# generated using pymatgen
data_Fe4O7F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64560400
_cell_length_b   7.54737556
_cell_length_c   7.59230981
_cell_angle_alpha   104.24729041
_cell_angle_beta   91.58467660
_cell_angle_gamma   90.91365102
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe4O7F
_chemical_formula_sum   'Fe8 O14 F2'
_cell_volume   257.84495511
_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  0.50336500  0.12340800  0.37082900  1.0
  Fe  Fe1  1  0.47573900  0.38671100  0.13468800  1.0
  Fe  Fe2  1  0.49663500  0.87659200  0.62917100  1.0
  Fe  Fe3  1  0.52426100  0.61328900  0.86531200  1.0
  Fe  Fe4  1  0.98231600  0.75452200  0.26406600  1.0
  Fe  Fe5  1  0.00000000  0.50000000  0.50000000  1.0
  Fe  Fe6  1  0.01768400  0.24547800  0.73593400  1.0
  Fe  Fe7  1  0.00000000  0.00000000  0.00000000  1.0
  O  O8  1  0.19652700  0.28441000  0.51845100  1.0
  O  O9  1  0.18005000  0.53323300  0.28763900  1.0
  O  O10  1  0.18780900  0.03048600  0.78092400  1.0
  O  O11  1  0.30671800  0.90477500  0.40448100  1.0
  O  O12  1  0.30729900  0.15345100  0.14941800  1.0
  O  O13  1  0.30927900  0.40301500  0.90321100  1.0
  O  O14  1  0.30921000  0.65484600  0.65897600  1.0
  O  O15  1  0.69072100  0.59698500  0.09678900  1.0
  O  O16  1  0.69079000  0.34515400  0.34102400  1.0
  O  O17  1  0.69270100  0.84654900  0.85058200  1.0
  O  O18  1  0.69328200  0.09522500  0.59551900  1.0
  O  O19  1  0.80347300  0.71559000  0.48154900  1.0
  O  O20  1  0.81219100  0.96951400  0.21907600  1.0
  O  O21  1  0.81995000  0.46676700  0.71236100  1.0
  F  F22  1  0.19969700  0.77125600  0.02869100  1.0
  F  F23  1  0.80030300  0.22874400  0.97130900  1.0