data_[Al2Ag6Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Ag  1.9300  1.6000  1.0867
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.6745]
_cell_length_b [6.6687]
_cell_length_c [11.9516]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.0882]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Al(AgCl2)3]
_chemical_formula_sum '[Al2 Ag6 Cl12]'
_cell_volume [450.7013]
_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
[
  Al  Al0  2  0.0000  0.0000  0.0000  1.0
  Ag  Ag1  4  0.2593  0.5444  0.2599  1.0
  Ag  Ag2  2  0.5000  0.0000  0.5000  1.0
  Cl  Cl3  4  0.0696  0.7059  0.9204  1.0
  Cl  Cl4  4  0.2502  0.1694  0.9478  1.0
  Cl  Cl5  4  0.3269  0.5797  0.7148  1.0
]