data_[K9Zr3Tl9O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Zr  1.3300  1.5500  0.8600
  Tl  1.6200  1.9000  1.3325
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [6.8510]
_cell_length_b [6.8510]
_cell_length_c [19.0915]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [K3ZrTl3O8]
_chemical_formula_sum '[K9 Zr3 Tl9 O24]'
_cell_volume [776.0420]
_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
[
  K  K0  9  0.0000  0.5000  0.0000  1.0
  Zr  Zr1  3  -0.0000  -0.0000  0.5000  1.0
  Tl  Tl2  9  0.0000  0.5000  0.5000  1.0
  O  O3  18  0.0275  0.5137  0.2281  1.0
  O  O4  6  0.0000  0.0000  0.2285  1.0
]