data_[Tl4H16Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  H  2.2000  0.2500  0.0000
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [5.2969]
_cell_length_b [9.0366]
_cell_length_c [5.5796]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.2054]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [TlH4Rh]
_chemical_formula_sum '[Tl4 H16 Rh4]'
_cell_volume [261.0372]
_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
[
  Tl  Tl0  4  0.0000  0.3512  0.2500  1
  H  H1  8  0.0344  0.1034  0.9581  1
  H  H2  8  0.1807  0.4303  0.6796  1
  Rh  Rh3  4  0.0000  0.0455  0.2500  1
]