#%pal 
#  nprocs 12 
#end 
! uks bp ri d3 def2-tzvp def2-tzvp/j tightscf opt cpcm(water) 
! PrintBasis def2-tzvp
%output
     print[p_mos] 1
  end 
* xyz 2 5
Fe          0.0000280000         -0.0000210000          0.0001650000
N         -1.7073360000          0.3648220000          1.2441370000
N          0.5401510000         -1.6611290000          1.2433730000
N          1.1698340000          1.2977550000          1.2433450000
N         -1.1689800000         -1.2982730000         -1.2432220000
N          1.7073630000         -0.3638560000         -1.2440960000
N         -0.5410060000          1.6606790000         -1.2432490000
H         -2.2306620000         -0.4915300000          1.4552630000
H         -1.4489860000          0.7777410000          2.1464350000
H         -2.3729680000          1.0136990000          0.8107260000
H          1.4490990000         -0.7780650000         -2.1458150000
H          2.2291730000          0.4931140000         -1.4565460000
H          2.3743320000         -1.0111630000         -0.8103930000
H          0.3192530000         -2.5618820000          0.8057080000
H          1.5420490000         -1.6815000000          1.4612900000
H          0.0470550000         -1.6506270000          2.1420760000
H         -1.5426710000          1.6793420000         -1.4623940000
H         -0.3222080000          2.5617790000         -0.8052430000
H         -0.0468960000          1.6509950000         -2.1414010000
H         -1.3976050000         -0.8690950000         -2.1459770000
H         -0.6880910000         -2.1791760000         -1.4537430000
H         -2.0636670000         -1.5514990000         -0.8111790000
H          0.6903400000          2.1797310000          1.4524540000
H          1.3971340000          0.8691690000          2.1467310000
H          2.0653110000          1.5488840000          0.8117090000
*