data_[Cu2Rh2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  Rh  2.2800  1.3500  0.7450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.1214]
_cell_length_b [6.1668]
_cell_length_c [8.7710]
_cell_angle_alpha [104.5017]
_cell_angle_beta [104.4788]
_cell_angle_gamma [106.3248]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [CuRhCl4]
_chemical_formula_sum '[Cu2 Rh2 Cl8]'
_cell_volume [288.7582]
_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
[
  Cu  Cu0  2  0.3745  0.1318  0.2578  1.0
  Rh  Rh1  2  0.1953  0.4452  0.8897  1.0
  Cl  Cl2  2  0.0619  0.3270  0.0996  1.0
  Cl  Cl3  2  0.1230  0.8903  0.3277  1.0
  Cl  Cl4  2  0.2972  0.5650  0.6724  1.0
  Cl  Cl5  2  0.4627  0.2284  0.9008  1.0
]