data_[Pb2C2O6F1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pb  2.3300  1.8000  1.1225
  C  2.5500  0.7000  0.3000
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.1524]
_cell_length_b [5.9136]
_cell_length_c [6.4805]
_cell_angle_alpha [85.8473]
_cell_angle_beta [69.0688]
_cell_angle_gamma [71.2488]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Pb2C2O6F]
_chemical_formula_sum '[Pb2 C2 O6 F1]'
_cell_volume [174.4374]
_cell_formula_units_Z [1]
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
[
  Pb  Pb0  2  0.4508  0.2608  0.2635  1.0
  C  C1  2  0.0633  0.8883  0.2212  1.0
  O  O2  2  0.1188  0.0829  0.1522  1.0
  O  O3  2  0.1937  0.1008  0.6355  1.0
  O  O4  2  0.2563  0.6822  0.1392  1.0
  F  F5  1  0.5000  0.5000  0.5000  1.0
]