data_[Ti1Cd2Tc1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Cd  1.6900  1.5500  1.0900
  Tc  1.9000  1.3500  0.7417
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P4mm]
_cell_length_a [5.5914]
_cell_length_b [5.5914]
_cell_length_c [3.8724]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [99]
_chemical_formula_structural [TiCd2TcO6]
_chemical_formula_sum '[Ti1 Cd2 Tc1 O6]'
_cell_volume [121.0672]
_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
[
  Ti  Ti0  1  0.0000  0.0000  0.6404  1
  Cd  Cd1  2  0.0000  0.5000  0.0811  1
  Tc  Tc2  1  0.5000  0.5000  0.6555  1
  O  O3  4  0.2492  0.2492  0.6684  1
  O  O4  1  0.0000  0.0000  0.1584  1
  O  O5  1  0.5000  0.5000  0.1566  1
]