data_Cd2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.34
_cell_length_b   10.34
_cell_length_c   10.34
_cell_angle_alpha   157.12
_cell_angle_beta   157.12
_cell_angle_gamma   32.59
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2Bi
_chemical_formula_sum   'Cd4 Bi2'
_cell_volume   167.18
_cell_formula_units_Z   2
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  0.05  0.0  0.45  1.0
  Cd  Cd3  1  0.0  0.0  0.44  1.0
  Cd  Cd4  1  0.05  0.0  0.48  1.0
  Cd  Cd5  1  0.0  0.0  0.41  1.0
  Bi  Bi0  1  0.0  0.05  0.96  1.0
  Bi  Bi1  1  0.0  0.0  0.0  1.0

data_Cd2Bi
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.1
_cell_length_b   4.1
_cell_length_c   10.34
_cell_angle_alpha   101.44
_cell_angle_beta   101.44
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2Bi
_chemical_formula_sum   'Cd4 Bi2'
_cell_volume   167.18
_cell_formula_units_Z   2
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  0.41  0.41  0.41  1.0
  Cd  Cd1  1  0.44  0.44  0.44  1.0
  Cd  Cd2  1  0.45  0.4  0.4  1.0
  Cd  Cd3  1  0.48  0.43  0.43  1.0
  Bi  Bi4  1  0.0  0.0  0.0  1.0
  Bi  Bi5  1  0.91  0.96  0.91  1.0

Cd Cd Cd Cd Bi Bi