# generated using pymatgen
data_Nb6SbS12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85177569
_cell_length_b   5.85177568
_cell_length_c   13.57527210
_cell_angle_alpha   85.87618673
_cell_angle_beta   85.87618369
_cell_angle_gamma   120.00334215
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6SbS12
_chemical_formula_sum   'Nb6 Sb1 S12'
_cell_volume   398.38277195
_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  0.08627959  0.08627959  0.74182835  1.0
  Nb  Nb1  1  0.41939835  0.75261779  0.74239664  1.0
  Nb  Nb2  1  0.75261779  0.41939835  0.74239664  1.0
  Nb  Nb3  1  0.24738221  0.58060165  0.25760336  1.0
  Nb  Nb4  1  0.58060165  0.24738221  0.25760336  1.0
  Nb  Nb5  1  0.91372041  0.91372041  0.25817165  1.0
  Sb  Sb6  1  0.00000000  0.00000000  0.00000000  1.0
  S  S7  1  0.28915993  0.28915993  0.14006786  1.0
  S  S8  1  0.61723987  0.95319849  0.14009116  1.0
  S  S9  1  0.95319849  0.61723987  0.14009116  1.0
  S  S10  1  0.04680151  0.38276013  0.85990884  1.0
  S  S11  1  0.38276013  0.04680151  0.85990884  1.0
  S  S12  1  0.71084007  0.71084007  0.85993214  1.0
  S  S13  1  0.20937263  0.20937263  0.37163264  1.0
  S  S14  1  0.54245798  0.87602732  0.37158206  1.0
  S  S15  1  0.87602732  0.54245798  0.37158206  1.0
  S  S16  1  0.12397268  0.45754202  0.62841794  1.0
  S  S17  1  0.45754202  0.12397268  0.62841794  1.0
  S  S18  1  0.79062737  0.79062737  0.62836736  1.0