data_[Tb12Co4C2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Co  1.8800  1.3500  0.7683
  C  2.5500  0.7000  0.3000
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.6232]
_cell_length_b [11.4954]
_cell_length_c [7.4868]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7584]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb6Co2CCl3]
_chemical_formula_sum '[Tb12 Co4 C2 Cl6]'
_cell_volume [545.8059]
_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
[
  Tb  Tb0  8  0.2195  0.8411  0.1908  1.0
  Tb  Tb1  4  0.2412  0.5000  0.1906  1.0
  Co  Co2  4  0.0000  0.3321  0.0000  1.0
  C  C3  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl4  4  0.0000  0.1582  0.5000  1.0
  Cl  Cl5  2  0.0000  0.5000  0.5000  1.0
]