data_[Hg2B10Rh16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  B  2.0400  0.8500  0.4100
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.9832]
_cell_length_b [3.1099]
_cell_length_c [7.5774]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.9556]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HgB5Rh8]
_chemical_formula_sum '[Hg2 B10 Rh16]'
_cell_volume [345.4180]
_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
[
  Hg  Hg0  2  0.0000  0.5000  0.5000  1
  B  B1  4  0.1583  0.5000  0.9859  1
  B  B2  4  0.2004  0.5000  0.3356  1
  B  B3  2  0.0000  0.0000  0.0000  1
  Rh  Rh4  4  0.0664  0.5000  0.1678  1
  Rh  Rh5  4  0.0971  0.0000  0.8238  1
  Rh  Rh6  4  0.1675  0.0000  0.4972  1
  Rh  Rh7  4  0.2361  0.0000  0.1637  1
]