data_[Np10V4S24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Np  1.3600  1.7500  1.0000
  V  1.6300  1.3500  0.7775
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.1266]
_cell_length_b [6.8229]
_cell_length_c [8.4363]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.0589]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Np5(VS6)2]
_chemical_formula_sum '[Np10 V4 S24]'
_cell_volume [832.3739]
_cell_formula_units_Z [2]
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  0.1854  0.5000  0.8489  1
  Np  Np1  4  0.1966  0.5000  0.3499  1
  Np  Np2  2  0.0000  0.0000  0.5000  1
  V  V3  4  0.0000  0.2695  0.0000  1
  S  S4  8  0.1503  0.2492  0.5697  1
  S  S5  8  0.1664  0.2486  0.0878  1
  S  S6  4  0.0003  0.0000  0.1867  1
  S  S7  4  0.0034  0.5000  0.2175  1
]