data_[In1Hg2Pb1]
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 [Pm]
_cell_length_a [3.4204]
_cell_length_b [5.3677]
_cell_length_c [6.1923]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0106]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [InHg2Pb]
_chemical_formula_sum '[In1 Hg2 Pb1]'
_cell_volume [113.6876]
_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  1  0.7755  0.0000  0.5224  1.0
  Hg  Hg1  1  0.5763  0.5000  0.2266  1.0
  Hg  Hg2  1  0.8883  0.0000  0.0238  1.0
  Pb  Pb3  1  0.2599  0.5000  0.7272  1.0
]