data_[Cs1V1Sn2I8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  V  1.6300  1.3500  0.7775
  Sn  1.9600  1.4500  0.8300
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.3892]
_cell_length_b [8.2385]
_cell_length_c [10.3711]
_cell_angle_alpha [71.0160]
_cell_angle_beta [78.4468]
_cell_angle_gamma [73.2171]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CsV(SnI4)2]
_chemical_formula_sum '[Cs1 V1 Sn2 I8]'
_cell_volume [567.6265]
_cell_formula_units_Z [1]
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
[
  Cs  Cs0  1  0.0000  0.0000  0.5000  1.0
  V  V1  1  0.0000  0.0000  0.0000  1.0
  Sn  Sn2  2  0.4414  0.4345  0.7420  1.0
  I  I3  2  0.1395  0.7201  0.2340  1.0
  I  I4  2  0.2523  0.1886  0.0067  1.0
  I  I5  2  0.2621  0.8306  0.8284  1.0
  I  I6  2  0.4305  0.2591  0.5319  1.0
]