data_[In2Hg7Pb3]
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 [P2/m]
_cell_length_a [4.6234]
_cell_length_b [4.7965]
_cell_length_c [15.8950]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.9278]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [In2Hg7Pb3]
_chemical_formula_sum '[In2 Hg7 Pb3]'
_cell_volume [349.9189]
_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  0.3729  0.5000  0.7223  1.0
  Hg  Hg1  2  0.0745  0.5000  0.1538  1.0
  Hg  Hg2  2  0.1934  0.5000  0.4131  1.0
  Hg  Hg3  2  0.4186  0.0000  0.8413  1.0
  Hg  Hg4  1  0.0000  0.0000  0.0000  1.0
  Pb  Pb5  2  0.2883  0.0000  0.5756  1.0
  Pb  Pb6  1  0.5000  0.5000  0.0000  1.0
]