data_[In2Ag2Hg2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.2112]
_cell_length_b [5.2079]
_cell_length_c [7.1854]
_cell_angle_alpha [69.1849]
_cell_angle_beta [77.6451]
_cell_angle_gamma [72.0709]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [InAgHg]
_chemical_formula_sum '[In2 Ag2 Hg2]'
_cell_volume [139.1766]
_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  2  0.1816  0.2606  0.3919  1.0
  Ag  Ag1  2  0.1590  0.7453  0.9258  1.0
  Hg  Hg2  2  0.4746  0.2443  0.7691  1.0
]