# generated using pymatgen
data_TaSe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.52664896
_cell_length_b   10.10898692
_cell_length_c   10.75011511
_cell_angle_alpha   108.14838277
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaSe3
_chemical_formula_sum   'Ta4 Se12'
_cell_volume   364.18516607
_cell_formula_units_Z   4
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  0.75000000  0.04581668  0.33236334  1.0
  Ta  Ta1  1  0.25000000  0.95418332  0.66763666  1.0
  Ta  Ta2  1  0.75000000  0.37360852  0.80920376  1.0
  Ta  Ta3  1  0.25000000  0.62639148  0.19079624  1.0
  Se  Se4  1  0.75000000  0.11795605  0.60153706  1.0
  Se  Se5  1  0.25000000  0.88204395  0.39846294  1.0
  Se  Se6  1  0.75000000  0.74684772  0.60616962  1.0
  Se  Se7  1  0.25000000  0.25315228  0.39383038  1.0
  Se  Se8  1  0.25000000  0.57208910  0.91787708  1.0
  Se  Se9  1  0.75000000  0.42791090  0.08212292  1.0
  Se  Se10  1  0.25000000  0.20334810  0.86625696  1.0
  Se  Se11  1  0.75000000  0.79665190  0.13374304  1.0
  Se  Se12  1  0.25000000  0.07446459  0.16307490  1.0
  Se  Se13  1  0.75000000  0.92553541  0.83692510  1.0
  Se  Se14  1  0.25000000  0.41650053  0.64280757  1.0
  Se  Se15  1  0.75000000  0.58349947  0.35719243  1.0