data_[Tl4Re4Ag4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Re  1.9000  1.3500  0.7125
  Ag  1.9300  1.6000  1.0867
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [11.6666]
_cell_length_b [2.9095]
_cell_length_c [10.3205]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [TlReAgO3]
_chemical_formula_sum '[Tl4 Re4 Ag4 O12]'
_cell_volume [350.3187]
_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
[
  Tl  Tl0  4  0.2023  0.7500  0.4065  1
  Re  Re1  4  0.0012  0.2500  0.1059  1
  Ag  Ag2  4  0.0642  0.2500  0.5984  1
  O  O3  4  0.0754  0.2500  0.2714  1
  O  O4  4  0.1054  0.2500  0.8184  1
  O  O5  4  0.1180  0.7500  0.0472  1
]