# generated using pymatgen
data_Nb3PbSe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10636315
_cell_length_b   6.10636344
_cell_length_c   15.47291034
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000379
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3PbSe6
_chemical_formula_sum   'Nb6 Pb2 Se12'
_cell_volume   499.65231245
_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  0.33333300  0.66666700  0.00068285  1.0
  Nb  Nb1  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb2  1  0.66666700  0.33333300  0.99931715  1.0
  Nb  Nb3  1  0.33333300  0.66666700  0.49931715  1.0
  Nb  Nb4  1  0.00000000  0.00000000  0.50000000  1.0
  Nb  Nb5  1  0.66666700  0.33333300  0.50068285  1.0
  Pb  Pb6  1  0.33333300  0.66666700  0.25000000  1.0
  Pb  Pb7  1  0.66666700  0.33333300  0.75000000  1.0
  Se  Se8  1  0.67106791  0.66595465  0.39333782  1.0
  Se  Se9  1  0.66595465  0.67106791  0.60666218  1.0
  Se  Se10  1  0.00511426  0.67106791  0.89333782  1.0
  Se  Se11  1  0.66595465  0.99488574  0.89333782  1.0
  Se  Se12  1  0.67106791  0.00511426  0.10666218  1.0
  Se  Se13  1  0.33404535  0.00511426  0.39333782  1.0
  Se  Se14  1  0.00511426  0.33404535  0.60666218  1.0
  Se  Se15  1  0.32893209  0.99488574  0.60666218  1.0
  Se  Se16  1  0.99488574  0.66595465  0.10666218  1.0
  Se  Se17  1  0.32893209  0.33404535  0.89333782  1.0
  Se  Se18  1  0.99488574  0.32893209  0.39333782  1.0
  Se  Se19  1  0.33404535  0.32893209  0.10666218  1.0