data_HfRh2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.33
_cell_length_b   5.33
_cell_length_c   3.0
_cell_angle_alpha   104.64
_cell_angle_beta   104.64
_cell_angle_gamma   118.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfRh2Cl
_chemical_formula_sum   'Hf1 Rh2 Cl1'
_cell_volume   65.29
_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  0.73  0.0  0.0  1.0
  Rh  Rh2  1  0.63  0.71  0.31  1.0
  Rh  Rh3  1  0.63  0.29  0.31  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_HfRh2Cl
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.0
_cell_length_b   4.77
_cell_length_c   5.33
_cell_angle_alpha   115.44
_cell_angle_beta   104.64
_cell_angle_gamma   93.68
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfRh2Cl
_chemical_formula_sum   'Hf1 Rh2 Cl1'
_cell_volume   65.29
_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  0.0  0.73  1.0
  Rh  Rh1  1  0.02  0.71  0.34  1.0
  Rh  Rh2  1  0.59  0.29  0.92  1.0
  Cl  Cl3  1  0.0  0.0  0.0  1.0

Hf Rh Rh Cl