data_[Li16Hg2Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Hg  2.0000  1.5000  1.2450
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.9230]
_cell_length_b [4.1315]
_cell_length_c [6.2470]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7572]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li8HgPt2]
_chemical_formula_sum '[Li16 Hg2 Pt4]'
_cell_volume [342.2200]
_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  0.0520  0.0000  0.7351  1
  Li  Li1  4  0.1121  0.5000  0.4712  1
  Li  Li2  4  0.1503  0.0000  0.2163  1
  Li  Li3  4  0.1889  0.5000  0.9153  1
  Hg  Hg4  2  0.0000  0.5000  0.0000  1
  Pt  Pt5  4  0.2237  0.0000  0.6513  1
]