# generated using pymatgen
data_LuHf9(Pb3S)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.57097032
_cell_length_b   8.59714338
_cell_length_c   6.00074021
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.10106621
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuHf9(Pb3S)2
_chemical_formula_sum   'Lu1 Hf9 Pb6 S2'
_cell_volume   382.53962403
_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
  Lu  Lu0  1  1.00000000  0.25096293  0.25000000  1.0
  Hf  Hf1  1  0.66514125  0.33478365  0.99950109  1.0
  Hf  Hf2  1  0.74745852  0.99967864  0.75000000  1.0
  Hf  Hf3  1  0.25254148  0.25222012  0.75000000  1.0
  Hf  Hf4  1  0.33485875  0.66964340  0.50049891  1.0
  Hf  Hf5  1  0.33485875  0.66964340  0.99950109  1.0
  Hf  Hf6  1  0.00000000  0.74503369  0.75000000  1.0
  Hf  Hf7  1  0.66514125  0.33478365  0.50049891  1.0
  Hf  Hf8  1  0.74718390  0.74863260  0.25000000  1.0
  Hf  Hf9  1  0.25281610  0.00144870  0.25000000  1.0
  Pb  Pb10  1  0.60248056  0.60317345  0.75000000  1.0
  Pb  Pb11  1  0.39751944  0.00069289  0.75000000  1.0
  Pb  Pb12  1  0.00000000  0.60488442  0.25000000  1.0
  Pb  Pb13  1  0.39875869  0.40004503  0.25000000  1.0
  Pb  Pb14  1  0.00000000  0.39635651  0.75000000  1.0
  Pb  Pb15  1  0.60124131  0.00128633  0.25000000  1.0
  S  S16  1  1.00000000  0.99336479  0.99697287  1.0
  S  S17  1  1.00000000  0.99336479  0.50302713  1.0