# generated using pymatgen
data_Ti6SnHgBi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37591935
_cell_length_b   9.37591999
_cell_length_c   5.75080515
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000121
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti6SnHgBi3
_chemical_formula_sum   'Ti12 Sn2 Hg2 Bi6'
_cell_volume   437.81136911
_cell_formula_units_Z   2
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  0.84302305  0.68604609  0.75000000  1.0
  Ti  Ti1  1  0.15697695  0.84302305  0.25000000  1.0
  Ti  Ti2  1  0.68604609  0.84302305  0.25000000  1.0
  Ti  Ti3  1  0.31395391  0.15697695  0.75000000  1.0
  Ti  Ti4  1  0.84302305  0.15697695  0.75000000  1.0
  Ti  Ti5  1  0.15697695  0.31395391  0.25000000  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
  Sn  Sn12  1  0.66666700  0.33333300  0.75000000  1.0
  Sn  Sn13  1  0.33333300  0.66666700  0.25000000  1.0
  Hg  Hg14  1  0.00000000  0.00000000  0.50000000  1.0
  Hg  Hg15  1  0.00000000  0.00000000  0.00000000  1.0
  Bi  Bi16  1  0.19880165  0.39760529  0.75000000  1.0
  Bi  Bi17  1  0.80119835  0.19880165  0.25000000  1.0
  Bi  Bi18  1  0.39760529  0.19880165  0.25000000  1.0
  Bi  Bi19  1  0.60239471  0.80119835  0.75000000  1.0
  Bi  Bi20  1  0.19880165  0.80119835  0.75000000  1.0
  Bi  Bi21  1  0.80119835  0.60239471  0.25000000  1.0