data_HfIn2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16
_cell_length_b   5.16
_cell_length_c   5.16
_cell_angle_alpha   130.39
_cell_angle_beta   130.39
_cell_angle_gamma   72.78
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfIn2Rh
_chemical_formula_sum   'Hf1 In2 Rh1'
_cell_volume   78.01
_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  0.17  0.0  0.08  1.0
  In  In1  1  0.0  0.0  0.16  1.0
  In  In2  1  0.0  0.17  0.08  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

data_HfIn2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.33
_cell_length_b   4.33
_cell_length_c   5.16
_cell_angle_alpha   114.8
_cell_angle_beta   114.8
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfIn2Rh
_chemical_formula_sum   'Hf1 In2 Rh1'
_cell_volume   78.01
_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  0.92  0.0  0.09  1.0
  In  In1  1  0.09  0.17  0.09  1.0
  In  In2  1  0.84  0.0  0.84  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

Hf In In Rh
Hf In In Rh 0 3 o o o 1 3 o o o 2 3 o o o 