data_[Bi4P8H24I4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Bi  2.0200  1.6000  1.0350
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.6839]
_cell_length_b [15.2368]
_cell_length_c [4.8948]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.5376]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [BiP2H6I]
_chemical_formula_sum '[Bi4 P8 H24 I4]'
_cell_volume [798.9015]
_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
[
  Bi  Bi0  4  0.0000  0.4287  0.2500  1.0
  P  P1  8  0.2296  0.0953  0.4674  1.0
  H  H2  8  0.1349  0.0297  0.3735  1.0
  H  H3  8  0.1766  0.1482  0.6289  1.0
  H  H4  8  0.1847  0.1456  0.1987  1.0
  I  I5  4  0.0000  0.2532  0.7500  1.0
]