data_[V24S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [I-42m]
_cell_length_a [9.4475]
_cell_length_b [9.4475]
_cell_length_c [4.5414]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [121]
_chemical_formula_structural [V3S]
_chemical_formula_sum '[V24 S8]'
_cell_volume [405.3488]
_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
[
  V  V0  8  0.0000  0.3573  0.0000  1.0
  V  V1  8  0.0914  0.0914  0.7619  1.0
  V  V2  8  0.1997  0.8003  0.7378  1.0
  S  S3  8  0.0000  0.2889  0.5000  1.0
]