data_NaPdPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26
_cell_length_b   6.26
_cell_length_c   6.26
_cell_angle_alpha   144.89
_cell_angle_beta   134.14
_cell_angle_gamma   59.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaPdPb2
_chemical_formula_sum   'Na1 Pd1 Pb2'
_cell_volume   100.57
_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
  Na  Na0  1  0.0  0.0  0.84  1.0
  Pd  Pd3  1  0.89  0.0  0.28  1.0
  Pb  Pb1  1  0.89  0.0  0.08  1.0
  Pb  Pb2  1  0.0  0.0  0.16  1.0

data_NaPdPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.78
_cell_length_b   4.88
_cell_length_c   6.26
_cell_angle_alpha   112.93
_cell_angle_beta   107.56
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaPdPb2
_chemical_formula_sum   'Na1 Pd1 Pb2'
_cell_volume   100.57
_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
  Na  Na0  1  0.0  0.84  0.84  1.0
  Pd  Pd1  1  0.0  0.28  0.39  1.0
  Pb  Pb2  1  0.0  0.08  0.19  1.0
  Pb  Pb3  1  0.0  0.16  0.16  1.0

Na Pd Pb Pb