data_[Li4Tl4Si8Te24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tl  1.6200  1.9000  1.3325
  Si  1.9000  1.1000  0.5400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [14.4948]
_cell_length_b [13.1892]
_cell_length_c [7.3949]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.3208]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiTl(SiTe3)2]
_chemical_formula_sum '[Li4 Tl4 Si8 Te24]'
_cell_volume [1342.0553]
_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
[
  Li  Li0  4  0.0000  0.2303  0.7500  1.0
  Tl  Tl1  4  0.0000  0.1743  0.2500  1.0
  Si  Si2  8  0.2141  0.4272  0.2122  1.0
  Te  Te3  8  0.1034  0.0561  0.6664  1.0
  Te  Te4  8  0.1297  0.4361  0.4684  1.0
  Te  Te5  8  0.1662  0.2471  0.0838  1.0
]