# generated using pymatgen
data_Fe4O7F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.71843270
_cell_length_b   9.71843270
_cell_length_c   5.51283914
_cell_angle_alpha   80.38773207
_cell_angle_beta   80.38773207
_cell_angle_gamma   144.09992409
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4O7F
_chemical_formula_sum   'Fe8 O14 F2'
_cell_volume   256.61348548
_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  0.14399000  0.76535300  0.48111400  1.0
  Fe  Fe1  1  0.36778100  0.48565200  0.52635700  1.0
  Fe  Fe2  1  0.24416800  0.62707900  0.99025600  1.0
  Fe  Fe3  1  0.76535300  0.14399000  0.98111400  1.0
  Fe  Fe4  1  0.48565200  0.36778100  0.02635700  1.0
  Fe  Fe5  1  0.87013400  0.99957100  0.49933400  1.0
  Fe  Fe6  1  0.62707900  0.24416800  0.49025600  1.0
  Fe  Fe7  1  0.99957100  0.87013400  0.99933400  1.0
  O  O8  1  0.05357500  0.53262800  0.78870400  1.0
  O  O9  1  0.23379600  0.95342300  0.68394600  1.0
  O  O10  1  0.25789000  0.29085100  0.32756000  1.0
  O  O11  1  0.02321900  0.55415400  0.30198100  1.0
  O  O12  1  0.53262800  0.05357500  0.28870400  1.0
  O  O13  1  0.70100800  0.47973000  0.19473100  1.0
  O  O14  1  0.20220400  0.97925600  0.19322200  1.0
  O  O15  1  0.29085100  0.25789000  0.82756000  1.0
  O  O16  1  0.55415400  0.02321900  0.80198100  1.0
  O  O17  1  0.79169500  0.76105800  0.81850700  1.0
  O  O18  1  0.97925600  0.20220400  0.69322200  1.0
  O  O19  1  0.47973000  0.70100800  0.69473100  1.0
  O  O20  1  0.76105800  0.79169500  0.31850700  1.0
  O  O21  1  0.95342300  0.23379600  0.18394600  1.0
  F  F22  1  0.45188900  0.72768400  0.19365000  1.0
  F  F23  1  0.72768400  0.45188900  0.69365000  1.0