data_[Ba2Ga2Hg4Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.8592]
_cell_length_b [5.1637]
_cell_length_c [11.8084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [BaGaHg2Sb]
_chemical_formula_sum '[Ba2 Ga2 Hg4 Sb2]'
_cell_volume [296.2930]
_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  2  0.0000  0.0000  0.5610  1.0
  Ga  Ga1  2  0.0000  0.5000  0.3048  1.0
  Hg  Hg2  2  0.0000  0.0000  0.9267  1.0
  Hg  Hg3  2  0.0000  0.5000  0.8238  1.0
  Sb  Sb4  2  0.0000  0.0000  0.1716  1.0
]