data_[Tb12Nd4In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Nd  1.1400  1.8500  1.2765
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.8420]
_cell_length_b [5.2807]
_cell_length_c [6.9752]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.8414]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb3NdIn]
_chemical_formula_sum '[Tb12 Nd4 In4]'
_cell_volume [620.2931]
_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
[
  Tb  Tb0  4  0.0039  0.0000  0.7546  1.0
  Tb  Tb1  4  0.1101  0.5000  0.9996  1.0
  Tb  Tb2  4  0.2056  0.0000  0.2503  1.0
  Nd  Nd3  4  0.1094  0.5000  0.4924  1.0
  In  In4  4  0.1969  0.0000  0.7580  1.0
]