data_Li2CdPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.97
_cell_length_b   4.97
_cell_length_c   4.74
_cell_angle_alpha   102.32
_cell_angle_beta   102.32
_cell_angle_gamma   34.99
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CdPd
_chemical_formula_sum   'Li2 Cd1 Pd1'
_cell_volume   65.42
_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
  Li  Li1  1  0.02  0.0  0.0  1.0
  Li  Li2  1  0.48  0.0  0.39  1.0
  Cd  Cd0  1  0.89  0.0  0.17  1.0
  Pd  Pd3  1  0.24  0.0  0.37  1.0

data_Li2CdPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.99
_cell_length_b   4.74
_cell_length_c   4.97
_cell_angle_alpha   102.32
_cell_angle_beta   107.49
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CdPd
_chemical_formula_sum   'Li2 Cd1 Pd1'
_cell_volume   65.42
_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
  Li  Li0  1  0.0  0.0  0.02  1.0
  Li  Li1  1  0.0  0.39  0.48  1.0
  Cd  Cd2  1  0.0  0.17  0.89  1.0
  Pd  Pd3  1  0.0  0.37  0.24  1.0

Li Li Cd Pd