data_[Ba4Ag2Hg12Sb2]
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
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Pmmn]
_cell_length_a [6.0970]
_cell_length_b [9.5957]
_cell_length_c [10.8293]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [59]
_chemical_formula_structural [Ba2AgHg6Sb]
_chemical_formula_sum '[Ba4 Ag2 Hg12 Sb2]'
_cell_volume [633.5732]
_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
[
  Ba  Ba0  4  0.0000  0.2342  0.7381  1
  Ag  Ag1  2  0.0000  0.0000  0.2524  1
  Hg  Hg2  4  0.0000  0.2580  0.1011  1
  Hg  Hg3  4  0.2478  0.5000  0.9831  1
  Hg  Hg4  4  0.2493  0.5000  0.5288  1
  Sb  Sb5  2  0.0000  0.5000  0.2865  1
]