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 [4.9469]
_cell_length_b [10.2204]
_cell_length_c [6.6395]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.5186]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [In5Hg]
_chemical_formula_sum '[In10 Hg2]'
_cell_volume [330.0442]
_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  0.2381  0.0807  0.3786  1.0
  In  In1  4  0.2457  0.0802  0.8763  1.0
  In  In2  2  0.2210  0.7500  0.9765  1.0
  Hg  Hg3  2  0.2375  0.7500  0.4839  1.0
]