# generated using pymatgen
data_TaFe4Si
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.78752452
_cell_length_b   4.78752452
_cell_length_c   7.51475900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000712
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaFe4Si
_chemical_formula_sum   'Ta2 Fe8 Si2'
_cell_volume   149.16525657
_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
  Ta  Ta0  1  0.66666700  0.33333300  0.92062500  1.0
  Ta  Ta1  1  0.33333300  0.66666700  0.07937500  1.0
  Fe  Fe2  1  0.00000000  0.00000000  0.50000000  1.0
  Fe  Fe3  1  0.00000000  0.00000000  0.00000000  1.0
  Fe  Fe4  1  0.82944100  0.17055900  0.25607900  1.0
  Fe  Fe5  1  0.82944100  0.65888100  0.25607900  1.0
  Fe  Fe6  1  0.34111900  0.17055900  0.25607900  1.0
  Fe  Fe7  1  0.17055900  0.82944100  0.74392100  1.0
  Fe  Fe8  1  0.17055900  0.34111900  0.74392100  1.0
  Fe  Fe9  1  0.65888100  0.82944100  0.74392100  1.0
  Si  Si10  1  0.33333300  0.66666700  0.44252500  1.0
  Si  Si11  1  0.66666700  0.33333300  0.55747500  1.0