data_[In10Hg2]
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
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.4967]
_cell_length_b [9.8003]
_cell_length_c [6.1681]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.6414]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [In5Hg]
_chemical_formula_sum '[In10 Hg2]'
_cell_volume [327.5780]
_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  4  0.2442  0.5809  0.3807  1
  In  In1  4  0.2512  0.5832  0.8811  1
  In  In2  2  0.2314  0.2500  0.9854  1
  Hg  Hg3  2  0.2463  0.2500  0.4885  1
]