data_[Cs6Zn4Sn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Zn  1.6500  1.3500  0.8800
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.0044]
_cell_length_b [4.5539]
_cell_length_c [10.9997]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.1404]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs3(ZnSn2)2]
_chemical_formula_sum '[Cs6 Zn4 Sn8]'
_cell_volume [734.7848]
_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
[
  Cs  Cs0  4  0.1114  0.5000  0.3931  1.0
  Cs  Cs1  2  0.0000  0.0000  0.0000  1.0
  Zn  Zn2  4  0.1650  0.5000  0.8238  1.0
  Sn  Sn3  4  0.1223  0.0000  0.6921  1.0
  Sn  Sn4  4  0.2165  0.5000  0.0903  1.0
]