fe1 1 0.01732900 0.97317000 0.80439300 1.0 Fe Fe2 1 0.99952100 0.00651100 0.59991000 1.0 Fe Fe3 1 0.01319200 0.01457400 0.40112900 1.0 Fe Fe4 1 0.00397000 0.00586800 0.20363500 1.0 Fe Fe5 1 0.48985100 0.50619100 0.90540300 1.0 Fe Fe6 1 0.47561200 0.47783200 0.49847400 1.0 Fe Fe7 1 0.52429200 0.54020900 0.69461000 1.0 Fe Fe8 1 0.47589000 0.47713900 0.29952800 1.0 Fe Fe9 1 0.50014900 0.50353500 0.10086600 1.0 O O10 1 0.20025700 0.19535500 0.89864800 1.0 O O11 1 0.18010200 0.18600000 0.50278300 1.0 O O12 1 0.18498800 0.18616100 0.29946500 1.0 O O13 1 0.30261700 0.69844300 0.00837900 1.0 O O14 1 0.32821700 0.68680500 0.79892800 1.0 O O15 1 0.30182500 0.69990100 0.59620300 1.0 O O16 1 0.29735700 0.68550700 0.39950900 1.0 O O17 1 0.30625300 0.69138300 0.19902200 1.0 O O18 1 0.69004500 0.30969700 0.00567600 1.0 O O19 1 0.69494500 0.30962300 0.59775800 1.0 O O20 1 0.68364200 0.29896900 0.39950900 1.0 O O21 1 0.68901000 0.30808600 0.19881100 1.0 O O22 1 0.80424300 0.79826600 0.90019600 1.0 O O23 1 0.82625800 0.82161200 0.69759700 1.0 F F24 1 0.21120800 0.20329400 0.70098600 1.0 F F25 1 0.18924200 0.19678300 0.10100700 1.0 F F26 1 0.71257800 0.30296800 0.79620200 1.0 F F27 1 0.79559800 0.80068900 0.49785800 1.0 F F28 1 0.80734500 0.81348100 0.10264400 1.0 F F29 1 0.79720400 0.79807000 0.30007700 1.0