data_[Fe8Co8P8O32F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  Co  1.8800  1.3500  0.7683
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cc]
_cell_length_a [13.2461]
_cell_length_b [6.3774]
_cell_length_c [9.9709]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.1381]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [9]
_chemical_formula_structural [FeCoPO4F]
_chemical_formula_sum '[Fe8 Co8 P8 O32 F8]'
_cell_volume [735.6990]
_cell_formula_units_Z [8]
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  4  0.2087  0.2617  0.1382  1
  Fe  Fe1  4  0.2956  0.1108  0.4835  1
  Co  Co2  4  0.0861  0.7078  0.1256  1
  Co  Co3  4  0.4870  0.3925  0.7689  1
  P  P4  4  0.3235  0.3998  0.9356  1
  P  P5  4  0.4735  0.1015  0.3237  1
  O  O6  4  0.0129  0.2062  0.7630  1
  O  O7  4  0.0687  0.4466  0.9909  1
  O  O8  4  0.2285  0.4610  0.7717  1
  O  O9  4  0.2801  0.2111  0.9921  1
  O  O10  4  0.3437  0.4163  0.5494  1
  O  O11  4  0.3586  0.1505  0.3222  1
  O  O12  4  0.4367  0.3448  0.9337  1
  O  O13  4  0.4589  0.0847  0.7153  1
  F  F14  4  0.1368  0.8687  0.7649  1
  F  F15  4  0.1658  0.0826  0.5546  1
]