data_[Tl1V1Ge2Cl8]
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
  Ge  2.0100  1.2500  0.7700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.2737]
_cell_length_b [7.2721]
_cell_length_c [8.4625]
_cell_angle_alpha [92.3169]
_cell_angle_beta [91.6153]
_cell_angle_gamma [112.5421]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [TlV(GeCl4)2]
_chemical_formula_sum '[Tl1 V1 Ge2 Cl8]'
_cell_volume [355.8997]
_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
[
  Tl  Tl0  1  0.0000  0.0000  0.5000  1.0
  V  V1  1  0.0000  0.0000  0.0000  1.0
  Ge  Ge2  2  0.3135  0.6707  0.1671  1.0
  Cl  Cl3  2  0.0438  0.7602  0.8275  1.0
  Cl  Cl4  2  0.2489  0.2623  0.8423  1.0
  Cl  Cl5  2  0.3299  0.0182  0.1700  1.0
  Cl  Cl6  2  0.3313  0.6814  0.4354  1.0
]