data_[Sc9Ni24Rh3]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [4.8427]
_cell_length_b [4.8427]
_cell_length_c [23.7342]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Sc3Ni8Rh]
_chemical_formula_sum '[Sc9 Ni24 Rh3]'
_cell_volume [482.0465]
_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  0.0102  1.0
  Sc  Sc1  3  0.0000  0.0000  0.4922  1.0
  Sc  Sc2  3  0.0000  0.0000  0.6231  1.0
  Ni  Ni3  9  0.0005  0.5003  0.5622  1.0
  Ni  Ni4  9  0.1683  0.3366  0.3950  1.0
  Ni  Ni5  3  0.0000  0.0000  0.3120  1.0
  Ni  Ni6  3  0.0000  0.0000  0.8123  1.0
  Rh  Rh7  3  0.0000  0.0000  0.1285  1.0
]