data_[Ba8Ag1Hg2Rh1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.8379]
_cell_length_b [9.6363]
_cell_length_c [8.1437]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4358]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ba8AgHg2Rh]
_chemical_formula_sum '[Ba8 Ag1 Hg2 Rh1]'
_cell_volume [615.0583]
_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
[
  Ba  Ba0  4  0.2301  0.2307  0.1569  1.0
  Ba  Ba1  2  0.2286  0.0000  0.6895  1.0
  Ba  Ba2  2  0.2548  0.5000  0.6659  1.0
  Ag  Ag3  1  0.0000  0.5000  0.0000  1.0
  Hg  Hg4  2  0.5000  0.2374  0.5000  1.0
  Rh  Rh5  1  0.0000  0.0000  0.0000  1.0
]