data_[Tl4Cr4In2Te12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cr  1.6600  1.4000  0.9400
  In  1.7800  1.5500  0.9400
  Te  2.1000  1.4000  1.2933
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0866]
_cell_length_b [12.5738]
_cell_length_c [8.1763]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2803]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl2Cr2InTe6]
_chemical_formula_sum '[Tl4 Cr4 In2 Te12]'
_cell_volume [699.3361]
_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  0.0000  0.1557  0.0000  1
  Cr  Cr1  4  0.0000  0.3293  0.5000  1
  In  In2  2  0.0000  0.0000  0.5000  1
  Te  Te3  8  0.2411  0.1798  0.6962  1
  Te  Te4  4  0.2000  0.5000  0.6900  1
]