data_[Ba2Zn4F14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Zn  1.6500  1.3500  0.8800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [6.5718]
_cell_length_b [10.6562]
_cell_length_c [3.9803]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [BaZn2F7]
_chemical_formula_sum '[Ba2 Zn4 F14]'
_cell_volume [278.7429]
_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
[
  Ba  Ba0  2  0.0000  0.0000  0.0000  1.0
  Zn  Zn1  4  0.0000  0.3054  0.5000  1.0
  F  F2  8  0.1895  0.1373  0.5000  1.0
  F  F3  4  0.0000  0.2883  0.0000  1.0
  F  F4  2  0.0000  0.5000  0.5000  1.0
]