data_[K4Na12Tl4Hg4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Na  0.9300  1.8000  1.1600
  Tl  1.6200  1.9000  1.3325
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [8.5657]
_cell_length_b [15.7906]
_cell_length_c [6.6768]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [KNa3TlHg]
_chemical_formula_sum '[K4 Na12 Tl4 Hg4]'
_cell_volume [903.0838]
_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
[
  K  K0  4  0.0000  0.2826  0.7500  1.0
  Na  Na1  8  0.1961  0.5000  0.0000  1.0
  Na  Na2  4  0.0000  0.1476  0.2500  1.0
  Tl  Tl3  4  0.0000  0.0591  0.7500  1.0
  Hg  Hg4  4  0.0000  0.3551  0.2500  1.0
]