data_CdAs2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.52
_cell_length_b   4.52
_cell_length_c   6.43
_cell_angle_alpha   109.26
_cell_angle_beta   109.26
_cell_angle_gamma   40.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdAs2Rh
_chemical_formula_sum   'Cd1 As2 Rh1'
_cell_volume   80.11
_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
  Cd  Cd2  1  0.45  0.0  0.06  1.0
  As  As0  1  0.35  0.0  0.98  1.0
  As  As1  1  0.11  0.0  0.53  1.0
  Rh  Rh3  1  0.41  0.0  0.46  1.0

data_CdAs2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.14
_cell_length_b   4.52
_cell_length_c   6.43
_cell_angle_alpha   109.26
_cell_angle_beta   90.0
_cell_angle_gamma   110.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CdAs2Rh
_chemical_formula_sum   'Cd1 As2 Rh1'
_cell_volume   80.11
_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
  Cd  Cd0  1  0.0  0.55  0.94  1.0
  As  As1  1  0.0  0.65  0.02  1.0
  As  As2  1  0.0  0.89  0.47  1.0
  Rh  Rh3  1  0.0  0.59  0.54  1.0

Cd As As Rh
Cd As As Rh 0 1 o o - 2 3 o o o 