data_Cd2PbAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57
_cell_length_b   5.57
_cell_length_c   5.57
_cell_angle_alpha   131.53
_cell_angle_beta   131.53
_cell_angle_gamma   70.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2PbAu
_chemical_formula_sum   'Cd2 Pb1 Au1'
_cell_volume   94.78
_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  Cd1  1  0.0  0.29  0.27  1.0
  Cd  Cd2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.29  0.0  0.27  1.0
  Au  Au0  1  0.0  0.0  0.53  1.0

data_Cd2PbAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.57
_cell_length_b   4.57
_cell_length_c   5.57
_cell_angle_alpha   114.24
_cell_angle_beta   114.24
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2PbAu
_chemical_formula_sum   'Cd2 Pb1 Au1'
_cell_volume   94.78
_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  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.98  0.27  0.98  1.0
  Pb  Pb2  1  0.27  0.98  0.98  1.0
  Au  Au3  1  0.53  0.53  0.53  1.0

Cd Cd Pb Au