data_[Sr2Ca2Zn4F16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ca  1.0000  1.8000  1.1400
  Zn  1.6500  1.3500  0.8800
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [I-4]
_cell_length_a [5.4450]
_cell_length_b [5.4450]
_cell_length_c [11.5136]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [82]
_chemical_formula_structural [SrCaZn2F8]
_chemical_formula_sum '[Sr2 Ca2 Zn4 F16]'
_cell_volume [341.3615]
_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
[
  Sr  Sr0  2  0.0000  0.5000  0.2500  1
  Ca  Ca1  2  0.0000  0.0000  0.0000  1
  Zn  Zn2  2  0.0000  0.0000  0.5000  1
  Zn  Zn3  2  0.0000  0.5000  0.7500  1
  F  F4  8  0.1597  0.7628  0.8384  1
  F  F5  8  0.1770  0.2602  0.4191  1
]