# generated using pymatgen
data_Ti3(TeSe)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.22933253
_cell_length_b   7.22933253
_cell_length_c   6.77719257
_cell_angle_alpha   63.92852855
_cell_angle_beta   63.92852855
_cell_angle_gamma   30.34078337
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti3(TeSe)2
_chemical_formula_sum   'Ti3 Te2 Se2'
_cell_volume   159.29408110
_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
  Ti  Ti0  1  0.25367403  0.25367403  0.80695402  1.0
  Ti  Ti1  1  0.74632597  0.74632597  0.19304598  1.0
  Ti  Ti2  1  0.00000000  -0.00000000  0.00000000  1.0
  Te  Te3  1  0.36630061  0.36630061  0.31144352  1.0
  Te  Te4  1  0.63369939  0.63369939  0.68855648  1.0
  Se  Se5  1  0.11640272  0.11640272  0.21239881  1.0
  Se  Se6  1  0.88359728  0.88359728  0.78760119  1.0