# generated using pymatgen
data_PrThZn4Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.16533989
_cell_length_b   7.16533989
_cell_length_c   5.32286636
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrThZn4Ru
_chemical_formula_sum   'Pr2 Th2 Zn8 Ru2'
_cell_volume   273.28711432
_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  0.00000000  0.50000000  0.78778886  1.0
  Pr  Pr1  1  0.50000000  0.00000000  0.21221114  1.0
  Th  Th2  1  0.00000000  0.00000000  0.00000000  1.0
  Th  Th3  1  0.50000000  0.50000000  0.00000000  1.0
  Zn  Zn4  1  0.18141497  0.68141497  0.30417967  1.0
  Zn  Zn5  1  0.81858503  0.68141497  0.30417967  1.0
  Zn  Zn6  1  0.81858503  0.31858503  0.30417967  1.0
  Zn  Zn7  1  0.31858503  0.18141497  0.69582033  1.0
  Zn  Zn8  1  0.18141497  0.31858503  0.30417967  1.0
  Zn  Zn9  1  0.68141497  0.18141497  0.69582033  1.0
  Zn  Zn10  1  0.68141497  0.81858503  0.69582033  1.0
  Zn  Zn11  1  0.31858503  0.81858503  0.69582033  1.0
  Ru  Ru12  1  0.50000000  0.50000000  0.50000000  1.0
  Ru  Ru13  1  0.00000000  0.00000000  0.50000000  1.0