data_HfCdBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.72
_cell_length_b   5.72
_cell_length_c   5.72
_cell_angle_alpha   131.37
_cell_angle_beta   131.37
_cell_angle_gamma   71.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCdBi2
_chemical_formula_sum   'Hf1 Cd1 Bi2'
_cell_volume   103.02
_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
  Hf  Hf3  1  0.0  0.0  0.65  1.0
  Cd  Cd2  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.35  0.32  1.0
  Bi  Bi1  1  0.35  0.0  0.32  1.0

data_HfCdBi2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.66
_cell_length_b   6.66
_cell_length_c   5.72
_cell_angle_alpha   90.0
_cell_angle_beta   125.61
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   HfCdBi2
_chemical_formula_sum   'Hf2 Cd2 Bi4'
_cell_volume   206.04
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Hf  Hf0  2  0.35  0.0  0.35  1.0
  Cd  Cd1  2  0.0  0.0  0.0  1.0
  Bi  Bi2  4  0.35  0.32  0.03  1.0

Hf Cd Bi Bi