data_[Tb4Sm12Sc8]
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
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [17.0809]
_cell_length_b [7.0197]
_cell_length_c [6.0327]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4277]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TbSm3Sc2]
_chemical_formula_sum '[Tb4 Sm12 Sc8]'
_cell_volume [723.3227]
_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  0.1267  0.7500  1.0
  Sm  Sm1  8  0.1693  0.1259  0.4136  1.0
  Sm  Sm2  4  0.0000  0.3768  0.2500  1.0
  Sc  Sc3  8  0.1680  0.3768  0.9195  1.0
]