data_[Na1Tl2Zn1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Tl  1.6200  1.9000  1.3325
  Zn  1.6500  1.3500  0.8800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.9647]
_cell_length_b [5.9885]
_cell_length_c [5.9896]
_cell_angle_alpha [90.6418]
_cell_angle_beta [118.8073]
_cell_angle_gamma [119.3496]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [NaTl2ZnF6]
_chemical_formula_sum '[Na1 Tl2 Zn1 F6]'
_cell_volume [154.5987]
_cell_formula_units_Z [1]
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
[
  Na  Na0  1  0.9994  0.4981  0.5039  1.0
  Tl  Tl1  1  0.5020  0.2203  0.7797  1.0
  Tl  Tl2  1  0.5084  0.7537  0.2599  1.0
  Zn  Zn3  1  0.0002  0.0006  0.0007  1.0
  F  F4  1  0.0001  0.3014  0.1697  1.0
  F  F5  1  0.0408  0.1879  0.7159  1.0
  F  F6  1  0.0667  0.8661  0.3275  1.0
  F  F7  1  0.4757  0.2071  0.1785  1.0
  F  F8  1  0.5223  0.8192  0.7811  1.0
  F  F9  1  0.8893  0.6468  0.7822  1.0
]