data_[Ga4I8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.1818]
_cell_length_b [9.8719]
_cell_length_c [7.4131]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.1867]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [GaI2]
_chemical_formula_sum '[Ga4 I8]'
_cell_volume [586.6242]
_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
[
  Ga  Ga0  2  0.2663  0.0000  0.5631  1.0
  Ga  Ga1  2  0.4054  0.0000  0.1746  1.0
  I  I2  4  0.2011  0.2073  0.3177  1.0
  I  I3  2  0.0772  0.5000  0.8404  1.0
  I  I4  2  0.0886  0.0000  0.7470  1.0
]