data_[Rh12Se24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [6.9057]
_cell_length_b [6.9057]
_cell_length_c [18.8977]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [RhSe2]
_chemical_formula_sum '[Rh12 Se24]'
_cell_volume [780.4726]
_cell_formula_units_Z [12]
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
[
  Rh  Rh0  9  0.0328  0.5164  0.9981  1.0
  Rh  Rh1  3  0.0000  0.0000  0.5045  1.0
  Se  Se2  9  0.0075  0.5038  0.2548  1.0
  Se  Se3  9  0.1724  0.3448  0.0875  1.0
  Se  Se4  3  0.0000  0.0000  0.2423  1.0
  Se  Se5  3  0.0000  0.0000  0.7295  1.0
]