data_[Cs4Sr4Zn4Br20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sr  0.9500  2.0000  1.3200
  Zn  1.6500  1.3500  0.8800
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.0717]
_cell_length_b [13.3471]
_cell_length_c [10.8815]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.3777]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsSrZnBr5]
_chemical_formula_sum '[Cs4 Sr4 Zn4 Br20]'
_cell_volume [1332.3678]
_cell_formula_units_Z [4]
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
[
  Cs  Cs0  4  0.0000  0.3495  0.7500  1.0
  Sr  Sr1  4  0.0000  0.0000  0.0000  1.0
  Zn  Zn2  4  0.0000  0.3122  0.2500  1.0
  Br  Br3  8  0.1094  0.2122  0.1265  1.0
  Br  Br4  8  0.1787  0.4210  0.4232  1.0
  Br  Br5  4  0.0000  0.0866  0.7500  1.0
]