data_[Cs4Ge1Rh1Se6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ge  2.0100  1.2500  0.7700
  Rh  2.2800  1.3500  0.7450
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.4288]
_cell_length_b [8.0410]
_cell_length_c [9.8563]
_cell_angle_alpha [70.7105]
_cell_angle_beta [68.3089]
_cell_angle_gamma [63.0941]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Cs4GeRhSe6]
_chemical_formula_sum '[Cs4 Ge1 Rh1 Se6]'
_cell_volume [478.3086]
_cell_formula_units_Z [1]
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  1  0.1805  0.9579  0.6703  1
  Cs  Cs1  1  0.4144  0.3065  0.8677  1
  Cs  Cs2  1  0.5904  0.6850  0.1307  1
  Cs  Cs3  1  0.8218  0.0475  0.3196  1
  Ge  Ge4  1  0.8745  0.5564  0.6919  1
  Rh  Rh5  1  0.1142  0.4488  0.3265  1
  Se  Se6  1  0.1197  0.6602  0.0957  1
  Se  Se7  1  0.2170  0.5091  0.5040  1
  Se  Se8  1  0.3027  0.1473  0.2608  1
  Se  Se9  1  0.6940  0.8706  0.7266  1
  Se  Se10  1  0.7786  0.4948  0.5022  1
  Se  Se11  1  0.8921  0.3158  0.9041  1
]