# generated using pymatgen
data_Nb2Se3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.47956188
_cell_length_b   6.62996938
_cell_length_c   9.30099227
_cell_angle_alpha   104.07460506
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2Se3
_chemical_formula_sum   'Nb4 Se6'
_cell_volume   208.12684635
_cell_formula_units_Z   2
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
  Nb  Nb0  1  0.25000000  0.11428199  0.63425135  1.0
  Nb  Nb1  1  0.75000000  0.88571801  0.36574865  1.0
  Nb  Nb2  1  0.25000000  0.32186894  0.00232767  1.0
  Nb  Nb3  1  0.75000000  0.67813106  0.99767233  1.0
  Se  Se4  1  0.25000000  0.72991704  0.51217163  1.0
  Se  Se5  1  0.75000000  0.27008296  0.48782837  1.0
  Se  Se6  1  0.25000000  0.96694113  0.15748975  1.0
  Se  Se7  1  0.75000000  0.03305887  0.84251025  1.0
  Se  Se8  1  0.75000000  0.47498658  0.20270130  1.0
  Se  Se9  1  0.25000000  0.52501342  0.79729870  1.0