data_[Li8In4O11]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  In  1.7800  1.5500  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.1420]
_cell_length_b [5.3398]
_cell_length_c [9.2116]
_cell_angle_alpha [84.7786]
_cell_angle_beta [74.8625]
_cell_angle_gamma [79.7228]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li8In4O11]
_chemical_formula_sum '[Li8 In4 O11]'
_cell_volume [239.9740]
_cell_formula_units_Z [1]
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
[
  Li  Li0  1  0.0044  0.5032  0.4996  1
  Li  Li1  1  0.1642  0.0034  0.3515  1
  Li  Li2  1  0.2470  0.2443  0.7490  1
  Li  Li3  1  0.3351  0.4652  0.1760  1
  Li  Li4  1  0.5302  0.0171  0.9815  1
  Li  Li5  1  0.6668  0.4856  0.8239  1
  Li  Li6  1  0.6999  0.7505  0.2553  1
  Li  Li7  1  0.8285  0.0195  0.6706  1
  In  In8  1  0.0796  0.7462  0.9066  1
  In  In9  1  0.4208  0.7493  0.5824  1
  In  In10  1  0.5857  0.2494  0.4167  1
  In  In11  1  0.9056  0.2690  0.0812  1
  O  O12  1  0.0398  0.6250  0.7024  1
  O  O13  1  0.2082  0.1248  0.5424  1
  O  O14  1  0.2921  0.3827  0.9720  1
  O  O15  1  0.3628  0.6240  0.3719  1
  O  O16  1  0.4579  0.8712  0.7990  1
  O  O17  1  0.5526  0.1155  0.2048  1
  O  O18  1  0.6286  0.3734  0.6256  1
  O  O19  1  0.7082  0.6479  0.0475  1
  O  O20  1  0.7980  0.8690  0.4499  1
  O  O21  1  0.8860  0.1299  0.8770  1
  O  O22  1  0.9696  0.3588  0.2885  1
]