data_Hf2CrPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.43
_cell_length_b   5.43
_cell_length_c   4.37
_cell_angle_alpha   112.99
_cell_angle_beta   112.99
_cell_angle_gamma   36.56
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2CrPd
_chemical_formula_sum   'Hf2 Cr1 Pd1'
_cell_volume   70.09
_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  Hf1  1  0.1  0.0  0.06  1.0
  Hf  Hf2  1  0.2  0.0  0.96  1.0
  Cr  Cr0  1  0.28  0.0  0.97  1.0
  Pd  Pd3  1  0.2  0.0  0.98  1.0

data_Hf2CrPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.41
_cell_length_b   4.37
_cell_length_c   5.43
_cell_angle_alpha   112.99
_cell_angle_beta   108.28
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2CrPd
_chemical_formula_sum   'Hf2 Cr1 Pd1'
_cell_volume   70.09
_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  0.0  0.06  0.1  1.0
  Hf  Hf1  1  0.0  0.96  0.2  1.0
  Cr  Cr2  1  0.0  0.97  0.28  1.0
  Pd  Pd3  1  0.0  0.98  0.2  1.0

Hf Hf Cr Pd