data_[Tl24Te10F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Te  2.1000  1.4000  1.2933
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.1155]
_cell_length_b [8.0698]
_cell_length_c [11.0413]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.2042]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl12Te5F2]
_chemical_formula_sum '[Tl24 Te10 F4]'
_cell_volume [1431.1740]
_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
[
  Tl  Tl0  8  0.1499  0.2374  0.0068  1
  Tl  Tl1  8  0.1761  0.2291  0.5762  1
  Tl  Tl2  4  0.0311  0.5000  0.3685  1
  Tl  Tl3  4  0.0627  0.0000  0.2083  1
  Te  Te4  4  0.1660  0.5000  0.7846  1
  Te  Te5  4  0.1742  0.5000  0.2336  1
  Te  Te6  2  0.0000  0.0000  0.5000  1
  F  F7  4  0.0000  0.1822  0.0000  1
]