# generated using pymatgen
data_Ti12Mn5MoIr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.31266498
_cell_length_b   6.09260471
_cell_length_c   12.93616716
_cell_angle_alpha   89.99993648
_cell_angle_beta   90.00004489
_cell_angle_gamma   89.99969317
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti12Mn5MoIr6
_chemical_formula_sum   'Ti12 Mn5 Mo1 Ir6'
_cell_volume   339.90248788
_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  0.49999244  0.24835857  0.00222395  1.0
  Ti  Ti1  1  0.50000271  0.75164359  0.00222378  1.0
  Ti  Ti2  1  0.00003721  0.25008566  0.16732947  1.0
  Ti  Ti3  1  0.00005118  0.74991372  0.16732969  1.0
  Ti  Ti4  1  0.50004537  0.25077518  0.33334394  1.0
  Ti  Ti5  1  0.50005088  0.74922191  0.33334450  1.0
  Ti  Ti6  1  0.99999685  0.25008548  0.49934378  1.0
  Ti  Ti7  1  0.00001061  0.74991478  0.49934370  1.0
  Ti  Ti8  1  0.49995182  0.24836381  0.66443496  1.0
  Ti  Ti9  1  0.49996182  0.75163726  0.66443501  1.0
  Ti  Ti10  1  0.99994498  0.24694894  0.83332717  1.0
  Ti  Ti11  1  0.99995829  0.75305207  0.83332659  1.0
  Mn  Mn12  1  0.99999739  0.99999923  0.00220604  1.0
  Mn  Mn13  1  0.50004264  0.50000021  0.16889683  1.0
  Mn  Mn14  1  0.00004171  0.99999343  0.33335027  1.0
  Mn  Mn15  1  0.50000487  0.50000363  0.49774863  1.0
  Mn  Mn16  1  0.99996190  0.99999641  0.66444226  1.0
  Mo  Mo17  1  0.49995289  0.50000042  0.83332072  1.0
  Ir  Ir18  1  0.99999168  0.49999973  0.00355304  1.0
  Ir  Ir19  1  0.50005034  0.00000033  0.16829084  1.0
  Ir  Ir20  1  0.00004993  0.49999533  0.33335148  1.0
  Ir  Ir21  1  0.50000276  0.00000153  0.49840515  1.0
  Ir  Ir22  1  0.99995042  0.49999786  0.66310331  1.0
  Ir  Ir23  1  0.49995031  0.00000091  0.83332188  1.0