data_[La6Zn16Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Zn  1.6500  1.3500  0.8800
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.3526]
_cell_length_b [9.5808]
_cell_length_c [13.1795]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [La3Zn8Pd3]
_chemical_formula_sum '[La6 Zn16 Pd6]'
_cell_volume [549.5989]
_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  0.0000  0.1751  1.0
  La  La1  2  0.0000  0.0000  0.5000  1.0
  Zn  Zn2  8  0.0000  0.2762  0.3766  1.0
  Zn  Zn3  8  0.0000  0.3599  0.1788  1.0
  Pd  Pd4  4  0.0000  0.2311  0.0000  1.0
  Pd  Pd5  2  0.0000  0.5000  0.5000  1.0
]