data_[Sc2Ru2Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Ru  2.2000  1.3000  0.6610
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.2306]
_cell_length_b [2.8551]
_cell_length_c [4.7226]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.1452]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [ScRuRh2]
_chemical_formula_sum '[Sc2 Ru2 Rh4]'
_cell_volume [122.1149]
_cell_formula_units_Z [2]
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  2  0.0000  0.0000  0.5000  1
  Ru  Ru1  2  0.0000  0.5000  0.0000  1
  Rh  Rh2  4  0.2453  0.0000  0.2378  1
]