# generated using pymatgen data_Fe10O11F9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.74427092 _cell_length_b 4.74339880 _cell_length_c 15.38824639 _cell_angle_alpha 90.05863556 _cell_angle_beta 89.98501257 _cell_angle_gamma 90.71818410 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe10O11F9 _chemical_formula_sum 'Fe10 O11 F9' _cell_volume 346.26922295 _cell_formula_units_Z 1 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 0.98922200 0.98602200 0.00048100 1.0 Fe Fe1 1 0.03220900 0.02743200 0.19902800 1.0 Fe Fe2 1 0.98887500 0.94578500 0.39864600 1.0 Fe Fe3 1 0.04830000 0.00165100 0.60005900 1.0 Fe Fe4 1 0.04147400 0.00011000 0.80137500 1.0 Fe Fe5 1 0.52391400 0.45525000 0.09429700 1.0 Fe Fe6 1 0.48205900 0.51812800 0.50005500 1.0 Fe Fe7 1 0.47548700 0.52716400 0.29670700 1.0 Fe Fe8 1 0.45972800 0.49707800 0.70295500 1.0 Fe Fe9 1 0.46537700 0.51364800 0.90741600 1.0 O O10 1 0.18500000 0.81175600 0.29661000 1.0 O O11 1 0.18839600 0.80322700 0.49895000 1.0 O O12 1 0.20286400 0.81799700 0.70102700 1.0 O O13 1 0.18435700 0.81264500 0.90229900 1.0 O O14 1 0.29748800 0.28965400 0.00129100 1.0 O O15 1 0.32463800 0.31199600 0.19795700 1.0 O O16 1 0.31373900 0.31751000 0.59916300 1.0 O O17 1 0.30269100 0.31728900 0.80334000 1.0 O O18 1 0.69144700 0.68473000 0.00158900 1.0 O O19 1 0.67332100 0.68098000 0.39816300 1.0 O O20 1 0.82311000 0.17732800 0.10161000 1.0 F F21 1 0.20917500 0.79273100 0.10231800 1.0 F F22 1 0.28690500 0.29772600 0.39832200 1.0 F F23 1 0.70898000 0.69847100 0.19917700 1.0 F F24 1 0.70147500 0.70754700 0.60086700 1.0 F F25 1 0.69603200 0.70809900 0.79992500 1.0 F F26 1 0.80021100 0.19443700 0.49863700 1.0 F F27 1 0.79985900 0.19778900 0.30057000 1.0 F F28 1 0.79605300 0.19784000 0.89745200 1.0 F F29 1 0.80761200 0.20797800 0.69971200 1.0