# generated using pymatgen
data_Ba3LuTiIrO9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87536206
_cell_length_b   5.87536161
_cell_length_c   14.52457868
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000251
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba3LuTiIrO9
_chemical_formula_sum   'Ba6 Lu2 Ti2 Ir2 O18'
_cell_volume   434.21357817
_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
  Ba  Ba0  1  0.33333300  0.66666700  0.59380442  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.39857892  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.09380442  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.89857892  1.0
  Ba  Ba4  1  0.00000000  0.00000000  0.24909653  1.0
  Ba  Ba5  1  0.00000000  0.00000000  0.74909653  1.0
  Lu  Lu6  1  0.00000000  0.00000000  0.49967932  1.0
  Lu  Lu7  1  0.00000000  0.00000000  0.99967932  1.0
  Ti  Ti8  1  0.66666700  0.33333300  0.64904594  1.0
  Ti  Ti9  1  0.33333300  0.66666700  0.14904594  1.0
  Ir  Ir10  1  0.33333300  0.66666700  0.33946684  1.0
  Ir  Ir11  1  0.66666700  0.33333300  0.83946684  1.0
  O  O12  1  0.17244533  0.82755467  0.08847907  1.0
  O  O13  1  0.17244533  0.34488965  0.08847907  1.0
  O  O14  1  0.65511035  0.82755467  0.08847907  1.0
  O  O15  1  0.82624765  0.17375235  0.91621871  1.0
  O  O16  1  0.82624765  0.65249630  0.91621871  1.0
  O  O17  1  0.34750370  0.17375235  0.91621871  1.0
  O  O18  1  0.82755467  0.17244533  0.58847907  1.0
  O  O19  1  0.82755467  0.65511035  0.58847907  1.0
  O  O20  1  0.34488965  0.17244533  0.58847907  1.0
  O  O21  1  0.17375235  0.82624765  0.41621871  1.0
  O  O22  1  0.17375235  0.34750370  0.41621871  1.0
  O  O23  1  0.65249630  0.82624765  0.41621871  1.0
  O  O24  1  0.48386068  0.51613932  0.25207923  1.0
  O  O25  1  0.48386068  0.96772136  0.25207923  1.0
  O  O26  1  0.03227864  0.51613932  0.25207923  1.0
  O  O27  1  0.51613932  0.48386068  0.75207923  1.0
  O  O28  1  0.51613932  0.03227864  0.75207923  1.0
  O  O29  1  0.96772136  0.48386068  0.75207923  1.0