data_[Al2Rh2F12]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [4.8476]
_cell_length_b [8.9513]
_cell_length_c [4.8399]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.2029]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AlRhF6]
_chemical_formula_sum '[Al2 Rh2 F12]'
_cell_volume [203.5957]
_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  0.0000  0.5000  0.5000  1.0
  Rh  Rh1  2  0.0000  0.0000  0.0000  1.0
  F  F2  8  0.2294  0.3628  0.7329  1.0
  F  F3  4  0.2405  0.5000  0.2646  1.0
]