# generated using pymatgen
data_Ti6BeSe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.73528335
_cell_length_b   6.73528392
_cell_length_c   3.51924981
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000210
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti6BeSe2
_chemical_formula_sum   'Ti6 Be1 Se2'
_cell_volume   138.25870892
_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  0.40491036  1.00000000  0.00000000  1.0
  Ti  Ti1  1  0.00000000  0.40490936  0.00000000  1.0
  Ti  Ti2  1  0.59508964  0.59509064  0.00000000  1.0
  Ti  Ti3  1  0.76153987  0.00000000  0.49999900  1.0
  Ti  Ti4  1  0.23845913  0.23845913  0.49999900  1.0
  Ti  Ti5  1  0.00000000  0.76154087  0.49999900  1.0
  Be  Be6  1  0.00000000  0.00000000  0.00000000  1.0
  Se  Se7  1  0.66666700  0.33333300  0.49999900  1.0
  Se  Se8  1  0.33333400  0.66666700  0.49999900  1.0