# generated using pymatgen
data_Fe4O7F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.32983730
_cell_length_b   7.32983730
_cell_length_c   6.44156400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   131.54122322
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4O7F
_chemical_formula_sum   'Fe8 O14 F2'
_cell_volume   259.03562119
_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  0.36310900  0.12276200  0.75000000  1.0
  Fe  Fe1  1  0.87723800  0.63689100  0.75000000  1.0
  Fe  Fe2  1  0.62518800  0.37481200  0.25000000  1.0
  Fe  Fe3  1  0.11968300  0.88031700  0.25000000  1.0
  Fe  Fe4  1  0.88031700  0.11968300  0.75000000  1.0
  Fe  Fe5  1  0.37481200  0.62518800  0.75000000  1.0
  Fe  Fe6  1  0.12276200  0.36310900  0.25000000  1.0
  Fe  Fe7  1  0.63689100  0.87723800  0.25000000  1.0
  O  O8  1  0.02693500  0.97306500  0.75000000  1.0
  O  O9  1  0.53229700  0.46770300  0.75000000  1.0
  O  O10  1  0.37923100  0.12717700  0.44320200  1.0
  O  O11  1  0.87282300  0.62076900  0.44320200  1.0
  O  O12  1  0.37923100  0.12717700  0.05679800  1.0
  O  O13  1  0.12717700  0.37923100  0.55679800  1.0
  O  O14  1  0.62076900  0.87282300  0.55679800  1.0
  O  O15  1  0.87282300  0.62076900  0.05679800  1.0
  O  O16  1  0.21832500  0.78167500  0.75000000  1.0
  O  O17  1  0.97306500  0.02693500  0.25000000  1.0
  O  O18  1  0.46770300  0.53229700  0.25000000  1.0
  O  O19  1  0.78167500  0.21832500  0.25000000  1.0
  O  O20  1  0.12717700  0.37923100  0.94320200  1.0
  O  O21  1  0.62076900  0.87282300  0.94320200  1.0
  F  F22  1  0.72328700  0.27671300  0.75000000  1.0
  F  F23  1  0.27671300  0.72328700  0.25000000  1.0