# generated using pymatgen data_Fe5O7F3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.67032000 _cell_length_b 4.67279635 _cell_length_c 15.25447277 _cell_angle_alpha 90.04948412 _cell_angle_beta 90.03633178 _cell_angle_gamma 90.10831870 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe5O7F3 _chemical_formula_sum 'Fe10 O14 F6' _cell_volume 332.90450232 _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 0.01555900 0.95960000 0.99393300 1.0 Fe Fe1 1 0.97686300 0.01613300 0.80032600 1.0 Fe Fe2 1 0.96820000 0.01127200 0.60603200 1.0 Fe Fe3 1 0.98602700 0.97861000 0.39978400 1.0 Fe Fe4 1 0.98287400 0.98822400 0.19906600 1.0 Fe Fe5 1 0.49579300 0.49121700 0.90088900 1.0 Fe Fe6 1 0.52798800 0.51064100 0.49386900 1.0 Fe Fe7 1 0.50793500 0.47967500 0.69998300 1.0 Fe Fe8 1 0.51674000 0.51499000 0.29969800 1.0 Fe Fe9 1 0.51385100 0.52709300 0.10559700 1.0 O O10 1 0.79926700 0.79650600 0.89696400 1.0 O O11 1 0.79093100 0.80767000 0.70465900 1.0 O O12 1 0.81088600 0.81763500 0.50257900 1.0 O O13 1 0.81153900 0.81029600 0.29871400 1.0 O O14 1 0.82315200 0.80712700 0.09704900 1.0 O O15 1 0.67652000 0.30915500 0.80362700 1.0 O O16 1 0.68477000 0.31776900 0.59787800 1.0 O O17 1 0.70179000 0.30611600 0.39530300 1.0 O O18 1 0.69586900 0.30678300 0.20188500 1.0 O O19 1 0.32281700 0.67655200 0.99957400 1.0 O O20 1 0.31047800 0.69553300 0.39746100 1.0 O O21 1 0.30619800 0.69860900 0.20385100 1.0 O O22 1 0.19072700 0.18702700 0.89852700 1.0 O O23 1 0.18183500 0.19771600 0.70276300 1.0 F F24 1 0.70855300 0.29208300 0.00306500 1.0 F F25 1 0.29182800 0.69602900 0.79887800 1.0 F F26 1 0.29638800 0.70421000 0.59922400 1.0 F F27 1 0.19881600 0.20396200 0.50109900 1.0 F F28 1 0.20722500 0.19416200 0.09777900 1.0 F F29 1 0.19858000 0.19760400 0.29994200 1.0