data_HfCd2In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.65
_cell_length_b   5.65
_cell_length_c   5.65
_cell_angle_alpha   135.19
_cell_angle_beta   135.19
_cell_angle_gamma   65.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCd2In
_chemical_formula_sum   'Hf1 Cd2 In1'
_cell_volume   88.41
_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  0.0  0.0  0.76  1.0
  Cd  Cd0  1  0.15  0.0  0.38  1.0
  Cd  Cd1  1  0.0  0.15  0.38  1.0
  In  In3  1  0.0  0.0  0.0  1.0

data_HfCd2In
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.09
_cell_length_b   6.09
_cell_length_c   5.65
_cell_angle_alpha   90.0
_cell_angle_beta   122.62
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   HfCd2In
_chemical_formula_sum   'Hf2 Cd4 In2'
_cell_volume   176.81
_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  0.24  0.0  0.24  1.0
  Cd  Cd1  4  0.2  0.42  0.77  1.0
  In  In2  2  0.0  0.0  0.0  1.0

Hf Cd Cd In