data_[Sc3Ni3H24Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Ni  1.9100  1.3500  0.7400
  H  2.2000  0.2500  0.0000
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.6271]
_cell_length_b [5.6271]
_cell_length_c [12.9039]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [ScNi(H2Rh)4]
_chemical_formula_sum '[Sc3 Ni3 H24 Rh12]'
_cell_volume [353.8464]
_cell_formula_units_Z [3]
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
[
  Sc  Sc0  3  0.0000  0.0000  0.6089  1.0
  Ni  Ni1  3  0.0000  0.0000  0.0041  1.0
  H  H2  9  0.0258  0.5129  0.7475  1.0
  H  H3  9  0.2071  0.4142  0.5796  1.0
  H  H4  3  0.0000  0.0000  0.2443  1.0
  H  H5  3  0.0000  0.0000  0.7720  1.0
  Rh  Rh6  9  0.1684  0.3368  0.8346  1.0
  Rh  Rh7  3  0.0000  0.0000  0.3856  1.0
]