data_[Y2Tl4Ag2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Tl  1.6200  1.9000  1.3325
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.3914]
_cell_length_b [7.7131]
_cell_length_c [12.6912]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.9775]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [YTl2AgCl6]
_chemical_formula_sum '[Y2 Tl4 Ag2 Cl12]'
_cell_volume [592.8522]
_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
[
  Y  Y0  2  0.0000  0.0000  0.5000  1.0
  Tl  Tl1  4  0.2714  0.0672  0.2517  1.0
  Ag  Ag2  2  0.5000  0.0000  0.0000  1.0
  Cl  Cl3  4  0.1586  0.0197  0.7481  1.0
  Cl  Cl4  4  0.2343  0.7140  0.5442  1.0
  Cl  Cl5  4  0.3348  0.1923  0.5437  1.0
]