data_[Fe4H8Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Fe  1.8300  1.4000  0.8525
  H  2.2000  0.2500  0.0000
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.2252]
_cell_length_b [2.7926]
_cell_length_c [4.8216]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.6499]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [FeH2Rh]
_chemical_formula_sum '[Fe4 H8 Rh4]'
_cell_volume [123.0528]
_cell_formula_units_Z [4]
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
[
  Fe  Fe0  4  0.1323  0.5000  0.8023  1.0
  H  H1  4  0.2483  0.0000  0.7517  1.0
  H  H2  2  0.0000  0.0000  0.5000  1.0
  H  H3  2  0.0000  0.5000  0.0000  1.0
  Rh  Rh4  4  0.1185  0.0000  0.2947  1.0
]