data_[Tb12Nd4Y8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Nd  1.1400  1.8500  1.2765
  Y  1.2200  1.8000  1.0400
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [17.5116]
_cell_length_b [7.2149]
_cell_length_c [6.2002]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.2122]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tb3NdY2]
_chemical_formula_sum '[Tb12 Nd4 Y8]'
_cell_volume [783.3548]
_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
[
  Tb  Tb0  8  0.1676  0.1250  0.4162  1.0
  Tb  Tb1  4  0.0000  0.3752  0.2500  1.0
  Nd  Nd2  4  0.0000  0.1247  0.7500  1.0
  Y  Y3  8  0.1672  0.3752  0.9168  1.0
]