data_Hf2CdCu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.07
_cell_length_b   4.32
_cell_length_c   6.0
_cell_angle_alpha   90.0
_cell_angle_beta   100.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2CdCu
_chemical_formula_sum   'Hf2 Cd1 Cu1'
_cell_volume   78.09
_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  Hf2  1  1.0  0.16  0.33  1.0
  Hf  Hf3  1  0.96  0.16  0.56  1.0
  Cd  Cd0  1  0.44  0.0  0.95  1.0
  Cu  Cu1  1  0.0  0.0  0.0  1.0

data_Hf2CdCu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.07
_cell_length_b   4.32
_cell_length_c   6.0
_cell_angle_alpha   90.0
_cell_angle_beta   100.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2CdCu
_chemical_formula_sum   'Hf2 Cd1 Cu1'
_cell_volume   78.09
_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  Hf0  1  0.96  0.16  0.56  1.0
  Hf  Hf1  1  1.0  0.16  0.33  1.0
  Cd  Cd2  1  0.44  0.0  0.95  1.0
  Cu  Cu3  1  0.0  0.0  0.0  1.0

Hf Hf Cd Cu