data_[Ag4Sb12I4F96]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Sb  2.0500  1.4500  0.8300
  I  2.6600  1.4000  1.2733
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.6800]
_cell_length_b [18.2909]
_cell_length_c [9.8290]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.0204]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [AgSb3IF24]
_chemical_formula_sum '[Ag4 Sb12 I4 F96]'
_cell_volume [1917.4024]
_cell_formula_units_Z [4]
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
[
  Ag  Ag0  4  0.0000  0.0000  0.0000  1
  Sb  Sb1  8  0.2417  0.4163  0.7515  1
  Sb  Sb2  4  0.0000  0.1714  0.7500  1
  I  I3  4  0.0000  0.3334  0.2500  1
  F  F4  8  0.0649  0.0921  0.6351  1
  F  F5  8  0.0657  0.2402  0.6284  1
  F  F6  8  0.0665  0.4039  0.1438  1
  F  F7  8  0.0671  0.2634  0.1439  1
  F  F8  8  0.1009  0.0773  0.1255  1
  F  F9  8  0.1014  0.4131  0.6254  1
  F  F10  8  0.1423  0.3331  0.3614  1
  F  F11  8  0.1555  0.1641  0.8529  1
  F  F12  8  0.1687  0.1575  0.3403  1
  F  F13  8  0.1772  0.4952  0.8532  1
  F  F14  8  0.1781  0.0112  0.3591  1
  F  F15  8  0.1811  0.3462  0.8742  1
]