data_[Np8Rh4S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Np  1.3600  1.7500  1.0000
  Rh  2.2800  1.3500  0.7450
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [7.8281]
_cell_length_b [3.8230]
_cell_length_c [15.2220]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Np2RhS3]
_chemical_formula_sum '[Np8 Rh4 S12]'
_cell_volume [455.5447]
_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
[
  Np  Np0  4  0.0759  0.7500  0.2770  1
  Np  Np1  4  0.2439  0.2500  0.0307  1
  Rh  Rh2  4  0.1251  0.7500  0.8659  1
  S  S3  4  0.0305  0.7500  0.0962  1
  S  S4  4  0.1000  0.2500  0.4252  1
  S  S5  4  0.1891  0.7500  0.7162  1
]