data_YIn2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.08
_cell_length_b   8.08
_cell_length_c   4.44
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   147.18
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YIn2
_chemical_formula_sum   'Y2 In4'
_cell_volume   157.21
_cell_formula_units_Z   2
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  Y4  1  0.28  0.36  0.33  1.0
  Y  Y5  1  0.28  0.64  0.11  1.0
  In  In0  1  0.28  0.27  0.33  1.0
  In  In1  1  0.28  0.14  0.33  1.0
  In  In2  1  0.28  0.73  0.11  1.0
  In  In3  1  0.28  0.86  0.11  1.0

data_YIn2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.44
_cell_length_b   4.57
_cell_length_c   8.08
_cell_angle_alpha   106.41
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   YIn2
_chemical_formula_sum   'Y2 In4'
_cell_volume   157.21
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  2  0.11  0.64  0.64  1.0
  In  In1  2  0.11  0.73  0.73  1.0
  In  In2  2  0.11  0.86  0.86  1.0

Y Y In In In In