data_[Ce6Co1Pb2C1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Co  1.8800  1.3500  0.7683
  Pb  2.3300  1.8000  1.1225
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [5.0190]
_cell_length_b [5.0190]
_cell_length_c [10.3897]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Ce6CoPb2C]
_chemical_formula_sum '[Ce6 Co1 Pb2 C1]'
_cell_volume [261.7219]
_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
[
  Ce  Ce0  2  0.0000  0.5000  0.0000  1.0
  Ce  Ce1  2  0.0000  0.5000  0.5000  1.0
  Ce  Ce2  2  0.5000  0.5000  0.2664  1.0
  Co  Co3  1  0.5000  0.5000  0.0000  1.0
  Pb  Pb4  2  0.0000  0.0000  0.2543  1.0
  C  C5  1  0.5000  0.5000  0.5000  1.0
]