data_[Rh4O4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rh  2.2800  1.3500  0.7450
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P4_1]
_cell_length_a [5.4991]
_cell_length_b [5.4991]
_cell_length_c [9.4062]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [76]
_chemical_formula_structural [RhOF3]
_chemical_formula_sum '[Rh4 O4 F12]'
_cell_volume [284.4489]
_cell_formula_units_Z [4]
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
[
  Rh  Rh0  4  0.1317  0.3786  0.4934  1.0
  O  O1  4  0.1004  0.6474  0.5911  1.0
  F  F2  4  0.0362  0.8216  0.1398  1.0
  F  F3  4  0.1555  0.5920  0.8841  1.0
  F  F4  4  0.3160  0.5310  0.3329  1.0
]