data_[Ba4Cd2Tc2S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Cd  1.6900  1.5500  1.0900
  Tc  1.9000  1.3500  0.7417
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.1310]
_cell_length_b [6.4805]
_cell_length_c [7.5750]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.0356]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2CdTcS6]
_chemical_formula_sum '[Ba4 Cd2 Tc2 S12]'
_cell_volume [481.5603]
_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
[
  Ba  Ba0  4  0.2488  0.0000  0.7572  1
  Cd  Cd1  2  0.0000  0.0000  0.0000  1
  Tc  Tc2  2  0.0000  0.5000  0.5000  1
  S  S3  8  0.0469  0.2474  0.3216  1
  S  S4  4  0.2362  0.5000  0.8164  1
]