# generated using pymatgen
data_Ti12Sn9Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.22588955
_cell_length_b   9.29408171
_cell_length_c   5.68984943
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.75758758
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti12Sn9Sb
_chemical_formula_sum   'Ti12 Sn9 Sb1'
_cell_volume   423.54720848
_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  0.84148627  0.68297255  0.75000000  1.0
  Ti  Ti1  1  0.15642222  0.84335567  0.25000000  1.0
  Ti  Ti2  1  0.68693346  0.84335567  0.25000000  1.0
  Ti  Ti3  1  0.30839229  0.15962361  0.75000000  1.0
  Ti  Ti4  1  0.85123132  0.15962361  0.75000000  1.0
  Ti  Ti5  1  0.15576044  0.31151989  0.25000000  1.0
  Ti  Ti6  1  0.49980191  0.99960482  0.49865622  1.0
  Ti  Ti7  1  0.49867332  0.50045060  0.99942427  1.0
  Ti  Ti8  1  0.00177728  0.50045060  0.99942427  1.0
  Ti  Ti9  1  0.00177728  0.50045060  0.50057573  1.0
  Ti  Ti10  1  0.49980191  0.99960482  0.00134378  1.0
  Ti  Ti11  1  0.49867332  0.50045060  0.50057573  1.0
  Sn  Sn12  1  0.79669948  0.20519807  0.25000000  1.0
  Sn  Sn13  1  0.40849860  0.20519807  0.25000000  1.0
  Sn  Sn14  1  0.59558810  0.79950847  0.75000000  1.0
  Sn  Sn15  1  0.20392137  0.79950847  0.75000000  1.0
  Sn  Sn16  1  0.79420311  0.58840622  0.25000000  1.0
  Sn  Sn17  1  0.66546447  0.33092794  0.75000000  1.0
  Sn  Sn18  1  0.33464020  0.66928140  0.25000000  1.0
  Sn  Sn19  1  0.99753224  0.99506449  0.49932147  1.0
  Sn  Sn20  1  0.99753224  0.99506449  0.00067853  1.0
  Sb  Sb21  1  0.20519017  0.41037934  0.75000000  1.0