# generated using pymatgen data_Fe10O11F9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.73437300 _cell_length_b 4.73651576 _cell_length_c 15.34888034 _cell_angle_alpha 90.10523432 _cell_angle_beta 90.15838326 _cell_angle_gamma 91.29713342 _symmetry_Int_Tables_number 1 _chemical_formula_structural Fe10O11F9 _chemical_formula_sum 'Fe10 O11 F9' _cell_volume 344.09979218 _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 0.96578500 0.96779300 0.00090800 1.0 Fe Fe1 1 0.03028400 0.02989500 0.20038700 1.0 Fe Fe2 1 0.01045700 0.96850600 0.39871600 1.0 Fe Fe3 1 0.04012300 0.99788300 0.59871700 1.0 Fe Fe4 1 0.04753900 0.00266700 0.80076400 1.0 Fe Fe5 1 0.53871800 0.46524700 0.10197300 1.0 Fe Fe6 1 0.47201400 0.50056100 0.49370100 1.0 Fe Fe7 1 0.46495200 0.51467500 0.30477900 1.0 Fe Fe8 1 0.46142300 0.49810400 0.69845400 1.0 Fe Fe9 1 0.47068000 0.52773300 0.90103600 1.0 O O10 1 0.18897100 0.81250200 0.29665300 1.0 O O11 1 0.19006600 0.80163500 0.49872900 1.0 O O12 1 0.20045500 0.81401300 0.70004200 1.0 O O13 1 0.18395200 0.81374300 0.90360500 1.0 O O14 1 0.32232500 0.32038900 0.20075600 1.0 O O15 1 0.29014200 0.29387500 0.39819700 1.0 O O16 1 0.30900500 0.31238900 0.59699700 1.0 O O17 1 0.30991700 0.31978200 0.80224600 1.0 O O18 1 0.68060600 0.67407800 0.00094100 1.0 O O19 1 0.69047800 0.69062900 0.39832100 1.0 O O20 1 0.82006800 0.17823500 0.10086500 1.0 F F21 1 0.20398200 0.79635400 0.10054700 1.0 F F22 1 0.29531500 0.29054700 0.00193000 1.0 F F23 1 0.70922600 0.70253100 0.20003100 1.0 F F24 1 0.69915300 0.70306900 0.60063900 1.0 F F25 1 0.69867300 0.71096900 0.80021100 1.0 F F26 1 0.80094100 0.19228600 0.50028400 1.0 F F27 1 0.80183300 0.19920800 0.29876500 1.0 F F28 1 0.79428500 0.19533800 0.90045100 1.0 F F29 1 0.80863100 0.20536500 0.70035200 1.0