# generated using pymatgen
data_Ta2FeS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.32377201
_cell_length_b   3.32377201
_cell_length_c   11.91691500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000020
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2FeS4
_chemical_formula_sum   'Ta2 Fe1 S4'
_cell_volume   114.01366987
_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
  Ta  Ta0  1  0.00000000  0.00000000  0.25969700  1.0
  Ta  Ta1  1  0.00000000  0.00000000  0.74030300  1.0
  Fe  Fe2  1  0.00000000  0.00000000  0.50000000  1.0
  S  S3  1  0.33333300  0.66666700  0.39593300  1.0
  S  S4  1  0.66666700  0.33333300  0.60406700  1.0
  S  S5  1  0.66666700  0.33333300  0.87118000  1.0
  S  S6  1  0.33333300  0.66666700  0.12882000  1.0