data_Ba2CdPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.66
_cell_length_b   6.66
_cell_length_c   6.66
_cell_angle_alpha   133.72
_cell_angle_beta   133.72
_cell_angle_gamma   67.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2CdPb
_chemical_formula_sum   'Ba2 Cd1 Pb1'
_cell_volume   151.9
_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
  Ba  Ba0  1  0.0  0.0  0.54  1.0
  Ba  Ba1  1  0.0  0.62  0.77  1.0
  Cd  Cd2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.62  0.0  0.77  1.0

data_Ba2CdPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.24
_cell_length_b   5.24
_cell_length_c   6.66
_cell_angle_alpha   113.14
_cell_angle_beta   113.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2CdPb
_chemical_formula_sum   'Ba2 Cd1 Pb1'
_cell_volume   151.9
_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
  Ba  Ba0  1  0.15  0.77  0.15  1.0
  Ba  Ba1  1  0.54  0.54  0.54  1.0
  Cd  Cd2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.77  0.15  0.15  1.0

Ba Ba Cd Pb
Ba Ba Cd Pb 0 1 o o o 0 1 o - - 0 1 o - o 0 3 - o - 0 3 - o o 0 3 o o o 0 2 o o o 0 2 o o + 1 2 o + + 2 3 - o - 