data_[In2Sn2Hg4Pb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
  Hg  2.0000  1.5000  1.2450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.2473]
_cell_length_b [9.7554]
_cell_length_c [6.5573]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [InSn(HgPb)2]
_chemical_formula_sum '[In2 Sn2 Hg4 Pb4]'
_cell_volume [335.6674]
_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
[
  In  In0  2  0.0000  0.4615  0.4068  1
  Sn  Sn1  2  0.5000  0.3182  0.1549  1
  Hg  Hg2  2  0.0000  0.1431  0.3595  1
  Hg  Hg3  2  0.5000  0.3618  0.6543  1
  Pb  Pb4  2  0.0000  0.2001  0.8696  1
  Pb  Pb5  2  0.5000  0.0265  0.6005  1
]