data_[Cs3Tl1V2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  V  1.6300  1.3500  0.7775
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.1623]
_cell_length_b [6.1623]
_cell_length_c [8.4102]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Cs3TlV2O8]
_chemical_formula_sum '[Cs3 Tl1 V2 O8]'
_cell_volume [276.5850]
_cell_formula_units_Z [1]
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
[
  Cs  Cs0  2  0.3333  0.6667  0.7267  1
  Cs  Cs1  1  0.0000  0.0000  0.0000  1
  Tl  Tl2  1  0.0000  0.0000  0.5000  1
  V  V3  2  0.3333  0.6667  0.2797  1
  O  O4  6  0.1754  0.3508  0.3433  1
  O  O5  2  0.3333  0.6667  0.0787  1
]