# generated using pymatgen
data_Fe3O5F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64186600
_cell_length_b   5.53535428
_cell_length_c   7.61296572
_cell_angle_alpha   85.45388449
_cell_angle_beta   88.48959695
_cell_angle_gamma   88.00823476
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe3O5F
_chemical_formula_sum   'Fe6 O10 F2'
_cell_volume   194.82244961
_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  0.51390200  0.84356200  0.67099500  1.0
  Fe  Fe1  1  0.49836500  0.49903600  0.99854800  1.0
  Fe  Fe2  1  0.51782500  0.17758600  0.34022000  1.0
  Fe  Fe3  1  0.99545200  0.32441300  0.67206400  1.0
  Fe  Fe4  1  0.97898400  0.65381200  0.32429100  1.0
  Fe  Fe5  1  0.99121300  0.99906900  0.99224300  1.0
  O  O6  1  0.81575700  0.36928900  0.44413700  1.0
  O  O7  1  0.80167100  0.03519800  0.76710200  1.0
  O  O8  1  0.80628900  0.71022200  0.09633300  1.0
  O  O9  1  0.69649000  0.20359400  0.10512400  1.0
  O  O10  1  0.69091100  0.53847900  0.76662900  1.0
  O  O11  1  0.69156000  0.87011300  0.43450700  1.0
  O  O12  1  0.30662200  0.13151500  0.56483100  1.0
  O  O13  1  0.31014800  0.46160200  0.23215700  1.0
  O  O14  1  0.30370000  0.79425100  0.89620800  1.0
  O  O15  1  0.18520700  0.28978000  0.89624700  1.0
  F  F16  1  0.19682300  0.96249300  0.23410100  1.0
  F  F17  1  0.19908100  0.63598700  0.56426400  1.0