data_SbPd2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.37
_cell_length_b   3.37
_cell_length_c   7.32
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbPd2Pb
_chemical_formula_sum   'Sb1 Pd2 Pb1'
_cell_volume   83.0
_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
  Sb  Sb3  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.32  0.0  0.76  1.0
  Pd  Pd2  1  0.32  0.0  0.56  1.0
  Pb  Pb0  1  0.0  0.0  0.66  1.0

data_SbPd2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.37
_cell_length_b   3.37
_cell_length_c   7.32
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.1
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbPd2Pb
_chemical_formula_sum   'Sb1 Pd2 Pb1'
_cell_volume   83.0
_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
  Sb  Sb0  1  0.0  0.0  0.0  1.0
  Pd  Pd1  1  0.32  0.0  0.56  1.0
  Pd  Pd2  1  0.32  0.0  0.76  1.0
  Pb  Pb3  1  0.0  0.0  0.66  1.0

Sb Pd Pd Pb
Sb Pd Pd Pb 0 1 o o - 1 3 o o o 1 2 o o o 2 3 o o o 