data_[Tl10V2Te10]
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
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.5711]
_cell_length_b [6.2840]
_cell_length_c [9.0134]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.0569]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl5VTe5]
_chemical_formula_sum '[Tl10 V2 Te10]'
_cell_volume [759.3801]
_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  4  0.1356  0.5000  0.7812  1
  Tl  Tl1  4  0.2032  0.5000  0.3051  1
  Tl  Tl2  2  0.0000  0.0000  0.5000  1
  V  V3  2  0.0000  0.0000  0.0000  1
  Te  Te4  4  0.1411  0.0000  0.3021  1
  Te  Te5  4  0.1509  0.0000  0.8969  1
  Te  Te6  2  0.0000  0.5000  0.0000  1
]