# generated using pymatgen
data_Ti9NbSn6As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.14520918
_cell_length_b   8.14520928
_cell_length_c   5.52467797
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000364
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti9NbSn6As
_chemical_formula_sum   'Ti9 Nb1 Sn6 As1'
_cell_volume   317.42569117
_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  0.33333300  0.66666700  0.50000000  1.0
  Ti  Ti1  1  0.33333300  0.66666700  0.00000000  1.0
  Ti  Ti2  1  0.66666700  0.33333300  0.00000000  1.0
  Ti  Ti3  1  0.74444162  0.74293244  0.24062203  1.0
  Ti  Ti4  1  0.25706756  0.00150917  0.24062203  1.0
  Ti  Ti5  1  0.99849083  0.25555838  0.24062203  1.0
  Ti  Ti6  1  0.25706756  0.25555838  0.75937797  1.0
  Ti  Ti7  1  0.74444162  0.00150917  0.75937797  1.0
  Ti  Ti8  1  0.99849083  0.74293244  0.75937797  1.0
  Nb  Nb9  1  0.66666700  0.33333300  0.50000000  1.0
  Sn  Sn10  1  0.38985355  0.39283965  0.24823110  1.0
  Sn  Sn11  1  0.60716035  0.99701490  0.24823110  1.0
  Sn  Sn12  1  0.00298510  0.61014645  0.24823110  1.0
  Sn  Sn13  1  0.60716035  0.61014645  0.75176890  1.0
  Sn  Sn14  1  0.38985355  0.99701490  0.75176890  1.0
  Sn  Sn15  1  0.00298510  0.39283965  0.75176890  1.0
  As  As16  1  0.00000000  0.00000000  0.50000000  1.0