data_IrRh3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.2
_cell_length_b   5.2
_cell_length_c   5.2
_cell_angle_alpha   149.56
_cell_angle_beta   63.38
_cell_angle_gamma   125.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrRh3
_chemical_formula_sum   'Ir1 Rh3'
_cell_volume   57.28
_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
  Ir  Ir0  1  0.0  0.43  0.36  1.0
  Rh  Rh1  1  0.0  0.66  0.79  1.0
  Rh  Rh2  1  0.0  0.0  0.37  1.0
  Rh  Rh3  1  0.0  0.2  0.79  1.0

data_IrRh3
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.73
_cell_length_b   4.74
_cell_length_c   5.2
_cell_angle_alpha   117.07
_cell_angle_beta   105.22
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrRh3
_chemical_formula_sum   'Ir1 Rh3'
_cell_volume   57.28
_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
  Ir  Ir0  1  0.36  0.94  0.94  1.0
  Rh  Rh1  1  0.37  0.37  0.37  1.0
  Rh  Rh2  1  0.79  0.13  0.13  1.0
  Rh  Rh3  1  0.79  0.59  0.59  1.0

Ir Rh Rh Rh