# generated using pymatgen
data_Ti16Si16Mo3W
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.63460703
_cell_length_b   6.63460790
_cell_length_c   12.13845779
_cell_angle_alpha   89.98526404
_cell_angle_beta   90.01473699
_cell_angle_gamma   89.98789336
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti16Si16Mo3W
_chemical_formula_sum   'Ti16 Si16 Mo3 W1'
_cell_volume   534.31078371
_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  0.99547827  0.14876886  0.62226742  1.0
  Ti  Ti1  1  0.35111662  0.49557683  0.87217592  1.0
  Ti  Ti2  1  0.64942014  0.50460868  0.37234712  1.0
  Ti  Ti3  1  0.49557683  0.35111662  0.12782408  1.0
  Ti  Ti4  1  0.50460868  0.64942014  0.62765288  1.0
  Ti  Ti5  1  0.00448462  0.85117099  0.12214629  1.0
  Ti  Ti6  1  0.14876886  0.99547827  0.37773258  1.0
  Ti  Ti7  1  0.85117099  0.00448462  0.87785371  1.0
  Ti  Ti8  1  0.00060872  0.33946709  0.22228736  1.0
  Ti  Ti9  1  0.15956956  0.50127629  0.47216571  1.0
  Ti  Ti10  1  0.83967311  0.49936757  0.97223908  1.0
  Ti  Ti11  1  0.50127629  0.15956956  0.52783429  1.0
  Ti  Ti12  1  0.49936757  0.83967311  0.02776092  1.0
  Ti  Ti13  1  0.99892081  0.66061742  0.72181274  1.0
  Ti  Ti14  1  0.33946709  0.00060872  0.77771264  1.0
  Ti  Ti15  1  0.66061742  0.99892081  0.27818726  1.0
  Si  Si16  1  0.04346679  0.30304389  0.81429095  1.0
  Si  Si17  1  0.19704198  0.54334417  0.06429423  1.0
  Si  Si18  1  0.80278085  0.45624913  0.56450546  1.0
  Si  Si19  1  0.54334417  0.19704198  0.93570577  1.0
  Si  Si20  1  0.45624913  0.80278085  0.43549454  1.0
  Si  Si21  1  0.95684564  0.69714145  0.31409372  1.0
  Si  Si22  1  0.30304389  0.04346679  0.18570905  1.0
  Si  Si23  1  0.69714145  0.95684564  0.68590628  1.0
  Si  Si24  1  0.29304682  0.35976535  0.67320516  1.0
  Si  Si25  1  0.14041409  0.79289724  0.92327367  1.0
  Si  Si26  1  0.85972797  0.20687120  0.42341471  1.0
  Si  Si27  1  0.79289724  0.14041409  0.07672633  1.0
  Si  Si28  1  0.20687120  0.85972797  0.57658529  1.0
  Si  Si29  1  0.70710505  0.64031315  0.17329484  1.0
  Si  Si30  1  0.35976535  0.29304682  0.32679484  1.0
  Si  Si31  1  0.64031315  0.70710505  0.82670516  1.0
  Mo  Mo32  1  0.17071680  0.17071680  0.00000000  1.0
  Mo  Mo33  1  0.32925255  0.67075672  0.24996128  1.0
  Mo  Mo34  1  0.67075672  0.32925255  0.75003872  1.0
  W  W35  1  0.82909559  0.82909559  0.50000000  1.0