data_[Ti2Tl2Cr2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Tl  1.6200  1.9000  1.3325
  Cr  1.6600  1.4000  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [4.7168]
_cell_length_b [4.7168]
_cell_length_c [9.4635]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [TiTlCrO6]
_chemical_formula_sum '[Ti2 Tl2 Cr2 O12]'
_cell_volume [210.5432]
_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
[
  Ti  Ti0  2  0.0000  0.0000  0.3368  1
  Tl  Tl1  2  0.0000  0.0000  0.9968  1
  Cr  Cr2  2  0.0000  0.0000  0.6629  1
  O  O3  4  0.1753  0.8247  0.5040  1
  O  O4  4  0.2151  0.7849  0.8096  1
  O  O5  4  0.2282  0.7718  0.1881  1
]