# generated using pymatgen
data_BaPr(TaS2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80746162
_cell_length_b   5.80746174
_cell_length_c   15.22425130
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998797
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaPr(TaS2)6
_chemical_formula_sum   'Ba1 Pr1 Ta6 S12'
_cell_volume   444.67153965
_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
  Ba  Ba0  1  0.00000000  0.00000000  0.50000000  1.0
  Pr  Pr1  1  0.00000000  0.00000000  0.00000000  1.0
  Ta  Ta2  1  0.00000000  0.00000000  0.23746493  1.0
  Ta  Ta3  1  0.00000000  0.00000000  0.76253507  1.0
  Ta  Ta4  1  0.33333300  0.66666700  0.23754248  1.0
  Ta  Ta5  1  0.66666700  0.33333300  0.76245752  1.0
  Ta  Ta6  1  0.66666700  0.33333300  0.23754248  1.0
  Ta  Ta7  1  0.33333300  0.66666700  0.76245752  1.0
  S  S8  1  0.33775089  0.00000000  0.13511509  1.0
  S  S9  1  0.00000000  0.33775089  0.13511509  1.0
  S  S10  1  0.66224911  0.66224911  0.13511509  1.0
  S  S11  1  0.33733805  0.33733805  0.66055234  1.0
  S  S12  1  0.66266195  0.66266195  0.33944766  1.0
  S  S13  1  0.66266195  0.00000000  0.66055234  1.0
  S  S14  1  0.00000000  0.66266195  0.66055234  1.0
  S  S15  1  1.00000000  0.66224911  0.86488491  1.0
  S  S16  1  0.33775089  0.33775089  0.86488491  1.0
  S  S17  1  1.00000000  0.33733805  0.33944766  1.0
  S  S18  1  0.33733805  1.00000000  0.33944766  1.0
  S  S19  1  0.66224911  1.00000000  0.86488491  1.0