data_[Nd4Ho12Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Ho  1.2300  1.7500  1.0410
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.3117]
_cell_length_b [7.2193]
_cell_length_c [8.1160]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.4093]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NdHo3Cd]
_chemical_formula_sum '[Nd4 Ho12 Cd4]'
_cell_volume [621.1695]
_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  4  0.0580  0.0000  0.2354  1
  Ho  Ho1  8  0.1586  0.2508  0.6342  1
  Ho  Ho2  4  0.0610  0.5000  0.2422  1
  Cd  Cd3  4  0.2406  0.5000  0.0002  1
]