data_[Tc8Cl12O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tc  1.9000  1.3500  0.7417
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.2045]
_cell_length_b [8.8004]
_cell_length_c [5.6006]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.3807]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tc2Cl3O4]
_chemical_formula_sum '[Tc8 Cl12 O16]'
_cell_volume [697.8130]
_cell_formula_units_Z [4]
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
[
  Tc  Tc0  8  0.1735  0.3583  0.8311  1
  Cl  Cl1  8  0.1173  0.1804  0.5109  1
  Cl  Cl2  4  0.0000  0.3938  0.7500  1
  O  O3  8  0.1808  0.4952  0.0916  1
  O  O4  8  0.1993  0.1879  0.0774  1
]