data_[Nd2Dy4Tl6Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nd  1.1400  1.8500  1.2765
  Dy  1.2200  1.7500  1.1310
  Tl  1.6200  1.9000  1.3325
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.7889]
_cell_length_b [13.4878]
_cell_length_c [8.5954]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.5840]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [NdDy2(TlTe2)3]
_chemical_formula_sum '[Nd2 Dy4 Tl6 Te12]'
_cell_volume [860.7919]
_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
[
  Nd  Nd0  2  0.0000  0.0000  0.0000  1.0
  Dy  Dy1  4  0.0000  0.3330  0.0000  1.0
  Tl  Tl2  4  0.0000  0.1643  0.5000  1.0
  Tl  Tl3  2  0.0000  0.5000  0.5000  1.0
  Te  Te4  8  0.2427  0.1705  0.2162  1.0
  Te  Te5  4  0.2303  0.5000  0.2142  1.0
]