data_[Tb6Mg4Tl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Mg  1.3100  1.5000  0.8600
  Tl  1.6200  1.9000  1.3325
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.6238]
_cell_length_b [4.9584]
_cell_length_c [9.4304]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.4512]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb3(MgTl2)2]
_chemical_formula_sum '[Tb6 Mg4 Tl8]'
_cell_volume [477.8770]
_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  0.1487  0.5000  0.6818  1.0
  Tb  Tb1  2  0.0000  0.0000  0.0000  1.0
  Mg  Mg2  4  0.1507  0.5000  0.3246  1.0
  Tl  Tl3  4  0.0530  0.0000  0.3760  1.0
  Tl  Tl4  4  0.1923  0.5000  0.0458  1.0
]