data_[In9O9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [8.9313]
_cell_length_b [8.9313]
_cell_length_c [19.0797]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [157]
_chemical_formula_structural [InO]
_chemical_formula_sum '[In9 O9]'
_cell_volume [1318.0367]
_cell_formula_units_Z [9]
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
[
  In  In0  6  0.2034  0.7873  0.4827  1
  In  In1  3  0.0000  0.2428  0.6319  1
  O  O2  6  0.0948  0.5426  0.4180  1
  O  O3  2  0.3333  0.6667  0.5344  1
  O  O4  1  0.0000  0.0000  0.6315  1
]