data_[K4Rb8H28C24O32]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Rb  0.8200  2.3500  1.6600
  H  2.2000  0.2500  0.0000
  C  2.5500  0.7000  0.3000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.2117]
_cell_length_b [11.7264]
_cell_length_c [13.9672]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.8260]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [KRb2H7(C3O4)2]
_chemical_formula_sum '[K4 Rb8 H28 C24 O32]'
_cell_volume [1088.6748]
_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
[
  Rb  Rb0  4  0.1146  0.6659  0.6155  1
  Rb  Rb1  4  0.2216  0.0715  0.3850  1
  K  K2  4  0.2765  0.5575  0.3880  1
  H  H3  4  0.0245  0.6494  0.9472  1
  H  H4  4  0.3788  0.7063  0.0382  1
  H  H5  4  0.4472  0.2028  0.9092  1
  H  H6  4  0.4585  0.2266  0.1157  1
  H  H7  4  0.4701  0.0748  0.7687  1
  H  H8  4  0.4710  0.2041  0.2440  1
  H  H9  4  0.4855  0.5970  0.8470  1
  C  C10  4  0.1198  0.1745  0.7213  1
  C  C11  4  0.2444  0.1768  0.6522  1
  C  C12  4  0.2469  0.1048  0.1274  1
  C  C13  4  0.3039  0.5372  0.1412  1
  C  C14  4  0.3677  0.2143  0.1625  1
  C  C15  4  0.3987  0.0778  0.6835  1
  O  O16  4  0.0675  0.6588  0.8251  1
  O  O17  4  0.1061  0.1649  0.5465  1
  O  O18  4  0.1155  0.0811  0.1641  1
  O  O19  4  0.2038  0.5879  0.1853  1
  O  O20  4  0.2133  0.1837  0.8194  1
  O  O21  4  0.2898  0.0421  0.0643  1
  O  O22  4  0.3340  0.5741  0.0622  1
  O  O23  4  0.4225  0.7144  0.5311  1
]