data_[Sn2H2Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sn  1.9600  1.4500  0.8300
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [5.7568]
_cell_length_b [4.3979]
_cell_length_c [5.8685]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.7186]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [SnHPd3]
_chemical_formula_sum '[Sn2 H2 Pd6]'
_cell_volume [142.2990]
_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
[
  Sn  Sn0  2  0.3474  0.8758  0.7040  1.0
  H  H1  2  0.0973  0.6151  0.1389  1.0
  Pd  Pd2  2  0.1453  0.3769  0.4105  1.0
  Pd  Pd3  2  0.1646  0.3760  0.9036  1.0
  Pd  Pd4  2  0.3711  0.8763  0.2215  1.0
]