data_[Na24P8S16O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  P  2.1900  1.0000  0.5500
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pbca]
_cell_length_a [5.8950]
_cell_length_b [17.8136]
_cell_length_c [11.4268]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [61]
_chemical_formula_structural [Na3P(SO)2]
_chemical_formula_sum '[Na24 P8 S16 O16]'
_cell_volume [1199.9353]
_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  0.1528  0.5539  0.1700  1
  Na  Na1  8  0.1911  0.2371  0.1192  1
  Na  Na2  8  0.2324  0.0887  0.8789  1
  P  P3  8  0.1768  0.6109  0.4408  1
  S  S4  8  0.1885  0.2097  0.3762  1
  S  S5  8  0.2227  0.1014  0.6160  1
  O  O6  8  0.0848  0.1153  0.0613  1
  O  O7  8  0.2331  0.0440  0.3682  1
]