data_[Ce3Dy9Tl12Te24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  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 [R-3m]
_cell_length_a [8.9754]
_cell_length_b [8.9754]
_cell_length_c [24.5690]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [CeDy3(TlTe2)4]
_chemical_formula_sum '[Ce3 Dy9 Tl12 Te24]'
_cell_volume [1714.0766]
_cell_formula_units_Z [3]
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
[
  Ce  Ce0  3  -0.0000  -0.0000  0.0000  1
  Dy  Dy1  9  0.0000  0.5000  0.0000  1
  Tl  Tl2  9  0.0000  0.5000  0.5000  1
  Tl  Tl3  3  -0.0000  -0.0000  0.5000  1
  Te  Te4  18  0.0076  0.5038  0.2615  1
  Te  Te5  6  0.0000  0.0000  0.2626  1
]