data_[La4Tl2Si2Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Tl  1.6200  1.9000  1.3325
  Si  1.9000  1.1000  0.5400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [5.6306]
_cell_length_b [8.9099]
_cell_length_c [8.6137]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [La2TlSiPd6]
_chemical_formula_sum '[La4 Tl2 Si2 Pd12]'
_cell_volume [432.1333]
_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  0.2545  0.7415  1
  Tl  Tl1  2  0.0000  0.5000  0.2913  1
  Si  Si2  2  0.0000  0.0000  0.2201  1
  Pd  Pd3  4  0.0000  0.2471  0.0983  1
  Pd  Pd4  4  0.2460  0.0000  0.4434  1
  Pd  Pd5  4  0.2479  0.5000  0.0082  1
]