data_[Cs4Sn2Hg2Sb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Sn  1.9600  1.4500  0.8300
  Hg  2.0000  1.5000  1.2450
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [11.0044]
_cell_length_b [4.6309]
_cell_length_c [11.3354]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.9146]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Cs2SnHgSb]
_chemical_formula_sum '[Cs4 Sn2 Hg2 Sb2]'
_cell_volume [519.5719]
_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
[
  Cs  Cs0  2  0.1240  0.7500  0.3987  1.0
  Cs  Cs1  2  0.3903  0.2500  0.1264  1.0
  Sn  Sn2  2  0.2168  0.7500  0.8189  1.0
  Hg  Hg3  2  0.0031  0.2500  0.0884  1.0
  Sb  Sb4  2  0.2828  0.2500  0.7036  1.0
]