data_[Tb4Si12Ni32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Si  1.9000  1.1000  0.5400
  Ni  1.9100  1.3500  0.7400
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [6.3082]
_cell_length_b [13.6256]
_cell_length_c [7.4887]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.6361]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TbSi3Ni8]
_chemical_formula_sum '[Tb4 Si12 Ni32]'
_cell_volume [589.6792]
_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  0.3695  0.2500  1
  Si  Si1  8  0.2302  0.0462  0.3243  1
  Si  Si2  4  0.2500  0.2500  0.0000  1
  Ni  Ni3  8  0.0314  0.1690  0.4221  1
  Ni  Ni4  8  0.1352  0.4251  0.9314  1
  Ni  Ni5  8  0.1425  0.2905  0.6718  1
  Ni  Ni6  4  0.0000  0.0000  0.0000  1
  Ni  Ni7  4  0.0000  0.1228  0.7500  1
]