# generated using pymatgen
data_Ti12Re6Ir5Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38353953
_cell_length_b   6.18689949
_cell_length_c   13.14915467
_cell_angle_alpha   89.99978969
_cell_angle_beta   90.00019320
_cell_angle_gamma   89.99997670
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti12Re6Ir5Os
_chemical_formula_sum   'Ti12 Re6 Ir5 Os1'
_cell_volume   356.61189237
_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  0.50002749  0.24875938  0.99829473  1.0
  Ti  Ti1  1  0.50002992  0.75124251  0.99830640  1.0
  Ti  Ti2  1  0.99995587  0.25012315  0.16626512  1.0
  Ti  Ti3  1  0.99996521  0.74990959  0.16627693  1.0
  Ti  Ti4  1  0.49998531  0.25009238  0.33338731  1.0
  Ti  Ti5  1  0.49999390  0.74993153  0.33339065  1.0
  Ti  Ti6  1  0.99999647  0.25008521  0.50045001  1.0
  Ti  Ti7  1  0.99999857  0.74988518  0.50044128  1.0
  Ti  Ti8  1  0.50000748  0.24875090  0.66831149  1.0
  Ti  Ti9  1  0.50000880  0.75122096  0.66830441  1.0
  Ti  Ti10  1  0.00004584  0.24739272  0.83327823  1.0
  Ti  Ti11  1  0.00004478  0.75259838  0.83328228  1.0
  Re  Re12  1  0.00001154  0.00000502  0.00095877  1.0
  Re  Re13  1  0.49995195  0.50002706  0.16685523  1.0
  Re  Re14  1  0.99998138  0.00001242  0.33339020  1.0
  Re  Re15  1  0.49998375  0.49999089  0.49985854  1.0
  Re  Re16  1  0.99999310  0.99997630  0.66566238  1.0
  Re  Re17  1  0.50004970  0.49998901  0.83328320  1.0
  Ir  Ir18  1  0.00002503  0.50000453  0.00018632  1.0
  Ir  Ir19  1  0.49995917  0.00003395  0.16696173  1.0
  Ir  Ir20  1  0.99996691  0.50000588  0.33338400  1.0
  Ir  Ir21  1  0.49998205  0.99999448  0.49975660  1.0
  Ir  Ir22  1  0.00001508  0.49998215  0.66644143  1.0
  Os  Os23  1  0.50002370  0.99999141  0.83327674  1.0