data_InPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45
_cell_length_b   5.45
_cell_length_c   5.45
_cell_angle_alpha   138.82
_cell_angle_beta   136.1
_cell_angle_gamma   61.76
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InPd
_chemical_formula_sum   'In2 Pd2'
_cell_volume   73.02
_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
  In  In0  1  0.92  0.02  0.54  1.0
  In  In1  1  0.0  0.02  0.14  1.0
  Pd  Pd2  1  0.92  0.02  0.83  1.0
  Pd  Pd3  1  0.0  0.02  0.85  1.0

data_InPd
_symmetry_space_group_name_H-M   P-1
_cell_length_a   3.83
_cell_length_b   4.07
_cell_length_c   5.45
_cell_angle_alpha   111.95
_cell_angle_beta   110.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   InPd
_chemical_formula_sum   'In2 Pd2'
_cell_volume   73.02
_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
  In  In0  2  0.26  0.3  0.26  1.0
  Pd  Pd1  2  0.03  0.99  0.03  1.0

In In Pd Pd