data_[Zn2Fe2Ni2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Fe  1.8300  1.4000  0.8525
  Ni  1.9100  1.3500  0.7400
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [4.7672]
_cell_length_b [4.7672]
_cell_length_c [9.6138]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [ZnFeNiF6]
_chemical_formula_sum '[Zn2 Fe2 Ni2 F12]'
_cell_volume [218.4881]
_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
[
  Zn  Zn0  2  0.0000  0.0000  0.6658  1.0
  Fe  Fe1  2  0.0000  0.0000  0.3335  1.0
  Ni  Ni2  2  0.0000  0.0000  0.0005  1.0
  F  F3  4  0.1944  0.8056  0.8356  1.0
  F  F4  4  0.1968  0.8032  0.1616  1.0
  F  F5  4  0.2006  0.7994  0.5029  1.0
]