data_[Mn2H12Pd10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  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 [5.1345]
_cell_length_b [8.7768]
_cell_length_c [5.0681]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.9428]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [MnH6Pd5]
_chemical_formula_sum '[Mn2 H12 Pd10]'
_cell_volume [213.3045]
_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
[
  Mn  Mn0  2  0.0000  0.0000  0.0000  1.0
  H  H1  8  0.2139  0.3190  0.7577  1.0
  Pd  Pd2  4  0.0000  0.1609  0.5000  1.0
  Pd  Pd3  4  0.0000  0.3310  0.0000  1.0
  H  H4  4  0.2499  0.0000  0.7080  1.0
  Pd  Pd5  2  0.0000  0.5000  0.5000  1.0
]