data_[La12Nd4Tl4Ga4]
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
  Tl  1.6200  1.9000  1.3325
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.9720]
_cell_length_b [7.7554]
_cell_length_c [6.5875]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7860]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3NdTlGa]
_chemical_formula_sum '[La12 Nd4 Tl4 Ga4]'
_cell_volume [781.2194]
_cell_formula_units_Z [4]
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  0.1335  0.2585  0.0876  1.0
  La  La1  4  0.1696  0.0000  0.5973  1.0
  Nd  Nd2  4  0.0000  0.3016  0.5000  1.0
  Tl  Tl3  4  0.1874  0.5000  0.6804  1.0
  Ga  Ga4  4  0.0006  0.0000  0.2070  1.0
]