data_[Cd2P2Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  P  2.1900  1.0000  0.5500
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.2830]
_cell_length_b [3.7549]
_cell_length_c [5.7171]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.4108]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [CdPPb2]
_chemical_formula_sum '[Cd2 P2 Pb4]'
_cell_volume [215.0202]
_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
[
  Cd  Cd0  2  0.0534  0.5000  0.4966  1
  P  P1  2  0.2280  0.0000  0.8355  1
  Pb  Pb2  2  0.2676  0.5000  0.2445  1
  Pb  Pb3  2  0.4509  0.5000  0.9234  1
]