# generated using pymatgen
data_Hf2(TaSi)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.72324321
_cell_length_b   7.72324310
_cell_length_c   7.72324295
_cell_angle_alpha   129.42470046
_cell_angle_beta   129.42469395
_cell_angle_gamma   74.32816758
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2(TaSi)3
_chemical_formula_sum   'Hf4 Ta6 Si6'
_cell_volume   267.95074241
_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
  Hf  Hf0  1  0.01664915  0.18372717  0.50000000  1.0
  Hf  Hf1  1  0.68372717  0.51664915  0.50000000  1.0
  Hf  Hf2  1  0.51664915  0.01664915  0.83292198  1.0
  Hf  Hf3  1  0.18372717  0.68372717  0.16707802  1.0
  Ta  Ta4  1  0.98344156  0.81140887  0.50000000  1.0
  Ta  Ta5  1  0.31140887  0.48344156  0.50000000  1.0
  Ta  Ta6  1  0.48344156  0.98344156  0.17203268  1.0
  Ta  Ta7  1  0.81140887  0.31140887  0.82796732  1.0
  Ta  Ta8  1  0.00817359  0.00817359  1.00000000  1.0
  Ta  Ta9  1  0.50817359  0.50817359  1.00000000  1.0
  Si  Si10  1  0.74228911  0.74228911  0.00000000  1.0
  Si  Si11  1  0.24228911  0.24228911  0.00000000  1.0
  Si  Si12  1  0.37171399  0.13259756  0.50000000  1.0
  Si  Si13  1  0.63259756  0.87171399  0.50000000  1.0
  Si  Si14  1  0.87171399  0.37171399  0.23911743  1.0
  Si  Si15  1  0.13259756  0.63259756  0.76088257  1.0