data_[La12Nd4Y6Mg2]
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
  Mg  1.3100  1.5000  0.8600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.3579]
_cell_length_b [11.0142]
_cell_length_c [11.9914]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2678]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La6Nd2Y3Mg]
_chemical_formula_sum '[La12 Nd4 Y6 Mg2]'
_cell_volume [826.2758]
_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  8  0.2482  0.8347  0.2513  1.0
  La  La1  4  0.2467  0.0000  0.7489  1.0
  Nd  Nd2  4  0.0000  0.3330  0.0000  1.0
  Y  Y3  4  0.0000  0.1662  0.5000  1.0
  Y  Y4  2  0.0000  0.5000  0.5000  1.0
  Mg  Mg5  2  0.0000  0.0000  0.0000  1.0
]