data_[In10Hg12Sb2]
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
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.9412]
_cell_length_b [11.0814]
_cell_length_c [6.7719]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.0668]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [In5Hg6Sb]
_chemical_formula_sum '[In10 Hg12 Sb2]'
_cell_volume [653.5997]
_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  0.0000  0.1586  0.5000  1
  In  In1  4  0.0000  0.3213  0.0000  1
  In  In2  2  0.0000  0.5000  0.5000  1
  Hg  Hg3  8  0.2451  0.3344  0.7453  1
  Hg  Hg4  4  0.2388  0.5000  0.2345  1
  Sb  Sb5  2  0.0000  0.0000  0.0000  1
]