data_[La4Ga2Hg2Ir2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.5895]
_cell_length_b [4.5455]
_cell_length_c [7.9836]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.0169]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [La2GaHgIr]
_chemical_formula_sum '[La4 Ga2 Hg2 Ir2]'
_cell_volume [258.7759]
_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
[
  La  La0  2  0.1346  0.2500  0.3423  1.0
  La  La1  2  0.2771  0.2500  0.9516  1.0
  Ga  Ga2  2  0.4506  0.7500  0.3253  1.0
  Hg  Hg3  2  0.3179  0.7500  0.6591  1.0
  Ir  Ir4  2  0.1260  0.7500  0.0953  1.0
]