# generated using pymatgen
data_Fe3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64162800
_cell_length_b   4.64925900
_cell_length_c   9.01804100
_cell_angle_alpha   90.00000000
_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   194.61050392
_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  0.01070500  0.74787800  0.67274400  1.0
  Fe  Fe1  1  0.98249600  0.72819500  0.00000000  1.0
  Fe  Fe2  1  0.01070500  0.74787800  0.32725600  1.0
  Fe  Fe3  1  0.51070500  0.25212200  0.82725600  1.0
  Fe  Fe4  1  0.48249600  0.27180500  0.50000000  1.0
  Fe  Fe5  1  0.51070500  0.25212200  0.17274400  1.0
  O  O6  1  0.19397600  0.54918000  0.83953100  1.0
  O  O7  1  0.19397600  0.54918000  0.16046900  1.0
  O  O8  1  0.18662800  0.57585500  0.50000000  1.0
  O  O9  1  0.69397600  0.45082000  0.66046900  1.0
  O  O10  1  0.68662800  0.42414500  0.00000000  1.0
  O  O11  1  0.69397600  0.45082000  0.33953100  1.0
  O  O12  1  0.30857500  0.06379300  0.66267500  1.0
  O  O13  1  0.30857500  0.06379300  0.33732500  1.0
  O  O14  1  0.80857500  0.93620700  0.83732500  1.0
  O  O15  1  0.80857500  0.93620700  0.16267500  1.0
  F  F16  1  0.30177600  0.04360900  0.00000000  1.0
  F  F17  1  0.80177600  0.95639100  0.50000000  1.0