data_[Nd24Tl4Cd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.0733]
_cell_length_b [10.7982]
_cell_length_c [8.5609]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.4088]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nd12Tl2Cd5]
_chemical_formula_sum '[Nd24 Tl4 Cd10]'
_cell_volume [1170.5141]
_cell_formula_units_Z [2]
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  0.1069  0.2688  0.3968  1.0
  Nd  Nd1  8  0.1759  0.1884  0.8135  1.0
  Nd  Nd2  4  0.0927  0.5000  0.7196  1.0
  Nd  Nd3  4  0.1290  0.0000  0.1475  1.0
  Tl  Tl4  4  0.0000  0.2693  0.0000  1.0
  Cd  Cd5  4  0.1283  0.5000  0.1181  1.0
  Cd  Cd6  4  0.2322  0.0000  0.5279  1.0
  Cd  Cd7  2  0.0000  0.0000  0.5000  1.0
]