data_LiCd2Ag
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17
_cell_length_b   5.17
_cell_length_c   5.18
_cell_angle_alpha   99.74
_cell_angle_beta   99.74
_cell_angle_gamma   34.08
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCd2Ag
_chemical_formula_sum   'Li1 Cd2 Ag1'
_cell_volume   76.39
_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  Li3  1  0.46  0.0  0.52  1.0
  Cd  Cd1  1  0.02  0.0  0.05  1.0
  Cd  Cd2  1  0.77  0.0  0.77  1.0
  Ag  Ag0  1  0.2  0.0  0.31  1.0

data_LiCd2Ag
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   5.17
_cell_length_c   5.18
_cell_angle_alpha   99.74
_cell_angle_beta   90.0
_cell_angle_gamma   107.04
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCd2Ag
_chemical_formula_sum   'Li1 Cd2 Ag1'
_cell_volume   76.39
_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  0.54  0.48  1.0
  Cd  Cd1  1  0.0  0.23  0.23  1.0
  Cd  Cd2  1  0.0  0.98  0.95  1.0
  Ag  Ag3  1  0.0  0.8  0.69  1.0

Li Cd Cd Ag