data_[Sr4Tl4Zn4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.2619]
_cell_length_b [12.2913]
_cell_length_c [10.2291]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.7083]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [SrTlZnCl5]
_chemical_formula_sum '[Sr4 Tl4 Zn4 Cl20]'
_cell_volume [1066.2098]
_cell_formula_units_Z [4]
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
[
  Sr  Sr0  4  0.0000  0.0000  0.0000  1.0
  Tl  Tl1  4  0.0000  0.3455  0.7500  1.0
  Zn  Zn2  4  0.0000  0.3172  0.2500  1.0
  Cl  Cl3  8  0.1222  0.2109  0.1390  1.0
  Cl  Cl4  8  0.1706  0.4289  0.4254  1.0
  Cl  Cl5  4  0.0000  0.0968  0.7500  1.0
]