data_[Sr12Hg2Au4N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  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 [P2_1/c]
_cell_length_a [7.4811]
_cell_length_b [8.1866]
_cell_length_c [12.7247]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.1967]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sr6HgAu2N]
_chemical_formula_sum '[Sr12 Hg2 Au4 N2]'
_cell_volume [659.4751]
_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
[
  Sr  Sr0  4  0.0790  0.0454  0.7239  1.0
  Sr  Sr1  4  0.2080  0.7109  0.5691  1.0
  Sr  Sr2  4  0.3527  0.1557  0.5601  1.0
  Hg  Hg3  2  0.5000  0.0000  0.0000  1.0
  Au  Au4  4  0.3073  0.1071  0.2609  1.0
  N  N5  2  0.0000  0.0000  0.5000  1.0
]