# generated using pymatgen
data_Fe3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64370300
_cell_length_b   5.54552755
_cell_length_c   7.60072636
_cell_angle_alpha   85.21696409
_cell_angle_beta   89.81710039
_cell_angle_gamma   89.81294080
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3O5F
_chemical_formula_sum   'Fe6 O10 F2'
_cell_volume   195.04875865
_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  0.53495400  0.84049100  0.66223000  1.0
  Fe  Fe1  1  0.50692400  0.48722500  0.99794800  1.0
  Fe  Fe2  1  0.49009400  0.16994800  0.33729600  1.0
  Fe  Fe3  1  0.99756000  0.32549900  0.67021400  1.0
  Fe  Fe4  1  0.98680700  0.66248000  0.32052100  1.0
  Fe  Fe5  1  0.98520600  0.00881700  0.00705400  1.0
  O  O6  1  0.81269800  0.37713200  0.44193500  1.0
  O  O7  1  0.80788200  0.03281400  0.78054200  1.0
  O  O8  1  0.80222700  0.70950500  0.08799500  1.0
  O  O9  1  0.68990900  0.20521800  0.11684600  1.0
  O  O10  1  0.69469100  0.53380700  0.76607800  1.0
  O  O11  1  0.69326500  0.87564900  0.42716500  1.0
  O  O12  1  0.31097700  0.13243100  0.56456100  1.0
  O  O13  1  0.30472500  0.46108600  0.23418700  1.0
  O  O14  1  0.18891100  0.95481700  0.22358500  1.0
  O  O15  1  0.19102600  0.28957500  0.90066700  1.0
  F  F16  1  0.30225600  0.79252100  0.89098700  1.0
  F  F17  1  0.19988600  0.64098300  0.57018800  1.0