data_Cd2AgPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.37
_cell_length_b   5.01
_cell_length_c   5.83
_cell_angle_alpha   90.0
_cell_angle_beta   100.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2AgPb
_chemical_formula_sum   'Cd2 Ag1 Pb1'
_cell_volume   96.65
_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  0.63  0.5  0.31  1.0
  Cd  Cd2  1  0.66  0.5  0.41  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.15  0.0  0.86  1.0

data_Cd2AgPb
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.37
_cell_length_b   5.01
_cell_length_c   5.83
_cell_angle_alpha   90.0
_cell_angle_beta   100.63
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Cd2AgPb
_chemical_formula_sum   'Cd2 Ag1 Pb1'
_cell_volume   96.65
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.63  0.5  0.31  1.0
  Cd  Cd1  1  0.66  0.5  0.41  1.0
  Ag  Ag2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.15  0.0  0.86  1.0

Cd Cd Ag Pb
Cd Cd Ag Pb 0 1 o o o 2 3 o o - 