data_[Li2In8Hg4]
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 [P2_1/m]
_cell_length_a [8.0740]
_cell_length_b [5.9640]
_cell_length_c [8.1257]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.0394]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Li(In2Hg)2]
_chemical_formula_sum '[Li2 In8 Hg4]'
_cell_volume [354.5037]
_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  2  0.2685  0.2500  0.0117  1
  In  In1  4  0.2161  0.0013  0.6456  1
  In  In2  2  0.1515  0.7500  0.2459  1
  In  In3  2  0.4439  0.2500  0.4219  1
  Hg  Hg4  2  0.0216  0.2500  0.1798  1
  Hg  Hg5  2  0.4192  0.7500  0.0622  1
]