data_[Tb12Te6C2Se4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Te  2.1000  1.4000  1.2933
  C  2.5500  0.7000  0.3000
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1693]
_cell_length_b [12.3376]
_cell_length_c [7.3616]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.7050]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb6Te3CSe2]
_chemical_formula_sum '[Tb12 Te6 C2 Se4]'
_cell_volume [616.7547]
_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  0.2156  0.1487  0.2020  1.0
  Tb  Tb1  4  0.2256  0.0000  0.7896  1.0
  Te  Te2  4  0.0000  0.1764  0.5000  1.0
  Te  Te3  2  0.0000  0.5000  0.5000  1.0
  Se  Se4  4  0.0000  0.3352  0.0000  1.0
  C  C5  2  0.0000  0.0000  0.0000  1.0
]