# generated using pymatgen
data_Fe2O3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69813600
_cell_length_b   7.64879296
_cell_length_c   9.85834817
_cell_angle_alpha   69.72305190
_cell_angle_beta   86.17427877
_cell_angle_gamma   87.47012525
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe2O3F
_chemical_formula_sum   'Fe10 O15 F5'
_cell_volume   331.48224115
_cell_formula_units_Z   5
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  0.46502100  0.69377300  0.88541100  1.0
  Fe  Fe1  1  0.50090400  0.90104500  0.30024400  1.0
  Fe  Fe2  1  0.53400100  0.10548400  0.71413300  1.0
  Fe  Fe3  1  0.50547100  0.30303200  0.10148100  1.0
  Fe  Fe4  1  0.47216000  0.49294500  0.48939100  1.0
  Fe  Fe5  1  0.99651600  0.40013000  0.79691700  1.0
  Fe  Fe6  1  0.99493800  0.80129300  0.59750700  1.0
  Fe  Fe7  1  0.00259900  0.19701500  0.40378200  1.0
  Fe  Fe8  1  0.02259100  0.60875100  0.20718000  1.0
  Fe  Fe9  1  0.00285400  0.99609900  0.00270000  1.0
  O  O10  1  0.18485600  0.42921000  0.37682100  1.0
  O  O11  1  0.17517000  0.63648400  0.76846100  1.0
  O  O12  1  0.19095600  0.84673500  0.17259900  1.0
  O  O13  1  0.30961600  0.93683600  0.87995200  1.0
  O  O14  1  0.30846900  0.33789600  0.67788800  1.0
  O  O15  1  0.30417500  0.53867400  0.07424400  1.0
  O  O16  1  0.31117000  0.14152800  0.27901400  1.0
  O  O17  1  0.29800100  0.73759500  0.47573700  1.0
  O  O18  1  0.69408600  0.85999400  0.72372100  1.0
  O  O19  1  0.69716800  0.26050500  0.52331600  1.0
  O  O20  1  0.68696200  0.66109100  0.32175200  1.0
  O  O21  1  0.70029300  0.06485000  0.12411800  1.0
  O  O22  1  0.68799300  0.46100000  0.91927800  1.0
  O  O23  1  0.82062400  0.96596500  0.42806500  1.0
  O  O24  1  0.82372000  0.16100400  0.83147600  1.0
  F  F25  1  0.20099100  0.24148300  0.98057500  1.0
  F  F26  1  0.20308800  0.03792400  0.58314900  1.0
  F  F27  1  0.79429600  0.55958300  0.61719200  1.0
  F  F28  1  0.80629500  0.75590200  0.02458500  1.0
  F  F29  1  0.80501600  0.36617300  0.21931200  1.0