data_[Mo4H4Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mo  2.1600  1.4500  0.7750
  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 [9.4137]
_cell_length_b [2.7885]
_cell_length_c [4.9645]
_cell_angle_alpha [90.0000]
_cell_angle_beta [98.5765]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [MoHRh]
_chemical_formula_sum '[Mo4 H4 Rh4]'
_cell_volume [128.8625]
_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
[
  Mo  Mo0  4  0.1166  0.0000  0.3624  1.0
  H  H1  4  0.2428  0.0000  0.7325  1.0
  Rh  Rh2  4  0.1158  0.5000  0.8668  1.0
]