# generated using pymatgen
data_Fe3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52309275
_cell_length_b   5.52309275
_cell_length_c   7.36576835
_cell_angle_alpha   70.81755894
_cell_angle_beta   70.81755894
_cell_angle_gamma   70.98633334
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3O5F
_chemical_formula_sum   'Fe6 O10 F2'
_cell_volume   194.36351613
_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  0.50000000  0.50000000  0.00000000  1.0
  Fe  Fe1  1  0.16775500  0.16775500  0.84395700  1.0
  Fe  Fe2  1  0.50000000  0.50000000  0.50000000  1.0
  Fe  Fe3  1  0.15756600  0.15756600  0.31918400  1.0
  Fe  Fe4  1  0.84243400  0.84243400  0.68081600  1.0
  Fe  Fe5  1  0.83224500  0.83224500  0.15604300  1.0
  O  O6  1  0.47610400  0.86195700  0.83308600  1.0
  O  O7  1  0.80464300  0.19535700  0.50000000  1.0
  O  O8  1  0.05563400  0.05563400  0.13321600  1.0
  O  O9  1  0.39691100  0.39691100  0.78844600  1.0
  O  O10  1  0.60308900  0.60308900  0.21155400  1.0
  O  O11  1  0.94436600  0.94436600  0.86678400  1.0
  O  O12  1  0.19535700  0.80464300  0.50000000  1.0
  O  O13  1  0.86195700  0.47610400  0.83308600  1.0
  O  O14  1  0.52389600  0.13804300  0.16691400  1.0
  O  O15  1  0.13804300  0.52389600  0.16691400  1.0
  F  F16  1  0.73711200  0.73711200  0.46674700  1.0
  F  F17  1  0.26288800  0.26288800  0.53325300  1.0