data_AlCd2In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.35
_cell_length_b   6.35
_cell_length_c   3.18
_cell_angle_alpha   103.34
_cell_angle_beta   103.34
_cell_angle_gamma   123.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCd2In
_chemical_formula_sum   'Al1 Cd2 In1'
_cell_volume   92.57
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.49  0.8  0.0  1.0
  Cd  Cd2  1  0.49  0.2  0.0  1.0
  In  In3  1  0.98  0.0  0.0  1.0

data_AlCd2In
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.18
_cell_length_b   5.2
_cell_length_c   6.35
_cell_angle_alpha   113.45
_cell_angle_beta   103.34
_cell_angle_gamma   92.7
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlCd2In
_chemical_formula_sum   'Al1 Cd2 In1'
_cell_volume   92.57
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Cd  Cd1  1  0.2  0.2  0.69  1.0
  Cd  Cd2  1  0.8  0.8  0.3  1.0
  In  In3  1  0.0  0.0  0.98  1.0

Al Cd Cd In