data_[Li4Tl4N8O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tl  1.6200  1.9000  1.3325
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8882]
_cell_length_b [10.5514]
_cell_length_c [6.4350]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.4956]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiTl(NO3)2]
_chemical_formula_sum '[Li4 Tl4 N8 O24]'
_cell_volume [575.5765]
_cell_formula_units_Z [4]
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  0.3926  0.2500  1.0
  Tl  Tl1  4  0.0000  0.1125  0.7500  1.0
  N  N2  8  0.2006  0.3862  0.7150  1.0
  O  O3  8  0.0842  0.3366  0.5713  1.0
  O  O4  8  0.1803  0.1799  0.1919  1.0
  O  O5  8  0.1959  0.4976  0.2652  1.0
]