data_[Zr2Tl4Sb4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Tl  1.6200  1.9000  1.3325
  Sb  2.0500  1.4500  0.8300
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.2581]
_cell_length_b [5.9719]
_cell_length_c [7.8020]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.5923]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ZrTl2(SbO3)2]
_chemical_formula_sum '[Zr2 Tl4 Sb4 O12]'
_cell_volume [469.8062]
_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
[
  Zr  Zr0  2  0.0000  0.5000  0.5000  1.0
  Tl  Tl1  4  0.2021  0.0000  0.7058  1.0
  Sb  Sb2  4  0.1244  0.0000  0.2247  1.0
  O  O3  8  0.0328  0.2436  0.3248  1.0
  O  O4  4  0.2092  0.5000  0.5986  1.0
]