data_[Tl2Rh1I1O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Rh  2.2800  1.3500  0.7450
  I  2.6600  1.4000  1.2733
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.9970]
_cell_length_b [6.3682]
_cell_length_c [5.2066]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.5353]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Tl2RhIO8]
_chemical_formula_sum '[Tl2 Rh1 I1 O8]'
_cell_volume [165.1645]
_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
[
  Tl  Tl0  2  0.5000  0.2577  0.5000  1
  Rh  Rh1  1  0.0000  0.5000  0.0000  1
  I  I2  1  0.0000  0.0000  0.0000  1
  O  O3  4  0.2019  0.2399  0.8664  1
  O  O4  2  0.2283  0.5000  0.3315  1
  O  O5  2  0.2475  0.0000  0.3123  1
]