data_[Li2Ga6Hg2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.2773]
_cell_length_b [6.6625]
_cell_length_c [5.9413]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.9602]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiGa3Hg]
_chemical_formula_sum '[Li2 Ga6 Hg2]'
_cell_volume [201.8197]
_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
[
  Li  Li0  2  0.1168  0.2500  0.9173  1
  Ga  Ga1  4  0.1915  0.0526  0.4013  1
  Ga  Ga2  2  0.4323  0.7500  0.2723  1
  Hg  Hg3  2  0.3452  0.7500  0.8098  1
]