# generated using pymatgen
data_Ti12CuSn9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.19959966
_cell_length_b   9.19960065
_cell_length_c   5.65430964
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000361
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti12CuSn9
_chemical_formula_sum   'Ti12 Cu1 Sn9'
_cell_volume   414.42706199
_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  0.84642663  0.69285226  0.74625502  1.0
  Ti  Ti1  1  0.15357337  0.84642663  0.25374498  1.0
  Ti  Ti2  1  0.69285226  0.84642663  0.25374498  1.0
  Ti  Ti3  1  0.30714774  0.15357337  0.74625502  1.0
  Ti  Ti4  1  0.84642663  0.15357337  0.74625502  1.0
  Ti  Ti5  1  0.15357337  0.30714774  0.25374498  1.0
  Ti  Ti6  1  0.50000000  0.00000000  0.50000000  1.0
  Ti  Ti7  1  0.50000000  0.50000000  0.00000000  1.0
  Ti  Ti8  1  0.00000000  0.50000000  0.00000000  1.0
  Ti  Ti9  1  0.00000000  0.50000000  0.50000000  1.0
  Ti  Ti10  1  0.50000000  0.00000000  0.00000000  1.0
  Ti  Ti11  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu12  1  0.00000000  0.00000000  0.50000000  1.0
  Sn  Sn13  1  0.19896050  0.39792201  0.74993363  1.0
  Sn  Sn14  1  0.80103950  0.19896050  0.25006637  1.0
  Sn  Sn15  1  0.39792201  0.19896050  0.25006637  1.0
  Sn  Sn16  1  0.60207799  0.80103950  0.74993363  1.0
  Sn  Sn17  1  0.19896050  0.80103950  0.74993363  1.0
  Sn  Sn18  1  0.80103950  0.60207799  0.25006637  1.0
  Sn  Sn19  1  0.66666700  0.33333300  0.74941973  1.0
  Sn  Sn20  1  0.33333300  0.66666700  0.25058027  1.0
  Sn  Sn21  1  0.00000000  0.00000000  0.00000000  1.0