data_[Ba1Zn1Pb2F8]
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
  Pb  2.3300  1.8000  1.1225
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.3549]
_cell_length_b [5.9256]
_cell_length_c [8.2466]
_cell_angle_alpha [86.4218]
_cell_angle_beta [86.6662]
_cell_angle_gamma [85.1928]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaZnPb2F8]
_chemical_formula_sum '[Ba1 Zn1 Pb2 F8]'
_cell_volume [211.3446]
_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
[
  Ba  Ba0  1  0.0000  0.0000  0.5000  1.0
  Zn  Zn1  1  0.0000  0.0000  0.0000  1.0
  Pb  Pb2  2  0.4748  0.4915  0.7639  1.0
  F  F3  2  0.0370  0.3176  0.2513  1.0
  F  F4  2  0.0638  0.1712  0.7923  1.0
  F  F5  2  0.3884  0.7792  0.9707  1.0
  F  F6  2  0.4872  0.2635  0.4966  1.0
]