data_[U2Fe10H22]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  U  1.3800  1.7500  0.9913
  Fe  1.8300  1.4000  0.8525
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8725]
_cell_length_b [7.6536]
_cell_length_c [4.5702]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.7568]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [UFe5H11]
_chemical_formula_sum '[U2 Fe10 H22]'
_cell_volume [239.0568]
_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
[
  U  U0  2  0.0000  0.0000  0.0000  1
  Fe  Fe1  8  0.1972  0.1750  0.6976  1
  Fe  Fe2  2  0.0000  0.5000  0.0000  1
  H  H3  8  0.0958  0.2571  0.3055  1
  H  H4  8  0.1973  0.3695  0.8886  1
  H  H5  4  0.2263  0.5000  0.4330  1
  H  H6  2  0.0000  0.0000  0.5000  1
]