%chk=000291931.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291931

0 1
O 4.465813 -1.727091 -0.002075
N 2.497903 0.239754 0.013680
N 3.840432 0.518429 0.025276
C -3.877151 -1.579188 -0.051450
C -2.370845 -1.945275 -0.050163
C -3.978154 -0.032002 -0.027294
C -1.645061 -0.630055 -0.024983
C -2.557406 0.455094 -0.012018
C -0.277439 -0.409677 -0.014377
C -2.095863 1.763621 0.011643
C 0.194801 0.921741 0.009746
C -0.710948 1.993354 0.022531
C 1.640573 1.224701 0.022063
C 4.774053 -0.562374 0.015845
H -4.385006 -2.016566 0.823062
H -4.376665 -1.988436 -0.944237
H -2.097377 -2.535885 -0.943123
H -2.105968 -2.565052 0.825418
H -4.532446 0.321154 0.860492
H -4.523054 0.349392 -0.909226
H 0.430927 -1.240636 -0.024236
H -2.787814 2.601509 0.021669
H -0.347233 3.018546 0.041150
H 1.891892 2.295879 0.038154
H 4.183899 1.485369 0.040580
H 5.811138 -0.182005 0.027173


%chk=000291931-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291931

0 1
O 4.756600 -1.696334 -0.003359
N 2.537493 0.153880 0.012287
N 3.878352 0.506450 0.025043
C -3.964586 -1.574292 -0.052271
C -2.447440 -1.973944 -0.050179
C -4.033603 -0.006897 -0.028284
C -1.690278 -0.654963 -0.024948
C -2.584137 0.450713 -0.012620
C -0.300401 -0.454421 -0.013645
C -2.081346 1.769583 0.011210
C 0.216113 0.874568 0.010333
C -0.684788 1.977342 0.022569
C 1.658628 1.136454 0.022527
C 4.897557 -0.452931 0.015911
H -4.481368 -2.000086 0.825060
H -4.471741 -1.972639 -0.947912
H -2.180396 -2.569183 -0.943811
H -2.190165 -2.597362 0.826946
H -4.579630 0.364687 0.860179
H -4.569130 0.392255 -0.911180
H 0.406250 -1.291163 -0.022758
H -2.764114 2.627214 0.020911
H -0.285012 2.999490 0.041022
H 1.968365 2.203802 0.040547
H 4.162744 1.500741 0.041910
H 5.889035 0.061337 0.029814


