data_Na2AlPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.07
_cell_length_b   6.07
_cell_length_c   6.07
_cell_angle_alpha   150.12
_cell_angle_beta   136.16
_cell_angle_gamma   53.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2AlPd
_chemical_formula_sum   'Na2 Al1 Pd1'
_cell_volume   76.74
_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  Na1  1  0.0  0.27  0.42  1.0
  Na  Na2  1  0.57  0.0  0.99  1.0
  Al  Al0  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.0  0.0  0.41  1.0

data_Na2AlPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.13
_cell_length_b   4.53
_cell_length_c   6.07
_cell_angle_alpha   111.92
_cell_angle_beta   104.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2AlPd
_chemical_formula_sum   'Na2 Al1 Pd1'
_cell_volume   76.74
_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  0.57  0.01  0.57  1.0
  Na  Na1  1  0.58  0.85  0.85  1.0
  Al  Al2  1  0.0  0.0  0.0  1.0
  Pd  Pd3  1  0.59  0.59  0.59  1.0

Na Na Al Pd