data_Cd2FeRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.31
_cell_length_b   9.31
_cell_length_c   9.31
_cell_angle_alpha   17.96
_cell_angle_beta   17.96
_cell_angle_gamma   17.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2FeRh
_chemical_formula_sum   'Cd2 Fe1 Rh1'
_cell_volume   67.0
_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  0.0  0.61  1.0
  Cd  Cd1  1  0.0  0.0  0.87  1.0
  Fe  Fe2  1  0.0  0.0  0.0  1.0
  Rh  Rh3  1  0.0  0.0  0.74  1.0

data_Cd2FeRh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.03
_cell_length_b   2.91
_cell_length_c   9.31
_cell_angle_alpha   90.0
_cell_angle_beta   100.38
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Cd2FeRh
_chemical_formula_sum   'Cd4 Fe2 Rh2'
_cell_volume   134.01
_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
  Cd  Cd0  2  0.0  0.0  0.13  1.0
  Cd  Cd1  2  0.0  0.0  0.39  1.0
  Fe  Fe2  2  0.0  0.0  0.0  1.0
  Rh  Rh3  2  0.0  0.0  0.26  1.0

Cd Cd Fe Rh
Cd Cd Fe Rh 0 3 o o o 1 3 o o o 1 2 o o + 