data_[La3Nd3Ga2Hg1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Nd  1.1400  1.8500  1.2765
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [P-62m]
_cell_length_a [8.3836]
_cell_length_b [8.3836]
_cell_length_c [4.4809]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [189]
_chemical_formula_structural [La3Nd3Ga2Hg]
_chemical_formula_sum '[La3 Nd3 Ga2 Hg1]'
_cell_volume [272.7488]
_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
[
  La  La0  3  0.0000  0.2823  0.5000  1.0
  Nd  Nd1  3  0.0000  0.5946  0.0000  1.0
  Ga  Ga2  2  0.3333  0.6667  0.5000  1.0
  Hg  Hg3  1  0.0000  0.0000  0.0000  1.0
]