# generated using pymatgen
data_Fe3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54805082
_cell_length_b   5.54805082
_cell_length_c   7.36891398
_cell_angle_alpha   70.55607194
_cell_angle_beta   70.55607194
_cell_angle_gamma   70.68023284
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3O5F
_chemical_formula_sum   'Fe6 O10 F2'
_cell_volume   195.41479565
_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  0.67585600  0.67585600  0.84703000  1.0
  Fe  Fe1  1  0.32614500  0.32614500  0.66328000  1.0
  Fe  Fe2  1  0.65617800  0.65617800  0.32327100  1.0
  Fe  Fe3  1  0.33075100  0.33075100  0.16282800  1.0
  Fe  Fe4  1  0.00400200  0.00400200  0.50976500  1.0
  Fe  Fe5  1  0.00401000  0.00401000  0.99208000  1.0
  O  O6  1  0.64440500  0.03171600  0.66617300  1.0
  O  O7  1  0.96873800  0.35748600  0.32939900  1.0
  O  O8  1  0.22958000  0.22958000  0.95384800  1.0
  O  O9  1  0.77740700  0.77740700  0.03925000  1.0
  O  O10  1  0.42860500  0.42860500  0.37780900  1.0
  O  O11  1  0.10186000  0.10186000  0.70062600  1.0
  O  O12  1  0.35748600  0.96873800  0.32939900  1.0
  O  O13  1  0.03171600  0.64440500  0.66617300  1.0
  O  O14  1  0.69162100  0.30782300  0.00389200  1.0
  O  O15  1  0.30782300  0.69162100  0.00389200  1.0
  F  F16  1  0.89478600  0.89478600  0.30263100  1.0
  F  F17  1  0.56903200  0.56903200  0.62865300  1.0