data_Li2CdAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   5.03
_cell_angle_alpha   133.23
_cell_angle_beta   131.51
_cell_angle_gamma   69.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CdAu
_chemical_formula_sum   'Li2 Cd1 Au1'
_cell_volume   68.23
_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  Li2  1  0.0  0.07  0.01  1.0
  Li  Li3  1  0.0  0.0  0.23  1.0
  Cd  Cd1  1  0.0  0.0  0.05  1.0
  Au  Au0  1  0.0  0.07  0.1  1.0

data_Li2CdAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.0
_cell_length_b   4.13
_cell_length_c   5.03
_cell_angle_alpha   114.24
_cell_angle_beta   113.39
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2CdAu
_chemical_formula_sum   'Li2 Cd1 Au1'
_cell_volume   68.23
_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  0.77  0.77  0.77  1.0
  Li  Li1  1  0.99  0.05  0.05  1.0
  Cd  Cd2  1  0.95  0.95  0.95  1.0
  Au  Au3  1  0.9  0.97  0.97  1.0

Li Li Cd Au