data_[In2Hg1Rh1]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.9408]
_cell_length_b [3.3271]
_cell_length_c [5.3828]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.7841]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [In2HgRh]
_chemical_formula_sum '[In2 Hg1 Rh1]'
_cell_volume [81.5801]
_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  1  0.0000  0.0000  0.0000  1
  In  In1  1  0.0000  0.5000  0.5000  1
  Hg  Hg2  1  0.5000  0.0000  0.5000  1
  Rh  Rh3  1  0.5000  0.5000  0.0000  1
]