# generated using pymatgen
data_Ta2Ni4(TeSe)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.68262270
_cell_length_b   7.68529983
_cell_length_c   10.39717631
_cell_angle_alpha   68.77824328
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2Ni4(TeSe)3
_chemical_formula_sum   'Ta2 Ni4 Te3 Se3'
_cell_volume   274.30657657
_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  0.25000000  0.78652343  0.70363381  1.0
  Ta  Ta1  1  0.75000000  0.22105356  0.29477696  1.0
  Ni  Ni2  1  0.25000000  0.41296643  0.09215834  1.0
  Ni  Ni3  1  0.75000000  0.58779992  0.91128906  1.0
  Ni  Ni4  1  0.75000000  0.04308105  0.56440949  1.0
  Ni  Ni5  1  0.25000000  0.96471336  0.43788455  1.0
  Te  Te6  1  0.25000000  0.41318600  0.84570405  1.0
  Te  Te7  1  0.25000000  0.28403155  0.49292211  1.0
  Te  Te8  1  0.75000000  0.72579095  0.50387443  1.0
  Se  Se9  1  0.75000000  0.92057274  0.81468950  1.0
  Se  Se10  1  0.25000000  0.07910729  0.18906586  1.0
  Se  Se11  1  0.75000000  0.56117373  0.14959183  1.0