# generated using pymatgen
data_PmNi4Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.05471844
_cell_length_b   5.05477620
_cell_length_c   3.97632254
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   57.81472211
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PmNi4Ir
_chemical_formula_sum   'Pm1 Ni4 Ir1'
_cell_volume   85.98452043
_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
  Pm  Pm0  1  0.00014131  0.00010536  0.00000000  1.0
  Ni  Ni1  1  0.32471936  0.32455829  0.00000000  1.0
  Ni  Ni2  1  0.67555277  0.67547540  0.00000000  1.0
  Ni  Ni3  1  0.49988228  0.99990573  0.49999900  1.0
  Ni  Ni4  1  0.99983632  0.49995817  0.49999900  1.0
  Ir  Ir5  1  0.49986296  0.50000005  0.49999900  1.0