data_YAl2In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.53
_cell_length_b   3.53
_cell_length_c   7.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YAl2In
_chemical_formula_sum   'Y1 Al2 In1'
_cell_volume   88.08
_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
  Y  Y3  1  0.0  0.0  0.62  1.0
  Al  Al0  1  0.42  0.0  0.78  1.0
  Al  Al1  1  0.0  0.0  0.48  1.0
  In  In2  1  0.42  0.0  0.79  1.0

data_YAl2In
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.53
_cell_length_b   3.53
_cell_length_c   7.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   93.36
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YAl2In
_chemical_formula_sum   'Y1 Al2 In1'
_cell_volume   88.08
_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
  Y  Y0  1  0.0  0.0  0.62  1.0
  Al  Al1  1  0.0  0.0  0.48  1.0
  Al  Al2  1  0.42  0.0  0.78  1.0
  In  In3  1  0.42  0.0  0.79  1.0

Y Al Al In
Y Al Al In 0 2 o o o 1 3 o o o 