# generated using pymatgen
data_TaAlSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.89372510
_cell_length_b   4.89372510
_cell_length_c   6.77443200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998788
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaAlSi
_chemical_formula_sum   'Ta3 Al3 Si3'
_cell_volume   140.50206669
_cell_formula_units_Z   3
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
  Ta  Ta0  1  0.02961200  0.51480600  0.50000000  1.0
  Ta  Ta1  1  0.48519400  0.51480600  0.16666700  1.0
  Ta  Ta2  1  0.48519400  0.97038800  0.83333300  1.0
  Al  Al3  1  0.33729100  0.16864600  0.50000000  1.0
  Al  Al4  1  0.83135400  0.16864600  0.16666700  1.0
  Al  Al5  1  0.83135400  0.66270900  0.83333300  1.0
  Si  Si6  1  0.68324200  0.84162100  0.50000000  1.0
  Si  Si7  1  0.15837900  0.84162100  0.16666700  1.0
  Si  Si8  1  0.15837900  0.31675800  0.83333300  1.0