# generated using pymatgen
data_LuNb9Se16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.01580321
_cell_length_b   7.01580480
_cell_length_c   13.57377772
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00001146
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuNb9Se16
_chemical_formula_sum   'Lu1 Nb9 Se16'
_cell_volume   578.61036716
_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
  Lu  Lu0  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.00000000  0.00000000  0.25691830  1.0
  Nb  Nb2  1  0.00000000  0.00000000  0.74308170  1.0
  Nb  Nb3  1  0.50746809  0.01493718  0.25760329  1.0
  Nb  Nb4  1  0.49253191  0.98506282  0.74239671  1.0
  Nb  Nb5  1  0.98506282  0.49253191  0.25760329  1.0
  Nb  Nb6  1  0.01493718  0.50746809  0.74239671  1.0
  Nb  Nb7  1  0.50746809  0.49253191  0.25760329  1.0
  Nb  Nb8  1  0.49253191  0.50746809  0.74239671  1.0
  Nb  Nb9  1  0.00000000  0.00000000  0.50000000  1.0
  Se  Se10  1  0.33333300  0.66666700  0.61626551  1.0
  Se  Se11  1  0.66666700  0.33333300  0.38373449  1.0
  Se  Se12  1  0.66666700  0.33333300  0.13101798  1.0
  Se  Se13  1  0.33333300  0.66666700  0.86898202  1.0
  Se  Se14  1  0.16929167  0.33858234  0.13496716  1.0
  Se  Se15  1  0.83070833  0.66141766  0.86503284  1.0
  Se  Se16  1  0.66141766  0.83070833  0.13496716  1.0
  Se  Se17  1  0.83168441  0.66336882  0.62168849  1.0
  Se  Se18  1  0.33858234  0.16929167  0.86503284  1.0
  Se  Se19  1  0.16831559  0.33663118  0.37831151  1.0
  Se  Se20  1  0.16929167  0.83070833  0.13496716  1.0
  Se  Se21  1  0.33663118  0.16831559  0.62168849  1.0
  Se  Se22  1  0.83070833  0.16929167  0.86503284  1.0
  Se  Se23  1  0.66336882  0.83168441  0.37831151  1.0
  Se  Se24  1  0.83168441  0.16831559  0.62168849  1.0
  Se  Se25  1  0.16831559  0.83168441  0.37831151  1.0