data_[La12Tb24Y4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tb  1.1000  1.7500  0.9815
  Y  1.2200  1.8000  1.0400
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [10.9832]
_cell_length_b [19.1535]
_cell_length_c [6.4448]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [La3Tb6Y]
_chemical_formula_sum '[La12 Tb24 Y4]'
_cell_volume [1355.7719]
_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  0.1714  0.4536  0.0528  1
  La  La1  8  0.1758  0.1148  0.9718  1
  Tb  Tb2  8  0.2351  0.2888  0.8662  1
  Tb  Tb3  4  0.0000  0.0327  0.3604  1
  Tb  Tb4  4  0.0000  0.2742  0.1515  1
  La  La5  4  0.0000  0.3876  0.5758  1
  Y  Y6  4  0.0000  0.1873  0.6162  1
]