data_[Na5W13O39]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  W  2.3600  1.3500  0.7667
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [8.7195]
_cell_length_b [9.5491]
_cell_length_c [9.5501]
_cell_angle_alpha [99.5824]
_cell_angle_beta [100.5160]
_cell_angle_gamma [89.9979]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Na5(WO3)13]
_chemical_formula_sum '[Na5 W13 O39]'
_cell_volume [770.5324]
_cell_formula_units_Z [1]
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  2  0.1929  0.5772  0.9613  1
  Na  Na1  2  0.3464  0.0381  0.7306  1
  Na  Na2  1  0.5000  0.5000  0.5000  1
  W  W3  2  0.0753  0.2284  0.8834  1
  W  W4  2  0.1527  0.4602  0.2705  1
  W  W5  2  0.2287  0.6930  0.6515  1
  W  W6  2  0.3060  0.9243  0.0385  1
  W  W7  2  0.3818  0.1526  0.4211  1
  W  W8  2  0.4614  0.3843  0.8069  1
  W  W9  1  0.0000  0.0000  0.5000  1
  O  O10  2  0.0378  0.6130  0.1887  1
  O  O11  2  0.0401  0.6152  0.6947  1
  O  O12  2  0.0413  0.1146  0.6929  1
  O  O13  2  0.1128  0.3489  0.0753  1
  O  O14  2  0.1164  0.8438  0.0759  1
  O  O15  2  0.1176  0.8480  0.5784  1
  O  O16  2  0.1936  0.0766  0.9592  1
  O  O17  2  0.1939  0.0766  0.4641  1
  O  O18  2  0.1949  0.5759  0.4616  1
  O  O19  2  0.2690  0.8077  0.8460  1
  O  O20  2  0.2694  0.3076  0.8459  1
  O  O21  2  0.2713  0.3096  0.3477  1
  O  O22  2  0.3461  0.5384  0.7306  1
  O  O23  2  0.3463  0.5385  0.2309  1
  O  O24  2  0.3489  0.0376  0.2307  1
  O  O25  2  0.4230  0.2693  0.6154  1
  O  O26  2  0.4231  0.7691  0.1155  1
  O  O27  2  0.4233  0.7694  0.6153  1
  O  O28  1  0.5000  0.0000  0.0000  1
  O  O29  1  0.5000  0.0000  0.5000  1
  O  O30  1  0.5000  0.5000  0.0000  1
]