data_[Al2Rh2Se4Cl4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [13.1988]
_cell_length_b [3.6296]
_cell_length_c [7.2080]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.9902]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [AlRh(SeCl)2]
_chemical_formula_sum '[Al2 Rh2 Se4 Cl4]'
_cell_volume [289.6342]
_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
[
  Al  Al0  2  0.3818  0.0000  0.2303  1
  Rh  Rh1  2  0.1284  0.5000  0.7872  1
  Se  Se2  2  0.1480  0.0000  0.0303  1
  Se  Se3  2  0.3468  0.5000  0.9787  1
  Cl  Cl4  2  0.0913  0.5000  0.4120  1
  Cl  Cl5  2  0.4038  0.0000  0.5616  1
]