data_[Rb4Rh4Se12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.2489]
_cell_length_b [6.6698]
_cell_length_c [6.6815]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.3807]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [RbRhSe3]
_chemical_formula_sum '[Rb4 Rh4 Se12]'
_cell_volume [626.5050]
_cell_formula_units_Z [4]
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
[
  Rb  Rb0  4  0.1901  0.5000  0.2078  1
  Rh  Rh1  4  0.0000  0.2068  0.5000  1
  Se  Se2  4  0.0513  0.0000  0.2470  1
  Se  Se3  4  0.0767  0.5000  0.6762  1
  Se  Se4  4  0.2440  0.0000  0.2833  1
]