data_[La24S16N12Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  S  2.5800  1.0000  0.8800
  N  3.0400  0.6500  0.6300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [11.9153]
_cell_length_b [4.1185]
_cell_length_c [27.2314]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [La6S4N3Cl]
_chemical_formula_sum '[La24 S16 N12 Cl4]'
_cell_volume [1336.3225]
_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
[
  La  La0  4  0.0547  0.7500  0.3102  1
  La  La1  4  0.0581  0.7500  0.5740  1
  La  La2  4  0.0909  0.7500  0.0404  1
  La  La3  4  0.1154  0.7500  0.7942  1
  La  La4  4  0.2328  0.2500  0.9350  1
  La  La5  4  0.2379  0.2500  0.6700  1
  S  S6  4  0.0446  0.2500  0.8639  1
  S  S7  4  0.1473  0.2500  0.4946  1
  S  S8  4  0.1808  0.2500  0.3611  1
  S  S9  4  0.2137  0.2500  0.1041  1
  N  N10  4  0.0639  0.2500  0.6248  1
  N  N11  4  0.0965  0.2500  0.9894  1
  N  N12  4  0.1108  0.2500  0.7388  1
  Cl  Cl13  4  0.1357  0.2500  0.2346  1
]