data_[La4Nd3Y2]
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 [P-1]
_cell_length_a [6.3578]
_cell_length_b [6.3735]
_cell_length_c [9.7472]
_cell_angle_alpha [71.2681]
_cell_angle_beta [71.3675]
_cell_angle_gamma [60.1066]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [La4Nd3Y2]
_chemical_formula_sum '[La4 Nd3 Y2]'
_cell_volume [318.1109]
_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
[
  La  La0  2  0.2228  0.8885  0.3344  1
  La  La1  2  0.3348  0.3313  0.9998  1
  Nd  Nd2  2  0.1101  0.4449  0.6657  1
  Nd  Nd3  1  0.0000  0.0000  0.0000  1
  Y  Y4  2  0.4451  0.7795  0.6647  1
]