%chk=000251333.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251333

0 1
O 0.476687 1.688576 -0.429597
O -3.887464 -0.663508 0.628512
N 1.223667 -0.312778 0.399761
C 0.902946 -1.696314 0.857154
C 2.616129 0.016480 0.192013
C 0.200819 0.590421 0.027027
C 0.505335 -2.614729 -0.295820
C 3.071357 1.322003 0.460984
C 3.520303 -0.967744 -0.248681
C -1.206154 0.151583 0.245876
C 4.422852 1.626196 0.300317
C 4.871322 -0.644893 -0.396635
C 5.328582 0.646344 -0.121418
C -2.188997 0.635784 -0.526788
C -3.582051 0.281044 -0.378225
C -4.738775 0.667552 -1.018485
C -5.821992 -0.051369 -0.401925
C -5.269836 -0.836369 0.578069
H 1.783631 -2.109425 1.400812
H 0.079374 -1.640232 1.607961
H -0.406142 -2.267827 -0.800152
H 1.288574 -2.669783 -1.063442
H 0.316593 -3.634525 0.058640
H 2.366552 2.097851 0.768688
H 3.179846 -1.972047 -0.489518
H -1.399304 -0.543821 1.066000
H 4.772910 2.637808 0.505063
H 5.570686 -1.408148 -0.735639
H 6.381140 0.891178 -0.240206
H -1.976919 1.354258 -1.334952
H -4.838732 1.370713 -1.823945
H -6.856300 0.031744 -0.676889
H -5.632336 -1.534622 1.299642


%chk=000251333-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251333

0 1
O 0.384035 1.533738 -0.776991
O -4.024786 -0.845041 0.376176
N 1.241764 -0.403320 0.253964
C 0.981716 -1.752664 0.837761
C 2.620742 0.007524 0.112764
C 0.178328 0.416123 -0.197489
C 0.651242 -2.842805 -0.204946
C 3.005776 1.372332 0.225674
C 3.631608 -0.971681 -0.093300
C -1.211807 -0.073003 0.026214
C 4.366002 1.733592 0.136457
C 4.990071 -0.598595 -0.177357
C 5.368853 0.757133 -0.064086
C -2.262292 0.682226 -0.427478
C -3.656703 0.357875 -0.287861
C -4.821105 1.016589 -0.691999
C -5.945021 0.216091 -0.276116
C -5.426210 -0.899554 0.365179
H 1.878993 -2.036591 1.412019
H 0.165529 -1.672935 1.576913
H -0.259575 -2.590150 -0.774973
H 1.472827 -2.969880 -0.931167
H 0.482777 -3.811939 0.300254
H 2.244042 2.139054 0.366713
H 3.367017 -2.026788 -0.210925
H -1.415298 -1.011894 0.545936
H 4.641449 2.790232 0.228718
H 5.749414 -1.371677 -0.340749
H 6.422668 1.047748 -0.133021
H -2.025301 1.619850 -0.946919
H -4.855553 1.964750 -1.225564
H -6.999246 0.436002 -0.430801
H -5.867653 -1.770939 0.841204


