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 [11.7092]
_cell_length_b [11.9155]
_cell_length_c [7.6099]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.7524]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ga2Ag2I7]
_chemical_formula_sum '[Ga4 Ag4 I14]'
_cell_volume [948.0977]
_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  0.1980  0.0000  0.3958  1
  Ag  Ag1  4  0.0000  0.3137  0.0000  1
  I  I2  8  0.2201  0.1769  0.1974  1
  I  I3  4  0.0674  0.5000  0.2856  1
  I  I4  2  0.0000  0.0000  0.5000  1
]