[CIF]
data_Ba2AlInO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.93292193
_cell_length_b   5.93292193
_cell_length_c   19.98246000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2AlInO5
_chemical_formula_sum   'Ba8 Al4 In4 O20'
_cell_volume   609.13962358
_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
  Ba  Ba0  1  0.00000000  3.42537407  17.86605771  1
  Ba  Ba1  1  2.96646096  1.71268704  2.11640229  1
  Ba  Ba2  1  2.96646096  1.71268704  7.87482771  1
  Ba  Ba3  1  0.00000000  0.00000000  0.00000000  1
  Ba  Ba4  1  0.00000000  0.00000000  9.99123000  1
  Ba  Ba5  1  0.00000000  3.42537407  4.99561500  1
  Ba  Ba6  1  0.00000000  3.42537407  12.10763229  1
  Ba  Ba7  1  2.96646096  1.71268704  14.98684500  1
  Al  Al8  1  0.00000000  0.00000000  16.71906451  1
  Al  Al9  1  0.00000000  0.00000000  3.26339549  1
  Al  Al10  1  0.00000000  0.00000000  13.25462549  1
  Al  Al11  1  0.00000000  0.00000000  6.72783451  1
  In  In12  1  2.96646096  1.71268704  11.32509917  1
  In  In13  1  0.00000000  3.42537407  1.33386917  1
  In  In14  1  2.96646096  1.71268704  18.64859083  1
  In  In15  1  0.00000000  3.42537407  8.65736083  1
  O  O16  1  4.48059159  0.83850331  12.67553380  1
  O  O17  1  1.48323048  2.56903055  9.99123000  1
  O  O18  1  0.00000000  0.00000000  4.99561500  1
  O  O19  1  1.51413062  4.29955779  7.30692620  1
  O  O20  1  -0.00000000  1.67700663  2.68430380  1
  O  O21  1  1.45233034  0.83850331  12.67553380  1
  O  O22  1  4.48059159  0.83850331  17.29815620  1
  O  O23  1  -1.51413062  4.29955779  2.68430380  1
  O  O24  1  0.00000000  0.00000000  14.98684500  1
  O  O25  1  -0.00000000  1.67700663  7.30692620  1
  O  O26  1  1.45233034  0.83850331  17.29815620  1
  O  O27  1  -1.48323048  2.56903055  0.00000000  1
  O  O28  1  -1.51413062  4.29955779  7.30692620  1
  O  O29  1  -1.48323048  2.56903055  9.99123000  1
  O  O30  1  1.51413062  4.29955779  2.68430380  1
  O  O31  1  2.96646096  3.46105448  12.67553380  1
  O  O32  1  2.96646096  0.00000000  0.00000000  1
  O  O33  1  1.48323048  2.56903055  0.00000000  1
  O  O34  1  2.96646096  0.00000000  9.99123000  1
  O  O35  1  2.96646096  3.46105448  17.29815620  1
[/CIF]
