data_[Rb1Li1Hg2Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Li  0.9800  1.4500  0.9000
  Hg  2.0000  1.5000  1.2450
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [7.1022]
_cell_length_b [7.1654]
_cell_length_c [8.4526]
_cell_angle_alpha [103.4714]
_cell_angle_beta [95.3058]
_cell_angle_gamma [110.9487]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [RbLi(HgBr3)2]
_chemical_formula_sum '[Rb1 Li1 Hg2 Br6]'
_cell_volume [383.2804]
_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
[
  Rb  Rb0  1  0.8069  0.5582  0.4013  1.0
  Li  Li1  1  0.4399  0.6994  0.9856  1.0
  Hg  Hg2  1  0.0122  0.1004  0.9780  1.0
  Hg  Hg3  1  0.4513  0.1079  0.6603  1.0
  Br  Br4  1  0.2178  0.8501  0.8295  1.0
  Br  Br5  1  0.2466  0.9525  0.3599  1.0
  Br  Br6  1  0.3108  0.4533  0.1569  1.0
  Br  Br7  1  0.5993  0.5184  0.7708  1.0
  Br  Br8  1  0.7443  0.0110  0.1716  1.0
  Br  Br9  1  0.8326  0.0720  0.6708  1.0
]