data_In2AsRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.09
_cell_length_b   5.09
_cell_length_c   5.09
_cell_angle_alpha   129.09
_cell_angle_beta   129.09
_cell_angle_gamma   74.86
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2AsRh
_chemical_formula_sum   'In2 As1 Rh1'
_cell_volume   77.29
_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
  In  In1  1  0.19  0.0  0.02  1.0
  In  In2  1  0.0  0.19  0.02  1.0
  As  As0  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.0  0.0  0.04  1.0

data_In2AsRh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.19
_cell_length_b   6.19
_cell_length_c   5.09
_cell_angle_alpha   90.0
_cell_angle_beta   127.43
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   In2AsRh
_chemical_formula_sum   'In4 As2 Rh2'
_cell_volume   154.58
_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
  In  In0  4  0.07  0.09  0.17  1.0
  As  As1  2  0.0  0.0  0.0  1.0
  Rh  Rh2  2  0.46  0.5  0.96  1.0

In In As Rh
In In As Rh 0 3 o o o 0 2 o o o 1 3 o o o 1 2 o o o 2 3 o o o 