data_[Li4Tb10Hg24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tb  1.1000  1.7500  0.9815
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.0436]
_cell_length_b [9.3324]
_cell_length_c [7.3910]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.7216]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Li2Tb5Hg12]
_chemical_formula_sum '[Li4 Tb10 Hg24]'
_cell_volume [934.8285]
_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  0.0000  0.2594  0.0000  1.0
  Tb  Tb1  4  0.1813  0.5000  0.6354  1.0
  Tb  Tb2  4  0.2170  0.5000  0.1776  1.0
  Tb  Tb3  2  0.0000  0.0000  0.5000  1.0
  Hg  Hg4  8  0.1380  0.2441  0.8295  1.0
  Hg  Hg5  8  0.1430  0.2023  0.4003  1.0
  Hg  Hg6  4  0.0032  0.5000  0.2186  1.0
  Hg  Hg7  4  0.1020  0.0000  0.0340  1.0
]