data_[Tl14Hg10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.4694]
_cell_length_b [4.2644]
_cell_length_c [11.6887]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.6155]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl7Hg5]
_chemical_formula_sum '[Tl14 Hg10]'
_cell_volume [720.6470]
_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
[
  Tl  Tl0  4  0.0825  0.0000  0.7543  1.0
  Tl  Tl1  4  0.0949  0.5000  0.2571  1.0
  Tl  Tl2  4  0.1658  0.5000  0.0109  1.0
  Tl  Tl3  2  0.0000  0.5000  0.5000  1.0
  Hg  Hg4  4  0.1700  0.0000  0.5061  1.0
  Hg  Hg5  4  0.2404  0.5000  0.7429  1.0
  Hg  Hg6  2  0.0000  0.0000  0.0000  1.0
]