# generated using pymatgen
data_Nb5PbSe8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.42131625
_cell_length_b   9.42131625
_cell_length_c   9.43625348
_cell_angle_alpha   77.00402864
_cell_angle_beta   77.00402864
_cell_angle_gamma   21.44907054
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb5PbSe8
_chemical_formula_sum   'Nb5 Pb1 Se8'
_cell_volume   298.14846975
_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
  Nb  Nb0  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.35884800  0.35884800  0.99658500  1.0
  Nb  Nb2  1  0.64115200  0.64115200  0.00341500  1.0
  Nb  Nb3  1  0.28914400  0.28914400  0.36775300  1.0
  Nb  Nb4  1  0.71085600  0.71085600  0.63224700  1.0
  Pb  Pb5  1  0.50000000  0.50000000  0.50000000  1.0
  Se  Se6  1  0.56987300  0.56987300  0.80142900  1.0
  Se  Se7  1  0.43012700  0.43012700  0.19857100  1.0
  Se  Se8  1  0.08471100  0.08471100  0.19263400  1.0
  Se  Se9  1  0.91528900  0.91528900  0.80736600  1.0
  Se  Se10  1  0.14997300  0.14997300  0.49137700  1.0
  Se  Se11  1  0.85002700  0.85002700  0.50862300  1.0
  Se  Se12  1  0.23942800  0.23942800  0.83928100  1.0
  Se  Se13  1  0.76057200  0.76057200  0.16071900  1.0