data_CdAs2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97
_cell_length_b   5.97
_cell_length_c   5.39
_cell_angle_alpha   114.86
_cell_angle_beta   114.86
_cell_angle_gamma   35.01
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdAs2Pb
_chemical_formula_sum   'Cd1 As2 Pb1'
_cell_volume   98.88
_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  Cd2  1  0.68  0.0  0.63  1.0
  As  As0  1  0.59  0.0  0.6  1.0
  As  As1  1  0.32  0.0  0.73  1.0
  Pb  Pb3  1  0.94  0.0  0.13  1.0

data_CdAs2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.59
_cell_length_b   5.39
_cell_length_c   5.97
_cell_angle_alpha   114.86
_cell_angle_beta   107.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdAs2Pb
_chemical_formula_sum   'Cd1 As2 Pb1'
_cell_volume   98.88
_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  0.63  0.68  1.0
  As  As1  1  0.0  0.6  0.59  1.0
  As  As2  1  0.0  0.73  0.32  1.0
  Pb  Pb3  1  0.0  0.13  0.94  1.0

Cd As As Pb