# generated using pymatgen
data_PrNi4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08569941
_cell_length_b   5.08570071
_cell_length_c   3.98422461
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   121.93428755
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PrNi4Ir
_chemical_formula_sum   'Pr1 Ni4 Ir1'
_cell_volume   87.45338585
_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  0.50000000  0.50000000  0.00000000  1.0
  Ni  Ni1  1  0.17450466  0.82549534  0.00000000  1.0
  Ni  Ni2  1  0.82549534  0.17450466  0.00000000  1.0
  Ni  Ni3  1  0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni4  1  0.50000000  0.00000000  0.50000000  1.0
  Ir  Ir5  1  0.00000000  0.00000000  0.50000000  1.0