data_[Li16In2Hg4]
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 [C2/m]
_cell_length_a [7.6993]
_cell_length_b [12.8829]
_cell_length_c [4.7382]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.4297]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li8InHg2]
_chemical_formula_sum '[Li16 In2 Hg4]'
_cell_volume [431.2321]
_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  0.1984  0.1145  0.1225  1
  Li  Li1  4  0.0000  0.2188  0.5000  1
  Li  Li2  4  0.1076  0.5000  0.3137  1
  In  In3  2  0.0000  0.0000  0.5000  1
  Hg  Hg4  4  0.0000  0.3151  0.0000  1
]