# generated using pymatgen
data_Nb6PbS8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.68044363
_cell_length_b   9.68044363
_cell_length_c   3.42087700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999749
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6PbS8
_chemical_formula_sum   'Nb6 Pb1 S8'
_cell_volume   277.62503275
_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  0.62506200  0.51279100  0.25128700  1.0
  Nb  Nb1  1  0.88772900  0.37493800  0.25128700  1.0
  Nb  Nb2  1  0.48720900  0.11227100  0.25128700  1.0
  Nb  Nb3  1  0.37493800  0.48720900  0.74871300  1.0
  Nb  Nb4  1  0.11227100  0.62506200  0.74871300  1.0
  Nb  Nb5  1  0.51279100  0.88772900  0.74871300  1.0
  Pb  Pb6  1  0.00000000  0.00000000  0.50000000  1.0
  S  S7  1  0.33333300  0.66666700  0.24945700  1.0
  S  S8  1  0.66666700  0.33333300  0.75054300  1.0
  S  S9  1  0.94530500  0.65870600  0.24759200  1.0
  S  S10  1  0.71340100  0.05469500  0.24759200  1.0
  S  S11  1  0.34129400  0.28659900  0.24759200  1.0
  S  S12  1  0.05469500  0.34129400  0.75240800  1.0
  S  S13  1  0.28659900  0.94530500  0.75240800  1.0
  S  S14  1  0.65870600  0.71340100  0.75240800  1.0