# generated using pymatgen
data_Ta3CrSe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.01023268
_cell_length_b   6.01018843
_cell_length_c   12.95487640
_cell_angle_alpha   90.00076666
_cell_angle_beta   89.99933199
_cell_angle_gamma   120.00014899
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta3CrSe6
_chemical_formula_sum   'Ta6 Cr2 Se12'
_cell_volume   405.26829303
_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  -0.00000418  0.00000370  0.99998540  1.0
  Ta  Ta1  1  0.66666791  0.33333437  0.00042176  1.0
  Ta  Ta2  1  0.33333674  0.66666577  0.50044608  1.0
  Ta  Ta3  1  -0.00000147  -0.00000511  0.50001904  1.0
  Ta  Ta4  1  0.33333161  0.66666602  -0.00044452  1.0
  Ta  Ta5  1  0.66666518  0.33332797  0.49957959  1.0
  Cr  Cr6  1  0.66666245  0.33333324  0.74997434  1.0
  Cr  Cr7  1  0.33333453  0.66666685  0.25002459  1.0
  Se  Se8  1  0.67127063  0.66673218  0.12869393  1.0
  Se  Se9  1  0.32872717  0.33328640  0.62870208  1.0
  Se  Se10  1  0.66672111  0.67126225  0.87127613  1.0
  Se  Se11  1  0.32873181  0.99546272  0.87127684  1.0
  Se  Se12  1  0.00454881  0.67127140  0.62870272  1.0
  Se  Se13  1  0.00453516  0.33327680  0.87127506  1.0
  Se  Se14  1  0.99546900  0.66671170  0.37132767  1.0
  Se  Se15  1  0.33327634  0.32873304  0.37132701  1.0
  Se  Se16  1  0.67127011  0.00453312  0.37132614  1.0
  Se  Se17  1  0.99545284  0.32875010  0.12869459  1.0
  Se  Se18  1  0.66672198  0.99544983  0.62870132  1.0
  Se  Se19  1  0.33328126  0.00453866  0.12869123  1.0