data_[Tb4Sc6Tl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Sc  1.3600  1.6000  0.8850
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.4093]
_cell_length_b [4.5388]
_cell_length_c [7.8080]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1335]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb2Sc3Tl2]
_chemical_formula_sum '[Tb4 Sc6 Tl4]'
_cell_volume [381.9981]
_cell_formula_units_Z [2]
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  0.1294  0.0000  0.7717  1.0
  Sc  Sc1  4  0.1249  0.5000  0.4392  1.0
  Sc  Sc2  2  0.0000  0.5000  0.0000  1.0
  Tl  Tl3  4  0.1649  0.0000  0.2086  1.0
]