data_[K1H6Au2N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  H  2.2000  0.2500  0.0000
  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 [5.2881]
_cell_length_b [6.4264]
_cell_length_c [6.8272]
_cell_angle_alpha [116.3239]
_cell_angle_beta [101.9317]
_cell_angle_gamma [102.1151]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KH6(AuN)2]
_chemical_formula_sum '[K1 H6 Au2 N2]'
_cell_volume [191.0492]
_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
[
  K  K0  1  0.5000  0.0000  0.5000  1.0
  H  H1  2  0.1590  0.0141  0.8351  1.0
  H  H2  2  0.2125  0.2922  0.8688  1.0
  H  H3  2  0.4164  0.2541  0.0556  1.0
  Au  Au4  2  0.2410  0.4754  0.4917  1.0
  N  N5  2  0.3093  0.1741  0.8811  1.0
]