# generated using pymatgen
data_Hf3Zr7(Pb3S)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.62616171
_cell_length_b   8.62616153
_cell_length_c   6.02457029
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999694
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf3Zr7(Pb3S)2
_chemical_formula_sum   'Hf3 Zr7 Pb6 S2'
_cell_volume   388.23251243
_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
  Hf  Hf0  1  0.66666700  0.33333300  0.00000000  1.0
  Hf  Hf1  1  0.33333300  0.66666700  0.00000000  1.0
  Hf  Hf2  1  0.33333300  0.66666700  0.50000000  1.0
  Zr  Zr3  1  0.66666700  0.33333300  0.50000000  1.0
  Zr  Zr4  1  0.75002439  0.75017511  0.74996347  1.0
  Zr  Zr5  1  0.24982489  0.99984929  0.74996347  1.0
  Zr  Zr6  1  0.00015071  0.24997561  0.74996347  1.0
  Zr  Zr7  1  0.24982489  0.24997561  0.25003653  1.0
  Zr  Zr8  1  0.75002439  0.99984929  0.25003653  1.0
  Zr  Zr9  1  0.00015071  0.75017511  0.25003653  1.0
  Pb  Pb10  1  0.39880809  0.39947230  0.75116754  1.0
  Pb  Pb11  1  0.60052770  0.99933579  0.75116754  1.0
  Pb  Pb12  1  0.00066421  0.60119191  0.75116754  1.0
  Pb  Pb13  1  0.60052770  0.60119191  0.24883246  1.0
  Pb  Pb14  1  0.39880809  0.99933579  0.24883246  1.0
  Pb  Pb15  1  0.00066421  0.39947230  0.24883246  1.0
  S  S16  1  0.00000000  0.00000000  0.00000000  1.0
  S  S17  1  0.00000000  0.00000000  0.50000000  1.0