data_[Ga4Ag4I14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.7191]
_cell_length_b [11.9260]
_cell_length_c [7.6280]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.7870]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ga2Ag2I7]
_chemical_formula_sum '[Ga4 Ag4 I14]'
_cell_volume [951.6943]
_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
[
  Ga  Ga0  4  0.1982  0.0000  0.3956  1.0
  Ag  Ag1  4  0.0000  0.3136  0.0000  1.0
  I  I2  8  0.2199  0.1768  0.1976  1.0
  I  I3  4  0.0678  0.5000  0.2855  1.0
  I  I4  2  0.0000  0.0000  0.5000  1.0
]