data_[Ca6Tl9Cd3O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [6.8390]
_cell_length_b [6.8390]
_cell_length_c [16.6496]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Ca2Tl3CdO8]
_chemical_formula_sum '[Ca6 Tl9 Cd3 O24]'
_cell_volume [674.4050]
_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
[
  Ca  Ca0  3  0.0000  0.0000  0.5016  1.0
  Ca  Ca1  3  0.0000  0.0000  0.8813  1.0
  Tl  Tl2  9  0.1676  0.3353  0.3337  1.0
  Cd  Cd3  3  0.0000  0.0000  0.1185  1.0
  O  O4  9  0.0271  0.5135  0.2581  1.0
  O  O5  9  0.1796  0.3591  0.0771  1.0
  O  O6  3  0.0000  0.0000  0.2568  1.0
  O  O7  3  0.0000  0.0000  0.7427  1.0
]