data_[Cs2Tl4Zn2Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [4.9574]
_cell_length_b [10.5089]
_cell_length_c [8.4619]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [CsTl2ZnSb2]
_chemical_formula_sum '[Cs2 Tl4 Zn2 Sb4]'
_cell_volume [440.8331]
_cell_formula_units_Z [2]
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
[
  Cs  Cs0  2  0.0000  0.4596  0.0145  1.0
  Tl  Tl1  2  0.0000  0.1324  0.3532  1.0
  Tl  Tl2  2  0.5000  0.0847  0.0226  1.0
  Zn  Zn3  2  0.5000  0.2127  0.6088  1.0
  Sb  Sb4  2  0.0000  0.1547  0.7415  1.0
  Sb  Sb5  2  0.5000  0.3025  0.3050  1.0
]