data_[Y2Tl4Ag2F12]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.3964]
_cell_length_b [6.5011]
_cell_length_c [11.2300]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.9358]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [YTl2AgF6]
_chemical_formula_sum '[Y2 Tl4 Ag2 F12]'
_cell_volume [387.4441]
_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  0.2623  0.5377  0.7520  1.0
  Ag  Ag2  2  0.5000  0.0000  0.0000  1.0
  F  F3  4  0.1428  0.5292  0.2285  1.0
  F  F4  4  0.2331  0.2243  0.0458  1.0
  F  F5  4  0.3150  0.6917  0.0373  1.0
]