data_[Na1Zn1Cu2F6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Zn  1.6500  1.3500  0.8800
  Cu  1.9000  1.3500  0.8200
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.3702]
_cell_length_b [5.4055]
_cell_length_c [5.7958]
_cell_angle_alpha [63.2257]
_cell_angle_beta [62.8391]
_cell_angle_gamma [61.9427]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [NaZnCu2F6]
_chemical_formula_sum '[Na1 Zn1 Cu2 F6]'
_cell_volume [126.0037]
_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  0.8153  0.8074  0.5810  1.0
  Zn  Zn1  1  0.3194  0.3217  0.0463  1.0
  Cu  Cu2  1  0.0179  0.0103  0.9634  1.0
  Cu  Cu3  1  0.5164  0.5179  0.4461  1.0
  F  F4  1  0.1439  0.3744  0.7545  1.0
  F  F5  1  0.2194  0.9440  0.2239  1.0
  F  F6  1  0.4032  0.7007  0.7360  1.0
  F  F7  1  0.5731  0.2619  0.2517  1.0
  F  F8  1  0.7255  0.1187  0.7864  1.0
  F  F9  1  0.9276  0.6047  0.2261  1.0
]