data_SiHgPd2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.02
_cell_length_b   3.73
_cell_length_c   6.11
_cell_angle_alpha   90.0
_cell_angle_beta   102.43
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiHgPd2
_chemical_formula_sum   'Si1 Hg1 Pd2'
_cell_volume   67.18
_cell_formula_units_Z   1
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
  Si  Si3  1  0.0  0.0  0.0  1.0
  Hg  Hg0  1  0.34  0.0  0.99  1.0
  Pd  Pd1  1  0.87  0.86  0.72  1.0
  Pd  Pd2  1  0.83  0.86  0.25  1.0

data_SiHgPd2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   3.73
_cell_length_c   6.11
_cell_angle_alpha   90.0
_cell_angle_beta   102.43
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SiHgPd2
_chemical_formula_sum   'Si1 Hg1 Pd2'
_cell_volume   67.18
_cell_formula_units_Z   1
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
  Si  Si0  1  0.0  0.0  0.0  1.0
  Hg  Hg1  1  0.34  0.0  0.99  1.0
  Pd  Pd2  1  0.83  0.86  0.25  1.0
  Pd  Pd3  1  0.87  0.86  0.72  1.0

Si Hg Pd Pd