data_[Li6Hg2Au1N1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.8218]
_cell_length_b [5.8953]
_cell_length_c [5.9125]
_cell_angle_alpha [70.5060]
_cell_angle_beta [70.3210]
_cell_angle_gamma [69.5007]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li6Hg2AuN]
_chemical_formula_sum '[Li6 Hg2 Au1 N1]'
_cell_volume [173.5364]
_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
[
  Li  Li0  2  0.1587  0.8339  0.2690  1.0
  Li  Li1  2  0.1849  0.7263  0.8490  1.0
  Li  Li2  2  0.2681  0.1587  0.8222  1.0
  Hg  Hg3  2  0.2669  0.2856  0.2855  1.0
  Au  Au4  1  0.5000  0.5000  0.5000  1.0
  N  N5  1  0.0000  0.0000  0.0000  1.0
]