data_[Ba1Ag2Sn1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.5141]
_cell_length_b [7.0598]
_cell_length_c [8.8393]
_cell_angle_alpha [70.0268]
_cell_angle_beta [89.3487]
_cell_angle_gamma [81.1229]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaAg2SnCl8]
_chemical_formula_sum '[Ba1 Ag2 Sn1 Cl8]'
_cell_volume [377.1003]
_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
[
  Ba  Ba0  1  0.0000  0.0000  0.5000  1.0
  Ag  Ag1  2  0.4967  0.3314  0.7044  1.0
  Sn  Sn2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.0907  0.2473  0.7320  1.0
  Cl  Cl4  2  0.1461  0.1942  0.1456  1.0
  Cl  Cl5  2  0.3383  0.7831  0.0155  1.0
  Cl  Cl6  2  0.4324  0.7348  0.5611  1.0
]