# generated using pymatgen
data_Fe3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52665500
_cell_length_b   5.52980545
_cell_length_c   7.21268468
_cell_angle_alpha   71.85061282
_cell_angle_beta   71.71062211
_cell_angle_gamma   72.85363806
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3O5F
_chemical_formula_sum   'Fe6 O10 F2'
_cell_volume   194.07939937
_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  0.33118700  0.34715000  0.15963700  1.0
  Fe  Fe1  1  0.68425800  0.64202000  0.33258300  1.0
  Fe  Fe2  1  0.33837700  0.34665100  0.67012100  1.0
  Fe  Fe3  1  0.66662000  0.67116700  0.83589200  1.0
  Fe  Fe4  1  0.97908600  0.99366200  0.49611500  1.0
  Fe  Fe5  1  0.99592300  0.00475300  0.00811900  1.0
  O  O6  1  0.02249500  0.64065400  0.67167900  1.0
  O  O7  1  0.77035800  0.76856900  0.04225300  1.0
  O  O8  1  0.43791600  0.43452500  0.37244400  1.0
  O  O9  1  0.22765600  0.23501100  0.96124800  1.0
  O  O10  1  0.57449500  0.57161800  0.62254900  1.0
  O  O11  1  0.89117900  0.88557600  0.29993000  1.0
  O  O12  1  0.62930700  0.02676000  0.67621200  1.0
  O  O13  1  0.98375900  0.34353900  0.33208500  1.0
  O  O14  1  0.31017800  0.70670000  0.99144100  1.0
  O  O15  1  0.69429700  0.31388200  0.99597100  1.0
  F  F16  1  0.36211700  0.96480900  0.33430300  1.0
  F  F17  1  0.10079400  0.10295400  0.69741900  1.0