data_[Tb96Zn40Sb24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Zn  1.6500  1.3500  0.8800
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Ia-3d]
_cell_length_a [17.2050]
_cell_length_b [17.2050]
_cell_length_c [17.2050]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [230]
_chemical_formula_structural [Tb12Zn5Sb3]
_chemical_formula_sum '[Tb96 Zn40 Sb24]'
_cell_volume [5092.9105]
_cell_formula_units_Z [8]
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  96  0.0199  0.0666  0.6479  1
  Zn  Zn1  24  0.0000  0.2500  0.3750  1
  Zn  Zn2  16  0.0000  0.0000  0.0000  1
  Sb  Sb3  24  0.0000  0.2500  0.1250  1
]