data_[La8Nd10Er2]
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
  Er  1.2400  1.7500  1.0300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9580]
_cell_length_b [5.6664]
_cell_length_c [10.7305]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.1983]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La4Nd5Er]
_chemical_formula_sum '[La8 Nd10 Er2]'
_cell_volume [727.0835]
_cell_formula_units_Z [2]
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  4  0.0469  0.0000  0.7535  1
  La  La1  4  0.1792  0.5000  0.2497  1
  Nd  Nd2  4  0.1947  0.0000  0.4370  1
  Nd  Nd3  4  0.1962  0.0000  0.0645  1
  Nd  Nd4  2  0.0000  0.5000  0.5000  1
  Er  Er5  2  0.0000  0.5000  0.0000  1
]