data_LaIrRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41
_cell_length_b   5.41
_cell_length_c   5.41
_cell_angle_alpha   141.82
_cell_angle_beta   139.81
_cell_angle_gamma   56.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaIrRh
_chemical_formula_sum   'La1 Ir1 Rh1'
_cell_volume   62.71
_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
  La  La1  1  0.0  0.0  0.33  1.0
  Ir  Ir0  1  0.0  0.0  0.12  1.0
  Rh  Rh2  1  0.0  0.0  0.61  1.0

data_LaIrRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.54
_cell_length_b   3.72
_cell_length_c   5.41
_cell_angle_alpha   110.09
_cell_angle_beta   109.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaIrRh
_chemical_formula_sum   'La1 Ir1 Rh1'
_cell_volume   62.71
_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
  La  La0  1  0.0  0.33  0.33  1.0
  Ir  Ir1  1  0.0  0.12  0.12  1.0
  Rh  Rh2  1  0.0  0.61  0.61  1.0

La Ir Rh
La Ir Rh 0 1 o o o 0 2 o o o 