data_[Na6H24S6N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  H  2.2000  0.2500  0.0000
  S  2.5800  1.0000  0.8800
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [4.9717]
_cell_length_b [4.9717]
_cell_length_c [25.0277]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [NaH4SN]
_chemical_formula_sum '[Na6 H24 S6 N6]'
_cell_volume [535.7580]
_cell_formula_units_Z [6]
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  6  0.0000  0.0000  0.3723  1.0
  H  H1  18  0.1030  0.5515  0.5556  1.0
  H  H2  6  0.0000  0.0000  0.1686  1.0
  S  S3  6  0.0000  0.0000  0.2611  1.0
  N  N4  6  0.0000  0.0000  0.1279  1.0
]