data_[Nd24Cd4Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Cd  1.6900  1.5500  1.0900
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [11.4680]
_cell_length_b [13.1957]
_cell_length_c [7.3217]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Nd6CdRh3]
_chemical_formula_sum '[Nd24 Cd4 Rh12]'
_cell_volume [1107.9762]
_cell_formula_units_Z [4]
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
[
  Nd  Nd0  8  0.1595  0.4686  0.8244  1.0
  Nd  Nd1  8  0.2200  0.2806  0.2063  1.0
  Nd  Nd2  4  0.0000  0.0710  0.3618  1.0
  Nd  Nd3  4  0.0000  0.2099  0.8889  1.0
  Cd  Cd4  4  0.0000  0.3281  0.4992  1.0
  Rh  Rh5  8  0.1686  0.0822  0.0426  1.0
  Rh  Rh6  4  0.0000  0.3870  0.1182  1.0
]