data_[Sc6Si12Rh18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Si  1.9000  1.1000  0.5400
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.7659]
_cell_length_b [3.9097]
_cell_length_c [9.5106]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.8184]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ScSi2Rh3]
_chemical_formula_sum '[Sc6 Si12 Rh18]'
_cell_volume [554.8929]
_cell_formula_units_Z [6]
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  0.1605  0.0000  0.6979  1
  Sc  Sc1  2  0.0000  0.0000  0.0000  1
  Si  Si2  4  0.0399  0.5000  0.7826  1
  Si  Si3  4  0.1375  0.5000  0.4482  1
  Si  Si4  4  0.1926  0.0000  0.1270  1
  Rh  Rh5  4  0.0356  0.0000  0.3243  1
  Rh  Rh6  4  0.1159  0.5000  0.1904  1
  Rh  Rh7  4  0.1802  0.5000  0.9565  1
  Rh  Rh8  4  0.2176  0.0000  0.3903  1
  Rh  Rh9  2  0.0000  0.5000  0.5000  1
]