data_[Cd1As2Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  As  2.1800  1.1500  0.6600
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [6.3137]
_cell_length_b [4.2492]
_cell_length_c [17.9361]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [Cd(AsPb)2]
_chemical_formula_sum '[Cd1 As2 Pb2]'
_cell_volume [481.1919]
_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
[
  Cd  Cd0  1  0.0121  0.0000  0.5089  1
  As  As1  1  0.3396  0.0000  0.4193  1
  As  As2  1  0.8252  0.5000  0.5796  1
  Pb  Pb3  1  0.5064  0.0000  0.5762  1
  Pb  Pb4  1  0.6356  0.5000  0.4159  1
]