data_[La1Tb5Nd5]
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
  Nd  1.1400  1.8500  1.2765
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [6.2002]
_cell_length_b [6.2002]
_cell_length_c [11.7747]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [La(TbNd)5]
_chemical_formula_sum '[La1 Tb5 Nd5]'
_cell_volume [392.0039]
_cell_formula_units_Z [1]
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  3  0.0006  0.5003  0.5000  1
  Tb  Tb1  2  0.6667  0.3333  0.2661  1
  La  La2  1  0.0000  0.0000  0.0000  1
  Nd  Nd3  2  0.0000  0.0000  0.3253  1
  Nd  Nd4  2  0.3333  0.6667  0.1585  1
  Nd  Nd5  1  0.6667  0.3333  0.0000  1
]