data_[Nd16Dy12Tl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Dy  1.2200  1.7500  1.1310
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.3287]
_cell_length_b [12.7073]
_cell_length_c [6.7089]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.8582]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Nd4Dy3Tl2]
_chemical_formula_sum '[Nd16 Dy12 Tl8]'
_cell_volume [1155.9787]
_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  0.0537  0.2229  0.0262  1.0
  Nd  Nd1  8  0.1943  0.3190  0.6707  1.0
  Dy  Dy2  8  0.1211  0.0348  0.4494  1.0
  Dy  Dy3  4  0.0000  0.4883  0.7500  1.0
  Tl  Tl4  8  0.1990  0.4179  0.1499  1.0
]