data_[Tb12Tm8Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [17.2844]
_cell_length_b [7.0316]
_cell_length_c [6.1127]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.6151]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tb3Tm2Sc]
_chemical_formula_sum '[Tb12 Tm8 Sc4]'
_cell_volume [722.0471]
_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  8  0.1664  0.1258  0.0233  1.0
  Tb  Tb1  4  0.0000  0.1288  0.2500  1.0
  Tm  Tm2  8  0.1646  0.3767  0.5290  1.0
  Sc  Sc3  4  0.0000  0.3787  0.7500  1.0
]