data_[In12Ga4Hg2]
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 [C2/m]
_cell_length_a [12.3518]
_cell_length_b [3.3395]
_cell_length_c [11.6607]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.8261]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [In6Ga2Hg]
_chemical_formula_sum '[In12 Ga4 Hg2]'
_cell_volume [470.7761]
_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  0.0334  0.0000  0.7437  1.0
  In  In1  4  0.1319  0.5000  0.5415  1.0
  In  In2  4  0.2432  0.0000  0.1201  1.0
  Ga  Ga3  4  0.1783  0.5000  0.3076  1.0
  Hg  Hg4  2  0.0000  0.0000  0.0000  1.0
]