data_[In2Pd13]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.2689]
_cell_length_b [6.3484]
_cell_length_c [6.9749]
_cell_angle_alpha [68.0698]
_cell_angle_beta [69.3500]
_cell_angle_gamma [84.0618]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [In2Pd13]
_chemical_formula_sum '[In2 Pd13]'
_cell_volume [240.8243]
_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
[
  In  In0  2  0.1448  0.4654  0.7819  1.0
  Pd  Pd1  2  0.0694  0.7406  0.3980  1.0
  Pd  Pd2  2  0.1963  0.2053  0.1946  1.0
  Pd  Pd3  2  0.2683  0.9371  0.5986  1.0
  Pd  Pd4  2  0.3309  0.6679  0.9997  1.0
  Pd  Pd5  2  0.3981  0.3991  0.3934  1.0
  Pd  Pd6  2  0.4689  0.1298  0.7993  1.0
  Pd  Pd7  1  0.0000  0.0000  0.0000  1.0
]