data_[V2Zn2F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  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 [5.2365]
_cell_length_b [5.5626]
_cell_length_c [5.8801]
_cell_angle_alpha [71.2951]
_cell_angle_beta [77.2062]
_cell_angle_gamma [87.8081]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [VZnF4]
_chemical_formula_sum '[V2 Zn2 F8]'
_cell_volume [158.1074]
_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
[
  V  V0  1  0.0000  0.5000  0.0000  1.0
  V  V1  1  0.5000  0.0000  0.0000  1.0
  Zn  Zn2  2  0.3706  0.3103  0.4057  1.0
  F  F3  2  0.1989  0.1812  0.1875  1.0
  F  F4  2  0.2720  0.5210  0.6613  1.0
  F  F5  2  0.2755  0.6456  0.1514  1.0
  F  F6  2  0.3401  0.0140  0.7009  1.0
]