data_[Cs6K2Rb4H12]
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
  Rb  0.8200  2.3500  1.6600
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [19.1019]
_cell_length_b [4.3643]
_cell_length_c [8.7790]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.6806]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs3K(RbH3)2]
_chemical_formula_sum '[Cs6 K2 Rb4 H12]'
_cell_volume [711.1156]
_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  0.1664  0.0000  0.8344  1.0
  Cs  Cs1  2  0.0000  0.5000  0.5000  1.0
  Rb  Rb2  4  0.1656  0.0000  0.3303  1.0
  K  K3  2  0.0000  0.5000  0.0000  1.0
  H  H4  4  0.0025  0.0000  0.2336  1.0
  H  H5  4  0.1595  0.5000  0.0879  1.0
  H  H6  4  0.1694  0.5000  0.5749  1.0
]