# generated using pymatgen
data_Fe4O7F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.51303778
_cell_length_b   5.51303778
_cell_length_c   8.82261098
_cell_angle_alpha   86.93329334
_cell_angle_beta   86.93329334
_cell_angle_gamma   73.96848645
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4O7F
_chemical_formula_sum   'Fe8 O14 F2'
_cell_volume   257.14373162
_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  0.87418300  0.38390500  0.62087500  1.0
  Fe  Fe1  1  0.61609500  0.12581700  0.87912500  1.0
  Fe  Fe2  1  0.50000000  0.00000000  0.50000000  1.0
  Fe  Fe3  1  0.72670700  0.27329300  0.25000000  1.0
  Fe  Fe4  1  0.27329300  0.72670700  0.75000000  1.0
  Fe  Fe5  1  0.38390500  0.87418300  0.12087500  1.0
  Fe  Fe6  1  0.12581700  0.61609500  0.37912500  1.0
  Fe  Fe7  1  0.00000000  0.50000000  0.00000000  1.0
  O  O8  1  0.80873000  0.70007400  0.49694400  1.0
  O  O9  1  0.57096400  0.42903600  0.75000000  1.0
  O  O10  1  0.96574400  0.47599800  0.22172800  1.0
  O  O11  1  0.71797600  0.22576500  0.47078600  1.0
  O  O12  1  0.47599800  0.96574400  0.72172800  1.0
  O  O13  1  0.22576500  0.71797600  0.97078600  1.0
  O  O14  1  0.52400200  0.03425600  0.27827200  1.0
  O  O15  1  0.77423500  0.28202400  0.02921400  1.0
  O  O16  1  0.28202400  0.77423500  0.52921400  1.0
  O  O17  1  0.03425600  0.52400200  0.77827200  1.0
  O  O18  1  0.42903600  0.57096400  0.25000000  1.0
  O  O19  1  0.19127000  0.29992600  0.50305600  1.0
  O  O20  1  0.70007400  0.80873000  0.99694400  1.0
  O  O21  1  0.29992600  0.19127000  0.00305600  1.0
  F  F22  1  0.95309000  0.04691000  0.75000000  1.0
  F  F23  1  0.04691000  0.95309000  0.25000000  1.0