data_[La32Nd8Y16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Nd  1.1400  1.8500  1.2765
  Y  1.2200  1.8000  1.0400
]
_symmetry_space_group_name_H-M [Fdd2]
_cell_length_a [12.2426]
_cell_length_b [24.7644]
_cell_length_c [6.5784]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [43]
_chemical_formula_structural [La4NdY2]
_chemical_formula_sum '[La32 Nd8 Y16]'
_cell_volume [1994.4481]
_cell_formula_units_Z [8]
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
[
  La  La0  16  0.0447  0.0730  0.0920  1
  La  La1  16  0.0629  0.1421  0.6103  1
  Nd  Nd2  8  0.0000  0.0000  0.5756  1
  Y  Y3  16  0.0252  0.2176  0.1323  1
]