data_Hf2CrBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.5
_cell_length_b   4.33
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   106.56
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2CrBi
_chemical_formula_sum   'Hf2 Cr1 Bi1'
_cell_volume   82.89
_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  0.56  0.17  0.06  1.0
  Hf  Hf3  1  0.08  0.0  0.53  1.0
  Cr  Cr1  1  0.24  0.0  0.44  1.0
  Bi  Bi0  1  0.33  0.17  0.61  1.0

data_Hf2CrBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   4.33
_cell_length_c   5.69
_cell_angle_alpha   90.0
_cell_angle_beta   106.56
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2CrBi
_chemical_formula_sum   'Hf2 Cr1 Bi1'
_cell_volume   82.89
_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  0.08  0.0  0.53  1.0
  Hf  Hf1  1  0.56  0.17  0.06  1.0
  Cr  Cr2  1  0.24  0.0  0.44  1.0
  Bi  Bi3  1  0.33  0.17  0.61  1.0

Hf Hf Cr Bi