data_[La6Nd4Y12Mg2]
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 [6.2653]
_cell_length_b [10.8467]
_cell_length_c [11.9342]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0990]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3Nd2Y6Mg]
_chemical_formula_sum '[La6 Nd4 Y12 Mg2]'
_cell_volume [798.4640]
_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  0.0000  0.1664  0.5000  1.0
  La  La1  2  0.0000  0.5000  0.5000  1.0
  Nd  Nd2  4  0.0000  0.3337  0.0000  1.0
  Y  Y3  8  0.2471  0.1654  0.2457  1.0
  Y  Y4  4  0.2487  0.0000  0.7539  1.0
  Mg  Mg5  2  0.0000  0.0000  0.0000  1.0
]