# generated using pymatgen
data_TmSc(NbSe2)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02708479
_cell_length_b   7.02708496
_cell_length_c   13.72939298
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999443
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmSc(NbSe2)8
_chemical_formula_sum   'Tm1 Sc1 Nb8 Se16'
_cell_volume   587.12745665
_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
  Tm  Tm0  1  0.00000000  0.00000000  0.50000000  1.0
  Sc  Sc1  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb2  1  0.00000000  0.00000000  0.24466101  1.0
  Nb  Nb3  1  0.00000000  0.00000000  0.75533899  1.0
  Nb  Nb4  1  0.50817348  0.01634896  0.24445301  1.0
  Nb  Nb5  1  0.98365104  0.49182652  0.24445301  1.0
  Nb  Nb6  1  0.50817348  0.49182652  0.24445301  1.0
  Nb  Nb7  1  0.49182652  0.98365104  0.75554699  1.0
  Nb  Nb8  1  0.01634896  0.50817348  0.75554699  1.0
  Nb  Nb9  1  0.49182652  0.50817348  0.75554699  1.0
  Se  Se10  1  0.33333300  0.66666700  0.88031116  1.0
  Se  Se11  1  0.66666700  0.33333300  0.11968884  1.0
  Se  Se12  1  0.66666700  0.33333300  0.36973221  1.0
  Se  Se13  1  0.33333300  0.66666700  0.63026779  1.0
  Se  Se14  1  0.16934175  0.83065825  0.36469751  1.0
  Se  Se15  1  0.16934175  0.33868450  0.36469751  1.0
  Se  Se16  1  0.66131550  0.83065825  0.36469751  1.0
  Se  Se17  1  0.83065825  0.16934175  0.63530249  1.0
  Se  Se18  1  0.83065825  0.66131550  0.63530249  1.0
  Se  Se19  1  0.33868450  0.16934175  0.63530249  1.0
  Se  Se20  1  0.83111690  0.16888310  0.87530034  1.0
  Se  Se21  1  0.83111690  0.66223480  0.87530034  1.0
  Se  Se22  1  0.33776520  0.16888310  0.87530034  1.0
  Se  Se23  1  0.16888310  0.83111690  0.12469966  1.0
  Se  Se24  1  0.16888310  0.33776520  0.12469966  1.0
  Se  Se25  1  0.66223480  0.83111690  0.12469966  1.0