data_[Ni2H10Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  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 [9.1549]
_cell_length_b [4.0215]
_cell_length_c [5.7194]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6414]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ni(HPd)5]
_chemical_formula_sum '[Ni2 H10 Pd10]'
_cell_volume [199.5191]
_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
[
  Ni  Ni0  2  0.0000  0.0000  0.0000  1
  H  H1  4  0.1448  0.0000  0.3076  1
  H  H2  4  0.1468  0.0000  0.8444  1
  Pd  Pd3  4  0.1622  0.5000  0.3276  1
  Pd  Pd4  4  0.1662  0.5000  0.8348  1
  Pd  Pd5  2  0.0000  0.0000  0.5000  1
  H  H6  2  0.0000  0.5000  0.0000  1
]