data_[In2Hg6Pb5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Hg  2.0000  1.5000  1.2450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.9343]
_cell_length_b [6.6440]
_cell_length_c [9.5346]
_cell_angle_alpha [93.5560]
_cell_angle_beta [90.6694]
_cell_angle_gamma [90.5100]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [In2Hg6Pb5]
_chemical_formula_sum '[In2 Hg6 Pb5]'
_cell_volume [375.1576]
_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
[
  In  In0  2  0.3761  0.7514  0.1948  1
  Hg  Hg1  2  0.2164  0.4426  0.9374  1
  Hg  Hg2  2  0.4278  0.7328  0.5159  1
  Hg  Hg3  2  0.4757  0.8119  0.8400  1
  Pb  Pb4  2  0.0685  0.3575  0.3307  1
  Pb  Pb5  2  0.1090  0.1372  0.6467  1
  Pb  Pb6  1  0.0000  0.0000  0.0000  1
]