# generated using pymatgen
data_Pr3HfSb5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.66435504
_cell_length_b   9.66435504
_cell_length_c   6.26196217
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000204
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr3HfSb5
_chemical_formula_sum   'Pr6 Hf2 Sb10'
_cell_volume   506.50858962
_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
  Pr  Pr0  1  0.61972073  -0.00000000  0.25000000  1.0
  Pr  Pr1  1  0.38027927  0.00000000  0.75000000  1.0
  Pr  Pr2  1  -0.00000000  0.61972073  0.25000000  1.0
  Pr  Pr3  1  0.00000000  0.38027927  0.75000000  1.0
  Pr  Pr4  1  0.38027927  0.38027927  0.25000000  1.0
  Pr  Pr5  1  0.61972073  0.61972073  0.75000000  1.0
  Hf  Hf6  1  -0.00000000  0.00000000  -0.00000000  1.0
  Hf  Hf7  1  -0.00000000  0.00000000  0.50000000  1.0
  Sb  Sb8  1  0.25837452  0.00000000  0.25000000  1.0
  Sb  Sb9  1  0.74162548  -0.00000000  0.75000000  1.0
  Sb  Sb10  1  0.00000000  0.25837452  0.25000000  1.0
  Sb  Sb11  1  -0.00000000  0.74162548  0.75000000  1.0
  Sb  Sb12  1  0.74162548  0.74162548  0.25000000  1.0
  Sb  Sb13  1  0.25837452  0.25837452  0.75000000  1.0
  Sb  Sb14  1  0.33333300  0.66666700  -0.00000000  1.0
  Sb  Sb15  1  0.66666700  0.33333300  -0.00000000  1.0
  Sb  Sb16  1  0.66666700  0.33333300  0.50000000  1.0
  Sb  Sb17  1  0.33333300  0.66666700  0.50000000  1.0