data_[In4H6Pd16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.3448]
_cell_length_b [5.9309]
_cell_length_c [4.7714]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.3267]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [In2H3Pd8]
_chemical_formula_sum '[In4 H6 Pd16]'
_cell_volume [358.4879]
_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  4  0.2464  0.5000  0.5182  1
  Pd  Pd1  8  0.0694  0.2422  0.3402  1
  H  H2  4  0.0000  0.3459  0.0000  1
  Pd  Pd3  4  0.1287  0.5000  0.9063  1
  Pd  Pd4  4  0.1377  0.0000  0.8869  1
  H  H5  2  0.0000  0.0000  0.5000  1
]