data_[Tl8V8S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  V  1.6300  1.3500  0.7775
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.4199]
_cell_length_b [11.3869]
_cell_length_c [5.3633]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.5913]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tl2V2S3]
_chemical_formula_sum '[Tl8 V8 S12]'
_cell_volume [683.2034]
_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
[
  Tl  Tl0  8  0.1348  0.1300  0.1383  1
  V  V1  8  0.1020  0.4922  0.5125  1
  S  S2  8  0.2143  0.3781  0.2917  1
  S  S3  4  0.0000  0.3630  0.7500  1
]