data_[K3Zn1F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Zn  1.6500  1.3500  0.8800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.1568]
_cell_length_b [6.1591]
_cell_length_c [6.3427]
_cell_angle_alpha [90.0200]
_cell_angle_beta [118.9224]
_cell_angle_gamma [119.5762]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [K3ZnF6]
_chemical_formula_sum '[K3 Zn1 F6]'
_cell_volume [173.8259]
_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
[
  K  K0  2  0.4922  0.7496  0.2287  1.0
  K  K1  1  0.0000  0.5000  0.5000  1.0
  Zn  Zn2  1  0.0000  0.0000  0.0000  1.0
  F  F3  2  0.0143  0.2869  0.8530  1.0
  F  F4  2  0.0798  0.1930  0.3083  1.0
  F  F5  2  0.4394  0.1758  0.1632  1.0
]