data_[La20Cu24S28O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Cu  1.9000  1.3500  0.8200
  S  2.5800  1.0000  0.8800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Ima2]
_cell_length_a [15.6941]
_cell_length_b [17.5899]
_cell_length_c [5.5946]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [46]
_chemical_formula_structural [La5Cu6S7O4]
_chemical_formula_sum '[La20 Cu24 S28 O16]'
_cell_volume [1544.4271]
_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  8  0.0681  0.1784  0.0004  1
  La  La1  8  0.1066  0.6674  0.0040  1
  La  La2  4  0.2500  0.1786  0.5001  1
  Cu  Cu3  8  0.1650  0.0114  0.2374  1
  Cu  Cu4  8  0.1650  0.0114  0.7627  1
  Cu  Cu5  4  0.0000  0.0000  0.2442  1
  Cu  Cu6  4  0.0000  0.0000  0.7560  1
  S  S7  8  0.0735  0.0879  0.5002  1
  S  S8  8  0.0900  0.5775  0.5004  1
  S  S9  4  0.2500  0.0947  0.0001  1
  S  S10  4  0.2500  0.5574  0.0002  1
  S  S11  4  0.2500  0.7454  0.2849  1
  O  O12  8  0.0303  0.7498  0.7506  1
  O  O13  8  0.1573  0.2500  0.7501  1
]