data_[K4Al8P8H16O44]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Al  1.6100  1.2500  0.6750
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_12_12_1]
_cell_length_a [9.1041]
_cell_length_b [9.9603]
_cell_length_c [10.0808]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [19]
_chemical_formula_structural [KAl2P2H4O11]
_chemical_formula_sum '[K4 Al8 P8 H16 O44]'
_cell_volume [914.1268]
_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  0.2410  0.9806  0.3568  1
  Al  Al1  4  0.0863  0.7296  0.6503  1
  Al  Al2  4  0.1377  0.5017  0.1813  1
  P  P3  4  0.0721  0.5245  0.8657  1
  P  P4  4  0.0752  0.2008  0.1381  1
  H  H5  4  0.0174  0.4111  0.4963  1
  H  H6  4  0.0909  0.7940  0.0394  1
  H  H7  4  0.1657  0.2964  0.6788  1
  H  H8  4  0.1746  0.7437  0.2316  1
  O  O9  4  0.0026  0.1471  0.7063  1
  O  O10  4  0.0030  0.0891  0.2199  1
  O  O11  4  0.0082  0.3925  0.8111  1
  O  O12  4  0.0266  0.1957  0.9920  1
  O  O13  4  0.0320  0.3381  0.1996  1
  O  O14  4  0.0466  0.5384  0.0163  1
  O  O15  4  0.0826  0.8795  0.9925  1
  O  O16  4  0.1902  0.5686  0.6188  1
  O  O17  4  0.2279  0.6892  0.1667  1
  O  O18  4  0.2412  0.5326  0.8372  1
  O  O19  4  0.2430  0.1736  0.1419  1
]