# generated using pymatgen
data_Ti16Ir5Pd3O4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.22748615
_cell_length_b   8.22748571
_cell_length_c   8.22748644
_cell_angle_alpha   60.08505529
_cell_angle_beta   60.08505695
_cell_angle_gamma   60.08506307
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti16Ir5Pd3O4
_chemical_formula_sum   'Ti16 Ir5 Pd3 O4'
_cell_volume   394.56880775
_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
  Ti  Ti0  1  0.12370333  0.62416066  0.62416066  1.0
  Ti  Ti1  1  0.62416066  0.12370333  0.62416066  1.0
  Ti  Ti2  1  0.62416066  0.62416066  0.12370333  1.0
  Ti  Ti3  1  0.62753985  0.62753985  0.62753985  1.0
  Ti  Ti4  1  0.81971199  0.81971199  0.18036477  1.0
  Ti  Ti5  1  0.18155839  0.18155839  0.81816943  1.0
  Ti  Ti6  1  0.81971199  0.18036477  0.81971199  1.0
  Ti  Ti7  1  0.18155839  0.81816943  0.18155839  1.0
  Ti  Ti8  1  0.18036477  0.81971199  0.81971199  1.0
  Ti  Ti9  1  0.81816943  0.18155839  0.18155839  1.0
  Ti  Ti10  1  0.43368404  0.43368404  0.06923197  1.0
  Ti  Ti11  1  0.06521208  0.06521208  0.43478548  1.0
  Ti  Ti12  1  0.43368404  0.06923197  0.43368404  1.0
  Ti  Ti13  1  0.06521208  0.43478548  0.06521208  1.0
  Ti  Ti14  1  0.06923197  0.43368404  0.43368404  1.0
  Ti  Ti15  1  0.43478548  0.06521208  0.06521208  1.0
  Ir  Ir16  1  0.40512125  0.40512125  0.40512125  1.0
  Ir  Ir17  1  0.47355262  0.84332925  0.84332925  1.0
  Ir  Ir18  1  0.84332925  0.47355262  0.84332925  1.0
  Ir  Ir19  1  0.84332925  0.84332925  0.47355262  1.0
  Ir  Ir20  1  0.84222068  0.84222068  0.84222068  1.0
  Pd  Pd21  1  0.77124057  0.41005539  0.41005539  1.0
  Pd  Pd22  1  0.41005539  0.77124057  0.41005539  1.0
  Pd  Pd23  1  0.41005539  0.41005539  0.77124057  1.0
  O  O24  1  0.62290071  0.12503152  0.12503152  1.0
  O  O25  1  0.12503152  0.62290071  0.12503152  1.0
  O  O26  1  0.12503152  0.12503152  0.62290071  1.0
  O  O27  1  0.12568271  0.12568271  0.12568271  1.0