data_[Tl3Zn12Ag9Cl36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [R32]
_cell_length_a [14.1065]
_cell_length_b [14.1065]
_cell_length_c [10.3488]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [155]
_chemical_formula_structural [TlZn4(AgCl4)3]
_chemical_formula_sum '[Tl3 Zn12 Ag9 Cl36]'
_cell_volume [1783.4517]
_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
[
  Tl  Tl0  3  0.0000  0.0000  0.0000  1.0
  Zn  Zn1  9  0.0000  0.4406  0.5000  1.0
  Zn  Zn2  3  0.0000  0.0000  0.5000  1.0
  Ag  Ag3  9  0.0000  0.5544  0.0000  1.0
  Cl  Cl4  18  0.0481  0.2225  0.1687  1.0
  Cl  Cl5  9  0.0000  0.5969  0.5000  1.0
  Cl  Cl6  9  0.0000  0.8435  0.5000  1.0
]