%chk=000212317.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212317

0 1
I 3.786346 -2.124875 -0.327507
O 1.318184 -0.611663 -0.098875
O -1.339484 1.771254 0.302836
O -3.507257 0.151879 -0.798809
N -1.379737 -0.518044 -0.061883
N -3.280092 -1.940945 0.117207
C 0.736756 0.666249 0.053394
C 1.716967 1.626554 0.125872
C -0.743033 0.741199 0.100314
C 2.981706 0.944439 0.015987
C 2.690659 -0.388674 -0.115233
C -2.801951 -0.674187 -0.269984
H 1.581788 2.690231 0.241921
H 3.950509 1.412962 0.035497
H -0.789158 -1.357736 -0.128831
H -2.802461 -2.503370 0.802111
H -4.284043 -2.077472 0.081683


%chk=000212317-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212317

0 1
I 3.866660 -2.164814 -0.186782
O 1.271972 -0.635593 -0.070478
O -1.319521 1.935228 0.144892
O -3.681831 0.254533 -0.463166
N -1.441794 -0.434804 -0.032820
N -3.212632 -1.958335 0.100885
C 0.700728 0.670332 0.023143
C 1.719783 1.609914 0.079419
C -0.775477 0.805428 0.045575
C 2.974310 0.899233 0.020759
C 2.664273 -0.450774 -0.068635
C -2.855368 -0.632790 -0.148300
H 1.571902 2.684910 0.153189
H 3.974321 1.324558 0.040972
H -0.836385 -1.260968 -0.071749
H -2.589001 -2.644348 0.522702
H -4.196240 -2.193909 -0.013908


