data_[Sr12As4Au2N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  As  2.1800  1.1500  0.6600
  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 [7.3217]
_cell_length_b [8.0834]
_cell_length_c [12.4675]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.0862]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Sr6As2AuN]
_chemical_formula_sum '[Sr12 As4 Au2 N2]'
_cell_volume [625.1620]
_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  0.0804  0.0518  0.7272  1.0
  Sr  Sr1  4  0.2215  0.7114  0.5717  1.0
  Sr  Sr2  4  0.3579  0.1643  0.5623  1.0
  As  As3  4  0.3060  0.1021  0.2598  1.0
  Au  Au4  2  0.5000  0.0000  0.0000  1.0
  N  N5  2  0.0000  0.0000  0.5000  1.0
]