# generated using pymatgen
data_TaSi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76862017
_cell_length_b   4.76863314
_cell_length_c   6.52140995
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99994092
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaSi2
_chemical_formula_sum   'Ta3 Si6'
_cell_volume   128.42779780
_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  -0.00000003  0.49999999  0.16664520  1.0
  Ta  Ta1  1  0.50000000  0.50000000  0.83334674  1.0
  Ta  Ta2  1  0.50000001  0.00000001  0.50000809  1.0
  Si  Si3  1  0.84138317  0.68276733  0.50000230  1.0
  Si  Si4  1  0.15861684  0.84138311  0.83331966  1.0
  Si  Si5  1  0.68276590  0.84138243  0.16667803  1.0
  Si  Si6  1  0.15861683  0.31723267  0.50000230  1.0
  Si  Si7  1  0.84138317  0.15861689  0.83331966  1.0
  Si  Si8  1  0.31723410  0.15861757  0.16667803  1.0