data_[Tl4W4O12]
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
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.2629]
_cell_length_b [3.2194]
_cell_length_c [8.4476]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.1410]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [TlWO3]
_chemical_formula_sum '[Tl4 W4 O12]'
_cell_volume [353.9729]
_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
[
  Tl  Tl0  4  0.0474  0.0000  0.8226  1.0
  W  W1  4  0.2335  0.5000  0.3158  1.0
  O  O2  4  0.1175  0.5000  0.1115  1.0
  O  O3  4  0.1755  0.0000  0.4154  1.0
  O  O4  4  0.1924  0.5000  0.7204  1.0
]