# generated using pymatgen
data_Fe3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.63895500
_cell_length_b   5.53528100
_cell_length_c   7.59296128
_cell_angle_alpha   85.43623297
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3O5F
_chemical_formula_sum   'Fe6 O10 F2'
_cell_volume   194.35327087
_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  0.47965500  0.57532600  0.16331200  1.0
  Fe  Fe1  1  0.50977000  0.90809400  0.83670700  1.0
  Fe  Fe2  1  0.51302700  0.24750300  0.48965400  1.0
  Fe  Fe3  1  0.00977000  0.09190600  0.16329300  1.0
  Fe  Fe4  1  0.01302700  0.75249700  0.51034600  1.0
  Fe  Fe5  1  0.97965500  0.42467400  0.83668800  1.0
  O  O6  1  0.19159400  0.04458400  0.39689400  1.0
  O  O7  1  0.19074000  0.38055700  0.05122200  1.0
  O  O8  1  0.19633000  0.70885500  0.74048400  1.0
  O  O9  1  0.30839300  0.87866900  0.06896100  1.0
  O  O10  1  0.30810200  0.54408500  0.39286000  1.0
  O  O11  1  0.69633000  0.29114500  0.25951600  1.0
  O  O12  1  0.69159400  0.95541600  0.60310600  1.0
  O  O13  1  0.69074000  0.61944300  0.94877800  1.0
  O  O14  1  0.80810200  0.45591500  0.60714000  1.0
  O  O15  1  0.80839300  0.12133100  0.93103900  1.0
  F  F16  1  0.30239000  0.21474900  0.72950400  1.0
  F  F17  1  0.80239000  0.78525100  0.27049600  1.0