data_MoIrRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.76
_cell_length_b   4.4
_cell_length_c   4.81
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoIrRh2
_chemical_formula_sum   'Mo1 Ir1 Rh2'
_cell_volume   58.49
_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
  Mo  Mo1  1  0.0  0.0  0.03  1.0
  Ir  Ir0  1  0.0  0.2  0.59  1.0
  Rh  Rh2  1  0.38  0.2  0.18  1.0
  Rh  Rh3  1  0.38  0.0  0.4  1.0

data_MoIrRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.76
_cell_length_b   4.4
_cell_length_c   4.81
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoIrRh2
_chemical_formula_sum   'Mo1 Ir1 Rh2'
_cell_volume   58.49
_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
  Mo  Mo0  1  0.0  0.0  0.03  1.0
  Ir  Ir1  1  0.0  0.2  0.59  1.0
  Rh  Rh2  1  0.38  0.0  0.4  1.0
  Rh  Rh3  1  0.38  0.2  0.18  1.0

Mo Ir Rh Rh
Mo Ir Rh Rh 0 2 o o o 1 3 o o o 2 3 o o o 