data_[K4La2Tl2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  La  1.1000  1.9500  1.1720
  Tl  1.6200  1.9000  1.3325
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.6619]
_cell_length_b [8.1748]
_cell_length_c [13.3072]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.5524]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [K2LaTlCl6]
_chemical_formula_sum '[K4 La2 Tl2 Cl12]'
_cell_volume [694.6148]
_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
[
  K  K0  4  0.2876  0.0752  0.2580  1.0
  La  La1  2  0.0000  0.0000  0.5000  1.0
  Tl  Tl2  2  0.5000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.0883  0.0687  0.7302  1.0
  Cl  Cl4  4  0.2516  0.7186  0.5844  1.0
  Cl  Cl5  4  0.3567  0.1776  0.5633  1.0
]