data_AlIn2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05
_cell_length_b   5.05
_cell_length_c   4.91
_cell_angle_alpha   97.29
_cell_angle_beta   97.29
_cell_angle_gamma   37.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlIn2Rh
_chemical_formula_sum   'Al1 In2 Rh1'
_cell_volume   75.15
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.82  0.0  0.61  1.0
  In  In2  1  0.09  0.0  0.26  1.0
  Rh  Rh3  1  0.45  0.0  0.43  1.0

data_AlIn2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.23
_cell_length_b   4.91
_cell_length_c   5.05
_cell_angle_alpha   97.29
_cell_angle_beta   108.66
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlIn2Rh
_chemical_formula_sum   'Al1 In2 Rh1'
_cell_volume   75.15
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.0  0.26  0.09  1.0
  In  In2  1  0.0  0.61  0.82  1.0
  Rh  Rh3  1  0.0  0.43  0.45  1.0

Al In In Rh
Al In In Rh 0 2 o o o 0 1 - o - 1 3 o o o 1 2 + o o 2 3 o o o 