# generated using pymatgen
data_Li2TeSe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.09835900
_cell_length_b   5.63405600
_cell_length_c   8.29752225
_cell_angle_alpha   87.54732966
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TeSe3
_chemical_formula_sum   'Li8 Te4 Se12'
_cell_volume   565.06449336
_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
  Li  Li0  1  0.77358500  0.26518200  0.14605300  1
  Li  Li1  1  0.72641500  0.26518200  0.64605300  1
  Li  Li2  1  0.41341200  0.23669400  0.13379900  1
  Li  Li3  1  0.08658800  0.23669400  0.63379900  1
  Li  Li4  1  0.58658800  0.76330600  0.86620100  1
  Li  Li5  1  0.91341200  0.76330600  0.36620100  1
  Li  Li6  1  0.22641500  0.73481800  0.85394700  1
  Li  Li7  1  0.27358500  0.73481800  0.35394700  1
  Te  Te8  1  0.08678600  0.28442000  0.18684100  1
  Te  Te9  1  0.58678600  0.71558000  0.31315900  1
  Te  Te10  1  0.91321400  0.71558000  0.81315900  1
  Te  Te11  1  0.41321400  0.28442000  0.68684100  1
  Se  Se12  1  0.92309600  0.25465800  0.37745900  1
  Se  Se13  1  0.25088500  0.22782400  0.88488300  1
  Se  Se14  1  0.74911500  0.77217600  0.11511700  1
  Se  Se15  1  0.57690400  0.25465800  0.87745900  1
  Se  Se16  1  0.90304800  0.26234900  0.87062600  1
  Se  Se17  1  0.09695200  0.73765100  0.12937400  1
  Se  Se18  1  0.40304800  0.73765100  0.62937400  1
  Se  Se19  1  0.07690400  0.74534200  0.62254100  1
  Se  Se20  1  0.75088500  0.77217600  0.61511700  1
  Se  Se21  1  0.24911500  0.22782400  0.38488300  1
  Se  Se22  1  0.59695200  0.26234900  0.37062600  1
  Se  Se23  1  0.42309600  0.74534200  0.12254100  1
