data_NaLa2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.33
_cell_length_b   3.99
_cell_length_c   8.0
_cell_angle_alpha   90.0
_cell_angle_beta   105.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaLa2Pd
_chemical_formula_sum   'Na1 La2 Pd1'
_cell_volume   133.53
_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  Na2  1  0.95  0.0  0.69  1.0
  La  La0  1  0.06  0.0  0.77  1.0
  La  La1  1  0.79  1.0  0.95  1.0
  Pd  Pd3  1  0.9  1.0  0.19  1.0

data_NaLa2Pd
_symmetry_space_group_name_H-M   Pm
_cell_length_a   4.33
_cell_length_b   3.99
_cell_length_c   8.0
_cell_angle_alpha   90.0
_cell_angle_beta   105.09
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   NaLa2Pd
_chemical_formula_sum   'Na1 La2 Pd1'
_cell_volume   133.53
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.95  0.0  0.69  1.0
  La  La1  1  0.06  0.0  0.77  1.0
  La  La2  1  0.79  0.0  0.95  1.0
  Pd  Pd3  1  0.9  0.0  0.19  1.0

Na La La Pd