data_[Na6Tl3Co3F18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Tl  1.6200  1.9000  1.3325
  Co  1.8800  1.3500  0.7683
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [R3]
_cell_length_a [5.7802]
_cell_length_b [5.7802]
_cell_length_c [15.8650]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [Na2TlCoF6]
_chemical_formula_sum '[Na6 Tl3 Co3 F18]'
_cell_volume [459.0511]
_cell_formula_units_Z [3]
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
[
  Na  Na0  3  0.0000  0.0000  0.4697  1
  Na  Na1  3  0.0000  0.0000  0.9960  1
  Tl  Tl2  3  0.0000  0.0000  0.2010  1
  Co  Co3  3  0.0000  0.0000  0.6708  1
  F  F4  9  0.0438  0.7665  0.5984  1
  F  F5  9  0.0706  0.3837  0.4022  1
]