%chk=000245493.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245493

0 1
I -3.313503 2.214795 0.045090
O 2.125328 2.104622 -0.203652
O 2.943990 0.165131 0.263432
N 2.008663 0.910735 0.020620
N -1.284438 -2.842256 -0.185954
C 0.398331 -1.033365 -0.035286
C 0.632829 0.349293 0.000074
C -0.964757 -1.471010 -0.047354
C -0.417818 1.291011 0.015615
C -2.013887 -0.533486 -0.021076
C 1.517330 -2.013153 -0.057271
C -1.722050 0.828891 0.007125
H -0.182476 2.363548 0.029525
H -3.051769 -0.874794 -0.036220
H 2.122632 -1.947569 0.866420
H 1.209187 -3.057382 -0.184048
H 2.227642 -1.796462 -0.877269
H -2.205334 -3.116038 0.129361
H -0.570501 -3.498012 0.109066


%chk=000245493-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245493

0 1
I -3.370853 2.249459 0.047517
O 2.160755 2.099887 -0.623639
O 2.942336 0.331533 0.578218
N 1.994630 0.963248 -0.034319
N -1.227103 -2.830740 0.069347
C 0.425580 -1.024534 -0.014709
C 0.625832 0.378456 -0.032395
C -0.941396 -1.468764 0.041939
C -0.422229 1.332080 -0.034969
C -2.012643 -0.529355 0.067631
C 1.518820 -2.070637 -0.108800
C -1.738741 0.848752 0.019482
H -0.182061 2.395165 -0.073900
H -3.044745 -0.890656 0.120478
H 1.633507 -2.616858 0.848889
H 1.274273 -2.808182 -0.898420
H 2.499965 -1.635403 -0.335738
H -2.189580 -3.155216 0.087700
H -0.486949 -3.523734 0.113886


