data_[La6Tb4Ce2S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tb  1.1000  1.7500  0.9815
  Ce  1.1200  1.8500  1.0800
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0185]
_cell_length_b [12.1538]
_cell_length_c [7.0480]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5567]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La3Tb2CeS6]
_chemical_formula_sum '[La6 Tb4 Ce2 S12]'
_cell_volume [566.5190]
_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
[
  La  La0  4  0.0000  0.1657  0.5000  1.0
  Tb  Tb1  4  0.0000  0.3330  0.0000  1.0
  La  La2  2  0.0000  0.5000  0.5000  1.0
  Ce  Ce3  2  0.0000  0.0000  0.0000  1.0
  S  S4  8  0.2476  0.1690  0.2353  1.0
  S  S5  4  0.2399  0.5000  0.2342  1.0
]