data_[Li4In4Sn2Hg10]
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
  Sn  1.9600  1.4500  0.8300
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [12.0072]
_cell_length_b [12.0072]
_cell_length_c [3.3961]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Li2In2SnHg5]
_chemical_formula_sum '[Li4 In4 Sn2 Hg10]'
_cell_volume [489.6235]
_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  4  0.1293  0.6293  0.0000  1
  In  In1  4  0.1741  0.3259  0.0000  1
  Sn  Sn2  2  0.0000  0.0000  0.0000  1
  Hg  Hg3  8  0.0528  0.7885  0.5000  1
  Hg  Hg4  2  0.0000  0.5000  0.5000  1
]