data_NaCdPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87
_cell_length_b   5.87
_cell_length_c   5.84
_cell_angle_alpha   98.19
_cell_angle_beta   98.19
_cell_angle_gamma   35.11
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCdPb2
_chemical_formula_sum   'Na1 Cd1 Pb2'
_cell_volume   114.39
_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
  Na  Na1  1  0.13  0.0  0.31  1.0
  Cd  Cd0  1  0.17  0.0  0.88  1.0
  Pb  Pb2  1  0.14  0.0  0.75  1.0
  Pb  Pb3  1  0.16  0.0  0.49  1.0

data_NaCdPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   5.84
_cell_length_c   5.87
_cell_angle_alpha   98.19
_cell_angle_beta   107.55
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaCdPb2
_chemical_formula_sum   'Na1 Cd1 Pb2'
_cell_volume   114.39
_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
  Na  Na0  1  0.0  0.31  0.13  1.0
  Cd  Cd1  1  0.0  0.88  0.17  1.0
  Pb  Pb2  1  0.0  0.49  0.16  1.0
  Pb  Pb3  1  0.0  0.75  0.14  1.0

Na Cd Pb Pb
Na Cd Pb Pb 0 3 o o o 1 2 o o o 