data_[Sr12H2Au4N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  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 [P2_1/c]
_cell_length_a [7.2272]
_cell_length_b [7.7875]
_cell_length_c [12.6487]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.5757]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sr6HAu2N]
_chemical_formula_sum '[Sr12 H2 Au4 N2]'
_cell_volume [586.1539]
_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  0.1470  0.5212  0.2409  1.0
  Sr  Sr1  4  0.2271  0.2092  0.0470  1.0
  Sr  Sr2  4  0.3424  0.6806  0.0471  1.0
  H  H3  2  0.5000  0.0000  0.0000  1.0
  Au  Au4  4  0.2832  0.5838  0.7511  1.0
  N  N5  2  0.0000  0.0000  0.5000  1.0
]