data_[Li8In6Hg8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.5037]
_cell_length_b [7.2134]
_cell_length_c [15.0697]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Li4In3Hg4]
_chemical_formula_sum '[Li8 In6 Hg8]'
_cell_volume [489.5656]
_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
[
  Li  Li0  8  0.0000  0.2166  0.3245  1
  In  In1  4  0.0000  0.0000  0.1360  1
  In  In2  2  0.0000  0.5000  0.0000  1
  Hg  Hg3  4  0.0000  0.2949  0.5000  1
  Hg  Hg4  4  0.0000  0.5000  0.2037  1
]