data_[Tl2Bi4Cl14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Bi  2.0200  1.6000  1.0350
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.4305]
_cell_length_b [8.7976]
_cell_length_c [11.0946]
_cell_angle_alpha [76.3405]
_cell_angle_beta [71.6569]
_cell_angle_gamma [72.3424]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TlBi2Cl7]
_chemical_formula_sum '[Tl2 Bi4 Cl14]'
_cell_volume [648.0005]
_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
[
  Tl  Tl0  2  0.0357  0.6734  0.1301  1.0
  Bi  Bi1  2  0.3054  0.1363  0.1530  1.0
  Bi  Bi2  2  0.4483  0.7566  0.5253  1.0
  Cl  Cl3  2  0.0726  0.7666  0.7946  1.0
  Cl  Cl4  2  0.2366  0.8571  0.3557  1.0
  Cl  Cl5  2  0.2770  0.9700  0.9827  1.0
  Cl  Cl6  2  0.2901  0.4648  0.6056  1.0
  Cl  Cl7  2  0.3103  0.3800  0.9691  1.0
  Cl  Cl8  2  0.3133  0.0669  0.6258  1.0
  Cl  Cl9  2  0.3170  0.3454  0.2997  1.0
]