data_[In1Ga1Hg1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [3.5696]
_cell_length_b [3.8617]
_cell_length_c [5.7657]
_cell_angle_alpha [75.5478]
_cell_angle_beta [74.8400]
_cell_angle_gamma [81.0599]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [InGaHg]
_chemical_formula_sum '[In1 Ga1 Hg1]'
_cell_volume [73.9392]
_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  0.4607  0.9034  0.2136  1.0
  Ga  Ga1  1  0.1207  0.5663  0.8818  1.0
  Hg  Hg2  1  0.7881  0.2284  0.5763  1.0
]