data_CuIrRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.83
_cell_length_b   8.83
_cell_length_c   8.83
_cell_angle_alpha   17.7
_cell_angle_beta   17.7
_cell_angle_gamma   17.7
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuIrRh2
_chemical_formula_sum   'Cu1 Ir1 Rh2'
_cell_volume   55.51
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Ir  Ir1  1  0.0  0.0  0.03  1.0
  Rh  Rh2  1  0.0  0.0  0.51  1.0
  Rh  Rh3  1  0.0  0.0  0.55  1.0

data_CuIrRh2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.7
_cell_length_b   2.72
_cell_length_c   8.83
_cell_angle_alpha   90.0
_cell_angle_beta   100.23
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   CuIrRh2
_chemical_formula_sum   'Cu2 Ir2 Rh4'
_cell_volume   111.01
_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
  Cu  Cu0  2  0.0  0.0  0.0  1.0
  Ir  Ir1  2  0.0  0.0  0.97  1.0
  Rh  Rh2  2  0.0  0.0  0.45  1.0
  Rh  Rh3  2  0.0  0.0  0.49  1.0

Cu Ir Rh Rh