data_[Tb4Sm16In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Sm  1.1700  1.8500  1.2290
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [5.6770]
_cell_length_b [21.2485]
_cell_length_c [6.4718]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [TbSm4In]
_chemical_formula_sum '[Tb4 Sm16 In4]'
_cell_volume [780.6685]
_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  0.0000  0.3639  0.5614  1
  Sm  Sm1  4  0.0000  0.0423  0.2559  1
  Sm  Sm2  4  0.0000  0.1867  0.4162  1
  Sm  Sm3  4  0.0000  0.2488  0.9457  1
  Sm  Sm4  4  0.0000  0.4375  0.0747  1
  In  In5  4  0.0000  0.1040  0.8128  1
]