# generated using pymatgen
data_PrTh2(AlIr)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.15740802
_cell_length_b   7.21568668
_cell_length_c   4.15879946
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.73317489
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrTh2(AlIr)3
_chemical_formula_sum   'Pr1 Th2 Al3 Ir3'
_cell_volume   186.50628708
_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
  Pr  Pr0  1  0.41958367  0.00000000  0.50000000  1.0
  Th  Th1  1  0.00165447  0.42099371  0.50000000  1.0
  Th  Th2  1  0.58066176  0.57900629  0.50000000  1.0
  Al  Al3  1  0.76720376  1.00000000  0.00000000  1.0
  Al  Al4  1  0.00189584  0.77817280  0.00000000  1.0
  Al  Al5  1  0.22372204  0.22182720  0.00000000  1.0
  Ir  Ir6  1  0.32942481  0.64172900  0.00000000  1.0
  Ir  Ir7  1  0.68769681  0.35827100  0.00000000  1.0
  Ir  Ir8  1  0.98815785  0.00000000  0.50000000  1.0