data_[K8Cd8S12O48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Cd  1.6900  1.5500  1.0900
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [10.3786]
_cell_length_b [10.4177]
_cell_length_c [10.4834]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [K2Cd2(SO4)3]
_chemical_formula_sum '[K8 Cd8 S12 O48]'
_cell_volume [1133.4755]
_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
[
  K  K0  4  0.0799  0.4439  0.5626  1
  K  K1  4  0.2137  0.8125  0.3115  1
  Cd  Cd2  4  0.0554  0.5841  0.9066  1
  Cd  Cd3  4  0.1462  0.1765  0.1632  1
  S  S4  4  0.0347  0.7762  0.6209  1
  S  S5  4  0.1354  0.4975  0.2397  1
  S  S6  4  0.2479  0.8815  0.9674  1
  O  O7  4  0.0104  0.1750  0.7888  1
  O  O8  4  0.0350  0.9047  0.6844  1
  O  O9  4  0.0545  0.2797  0.9892  1
  O  O10  4  0.0592  0.5925  0.3157  1
  O  O11  4  0.0762  0.3680  0.2572  1
  O  O12  4  0.1417  0.5367  0.1032  1
  O  O13  4  0.1481  0.1743  0.5499  1
  O  O14  4  0.1501  0.7817  0.9401  1
  O  O15  4  0.1683  0.7445  0.5760  1
  O  O16  4  0.1835  0.9906  0.0325  1
  O  O17  4  0.1935  0.0697  0.3459  1
  O  O18  4  0.2303  0.4998  0.7900  1
]