data_In2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   20.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2Pd
_chemical_formula_sum   'In16 Pd8'
_cell_volume   566.67
_cell_formula_units_Z   8
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  0.82  0.63  0.58  1.0
  In  In1  1  0.0  0.26  0.96  1.0
  In  In2  1  0.0  0.26  0.85  1.0
  In  In3  1  0.82  0.63  0.69  1.0
  In  In4  1  0.59  0.44  0.0  1.0
  In  In5  1  0.41  0.44  0.0  1.0
  In  In6  1  0.82  0.0  0.0  1.0
  In  In7  1  0.59  0.44  0.27  1.0
  In  In8  1  0.41  0.44  0.27  1.0
  In  In9  1  0.82  0.0  0.27  1.0
  In  In10  1  0.38  0.8  0.13  1.0
  In  In11  1  0.26  0.8  0.13  1.0
  In  In12  1  0.82  0.29  0.13  1.0
  In  In13  1  0.44  0.09  0.4  1.0
  In  In14  1  0.56  0.09  0.4  1.0
  In  In15  1  0.0  0.6  0.4  1.0
  Pd  Pd16  1  0.0  0.0  0.39  1.0
  Pd  Pd17  1  0.0  0.0  0.15  1.0
  Pd  Pd18  1  0.0  0.0  0.65  1.0
  Pd  Pd19  1  0.0  0.0  0.88  1.0
  Pd  Pd20  1  0.82  0.63  0.78  1.0
  Pd  Pd21  1  0.0  0.26  0.75  1.0
  Pd  Pd22  1  0.0  0.26  0.51  1.0
  Pd  Pd23  1  0.82  0.63  0.02  1.0

data_In2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   20.53
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In2Pd
_chemical_formula_sum   'In16 Pd8'
_cell_volume   566.67
_cell_formula_units_Z   8
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  0.0  0.6  0.4  1.0
  In  In1  1  0.0  0.26  0.85  1.0
  In  In2  1  0.0  0.26  0.96  1.0
  In  In3  1  0.26  0.8  0.13  1.0
  In  In4  1  0.38  0.8  0.13  1.0
  In  In5  1  0.41  0.44  0.0  1.0
  In  In6  1  0.41  0.44  0.27  1.0
  In  In7  1  0.44  0.09  0.4  1.0
  In  In8  1  0.56  0.09  0.4  1.0
  In  In9  1  0.59  0.44  0.0  1.0
  In  In10  1  0.59  0.44  0.27  1.0
  In  In11  1  0.82  0.0  0.0  1.0
  In  In12  1  0.82  0.0  0.27  1.0
  In  In13  1  0.82  0.29  0.13  1.0
  In  In14  1  0.82  0.63  0.58  1.0
  In  In15  1  0.82  0.63  0.69  1.0
  Pd  Pd16  1  0.0  0.0  0.15  1.0
  Pd  Pd17  1  0.0  0.0  0.39  1.0
  Pd  Pd18  1  0.0  0.0  0.65  1.0
  Pd  Pd19  1  0.0  0.0  0.88  1.0
  Pd  Pd20  1  0.0  0.26  0.51  1.0
  Pd  Pd21  1  0.0  0.26  0.75  1.0
  Pd  Pd22  1  0.82  0.63  0.02  1.0
  Pd  Pd23  1  0.82  0.63  0.78  1.0

In In In In In In In In In In In In In In In In Pd Pd Pd Pd Pd Pd Pd Pd