data_[Sr2Tl4Cd2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.4636]
_cell_length_b [6.5267]
_cell_length_c [11.1630]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.9413]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [SrTl2CdF6]
_chemical_formula_sum '[Sr2 Tl4 Cd2 F12]'
_cell_volume [386.0364]
_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
[
  Sr  Sr0  2  0.5000  0.0000  0.0000  1.0
  Tl  Tl1  4  0.2380  0.0316  0.2489  1.0
  Cd  Cd2  2  0.0000  0.0000  0.5000  1.0
  F  F3  4  0.1584  0.2217  0.9536  1.0
  F  F4  4  0.2321  0.7072  0.9544  1.0
  F  F5  4  0.3254  0.0251  0.7411  1.0
]