data_[Tl2W10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.1366]
_cell_length_b [3.2139]
_cell_length_c [6.6738]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.0060]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TlW5]
_chemical_formula_sum '[Tl2 W10]'
_cell_volume [205.5634]
_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  2  0.0000  0.5000  0.5000  1
  W  W1  4  0.1704  0.0000  0.8495  1
  W  W2  4  0.1769  0.0000  0.3215  1
  W  W3  2  0.0000  0.5000  0.0000  1
]