data_[Cs2Cr2Rh2Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cr  1.6600  1.4000  0.9400
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [9.0448]
_cell_length_b [3.8050]
_cell_length_c [9.9622]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.3658]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [CsCrRhSe3]
_chemical_formula_sum '[Cs2 Cr2 Rh2 Se6]'
_cell_volume [309.8055]
_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
[
  Cs  Cs0  2  0.0177  0.7500  0.2620  1.0
  Cr  Cr1  2  0.4720  0.7500  0.1625  1.0
  Rh  Rh2  2  0.4831  0.2500  0.3939  1.0
  Se  Se3  2  0.2724  0.2500  0.1364  1.0
  Se  Se4  2  0.3354  0.2500  0.5707  1.0
  Se  Se5  2  0.3567  0.7500  0.8751  1.0
]