[CIF]
data_SiPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.05412245
_cell_length_b   4.05412245
_cell_length_c   13.42251900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiPd
_chemical_formula_sum   'Si6 Pd6'
_cell_volume   191.05498911
_cell_formula_units_Z   6
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
  Pd  Pd0  1  0.00000000  0.00000000  3.72985589  1
  Pd  Pd1  1  0.00000000  0.00000000  9.69266311  1
  Pd  Pd2  1  0.00000000  2.34064869  8.19600191  1
  Pd  Pd3  1  0.00000000  2.34064869  0.64541444  1
  Pd  Pd4  1  2.02706123  1.17032434  12.77710456  1
  Pd  Pd5  1  2.02706123  1.17032434  5.22651709  1
  Si  Si6  1  0.00000000  0.00000000  1.28245458  1
  Si  Si7  1  0.00000000  0.00000000  12.14006442  1
  Si  Si8  1  0.00000000  2.34064869  5.69533347  1
  Si  Si9  1  0.00000000  2.34064869  3.08236713  1
  Si  Si10  1  2.02706123  1.17032434  10.34015187  1
  Si  Si11  1  2.02706123  1.17032434  7.72718553  1
[/CIF]
