# generated using pymatgen
data_Fe4O7F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64245400
_cell_length_b   7.57072300
_cell_length_c   7.58780357
_cell_angle_alpha   75.64486135
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4O7F
_chemical_formula_sum   'Fe8 O14 F2'
_cell_volume   258.35991075
_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  0.48439200  0.68742700  0.42688500  1.0
  Fe  Fe1  1  0.52338900  0.44296000  0.18234500  1.0
  Fe  Fe2  1  0.48996600  0.95155200  0.68367500  1.0
  Fe  Fe3  1  0.50075700  0.18532200  0.94257900  1.0
  Fe  Fe4  1  0.02338900  0.55704000  0.81765500  1.0
  Fe  Fe5  1  0.00075700  0.81467800  0.05742100  1.0
  Fe  Fe6  1  0.98996600  0.04844800  0.31632500  1.0
  Fe  Fe7  1  0.98439200  0.31257300  0.57311500  1.0
  O  O8  1  0.80544600  0.35103300  0.79241400  1.0
  O  O9  1  0.80172800  0.83144600  0.27866800  1.0
  O  O10  1  0.81618400  0.59659500  0.02461400  1.0
  O  O11  1  0.80858200  0.09085200  0.53431000  1.0
  O  O12  1  0.69314800  0.46288500  0.40665500  1.0
  O  O13  1  0.69250300  0.21500500  0.16378400  1.0
  O  O14  1  0.68793100  0.97334400  0.90658800  1.0
  O  O15  1  0.31618400  0.40340500  0.97538600  1.0
  O  O16  1  0.30544600  0.64896700  0.20758600  1.0
  O  O17  1  0.30172800  0.16855400  0.72133200  1.0
  O  O18  1  0.30858200  0.90914800  0.46569000  1.0
  O  O19  1  0.19250300  0.78499500  0.83621600  1.0
  O  O20  1  0.19314800  0.53711500  0.59334500  1.0
  O  O21  1  0.18793100  0.02665600  0.09341200  1.0
  F  F22  1  0.69597400  0.71822100  0.65665700  1.0
  F  F23  1  0.19597400  0.28177900  0.34334300  1.0