data_[Sc8As8Rh16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  As  2.1800  1.1500  0.6600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [13.6038]
_cell_length_b [7.1171]
_cell_length_c [5.3816]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [ScAsRh2]
_chemical_formula_sum '[Sc8 As8 Rh16]'
_cell_volume [521.0507]
_cell_formula_units_Z [8]
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  4  0.1176  0.2500  0.7024  1
  Sc  Sc1  4  0.1268  0.7500  0.5195  1
  As  As2  4  0.0654  0.7500  0.0290  1
  As  As3  4  0.1834  0.2500  0.2105  1
  Rh  Rh4  8  0.0348  0.0486  0.2591  1
  Rh  Rh5  8  0.2156  0.5502  0.9940  1
]