data_[Na16Mo8H32O48]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Mo  2.1600  1.4500  0.7750
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pbca]
_cell_length_a [8.2760]
_cell_length_b [11.3976]
_cell_length_c [14.4143]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [61]
_chemical_formula_structural [Na2Mo(H2O3)2]
_chemical_formula_sum '[Na16 Mo8 H32 O48]'
_cell_volume [1359.6466]
_cell_formula_units_Z [8]
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
[
  Na  Na0  8  0.1771  0.0165  0.8379  1
  Na  Na1  8  0.1840  0.5215  0.5694  1
  Mo  Mo2  8  0.0291  0.2278  0.4543  1
  H  H3  8  0.0137  0.5838  0.8196  1
  H  H4  8  0.0195  0.5491  0.1633  1
  H  H5  8  0.1204  0.7492  0.6945  1
  H  H6  8  0.1227  0.7420  0.9019  1
  O  O7  8  0.0212  0.6975  0.9128  1
  O  O8  8  0.0243  0.5067  0.7882  1
  O  O9  8  0.0478  0.6921  0.6654  1
  O  O10  8  0.0669  0.1156  0.9741  1
  O  O11  8  0.1204  0.6206  0.0857  1
  O  O12  8  0.2192  0.1575  0.4330  1
]