data_[Cs3K9Zn12H36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  K  0.8200  2.2000  1.5200
  Zn  1.6500  1.3500  0.8800
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [R32]
_cell_length_a [12.2294]
_cell_length_b [12.2294]
_cell_length_c [9.2886]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [155]
_chemical_formula_structural [CsK3(ZnH3)4]
_chemical_formula_sum '[Cs3 K9 Zn12 H36]'
_cell_volume [1203.0573]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0000  1.0
  K  K1  9  0.0000  0.5485  0.0000  1.0
  Zn  Zn2  9  0.0000  0.4375  0.5000  1.0
  Zn  Zn3  3  0.0000  0.0000  0.5000  1.0
  H  H4  18  0.0258  0.2274  0.1591  1.0
  H  H5  9  0.0000  0.5695  0.5000  1.0
  H  H6  9  0.0000  0.8689  0.5000  1.0
]