data_[Ag6Sn2Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.7572]
_cell_length_b [4.1527]
_cell_length_c [9.1722]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.9393]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Ag3SnPd6]
_chemical_formula_sum '[Ag6 Sn2 Pd12]'
_cell_volume [332.7702]
_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
[
  Ag  Ag0  2  0.2504  0.2500  0.9945  1
  Ag  Ag1  2  0.3430  0.7500  0.7971  1
  Ag  Ag2  2  0.4464  0.2500  0.5978  1
  Sn  Sn3  2  0.0681  0.2500  0.3730  1
  Pd  Pd4  2  0.0468  0.7500  0.9026  1
  Pd  Pd5  2  0.1324  0.2500  0.6843  1
  Pd  Pd6  2  0.1586  0.7500  0.1903  1
  Pd  Pd7  2  0.2345  0.7500  0.4959  1
  Pd  Pd8  2  0.3570  0.2500  0.2959  1
  Pd  Pd9  2  0.4524  0.7500  0.0993  1
]