data_[Li4Tl4In4Hg24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tl  1.6200  1.9000  1.3325
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [6.9923]
_cell_length_b [10.4273]
_cell_length_c [13.3051]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [LiTlInHg6]
_chemical_formula_sum '[Li4 Tl4 In4 Hg24]'
_cell_volume [970.0945]
_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
[
  Li  Li0  4  0.0000  0.0000  0.5000  1
  Tl  Tl1  4  0.0000  0.2500  0.7108  1
  In  In2  4  0.2500  0.2500  0.2500  1
  Hg  Hg3  16  0.2148  0.0100  0.8677  1
  Hg  Hg4  4  0.0000  0.2500  0.4562  1
  Hg  Hg5  4  0.0000  0.2500  0.9932  1
]