data_[Sn14Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [13.2964]
_cell_length_b [4.3838]
_cell_length_c [9.7304]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.4670]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Sn7Pd5]
_chemical_formula_sum '[Sn14 Pd10]'
_cell_volume [527.8236]
_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
[
  Sn  Sn0  4  0.0074  0.5048  0.8254  1.0
  Sn  Sn1  4  0.2276  0.0011  0.1167  1.0
  Sn  Sn2  4  0.2467  0.9937  0.6194  1.0
  Sn  Sn3  2  0.0000  0.1755  0.5000  1.0
  Pd  Pd4  4  0.1161  0.9959  0.3198  1.0
  Pd  Pd5  4  0.1296  0.0022  0.8030  1.0
  Pd  Pd6  2  0.0000  0.0091  0.0000  1.0
]