%chk=000230572.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230572

0 1
S 1.086417 1.054360 -1.759784
O -0.606873 2.649156 1.257417
N -1.264608 0.169600 -0.832827
N 1.062119 1.139731 1.277587
C -0.413971 1.360162 -0.777685
C -2.652341 0.410838 -0.320741
C -3.399715 -0.927299 -0.231835
C -4.854942 -0.713600 0.205972
C -0.004875 1.798550 0.630349
C 2.013863 0.024826 -0.699450
C 1.946928 0.192212 0.694880
C -5.610058 -2.036659 0.305307
C 2.876005 -0.918789 -1.261295
C 2.768565 -0.590548 1.532027
C 3.692165 -1.689170 -0.429649
C 3.636356 -1.520293 0.960215
H -0.941985 2.226271 -1.275044
H -3.163281 1.086938 -1.043450
H -2.664321 0.929936 0.663892
H -2.890901 -1.610311 0.475035
H -3.370974 -1.437864 -1.216500
H -0.828996 -0.628238 -0.355051
H -5.369960 -0.043343 -0.510756
H -4.884320 -0.192162 1.183257
H 1.245237 1.417934 2.249085
H -5.630445 -2.563800 -0.655743
H -5.153002 -2.710644 1.038750
H -6.650065 -1.875987 0.611996
H 2.914721 -1.053776 -2.344570
H 2.729998 -0.472505 2.612620
H 4.370911 -2.422252 -0.861538
H 4.276949 -2.124474 1.604026


%chk=000230572-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230572

0 1
S 0.599391 1.400634 -1.602453
O 0.271059 3.320311 1.754571
N -1.355218 0.704257 0.458755
N 1.505100 1.389829 1.378024
C -0.541726 1.780075 0.031129
C -2.514864 0.312486 -0.369254
C -3.360134 -0.764977 0.335670
C -4.570349 -1.214580 -0.514000
C 0.439488 2.250482 1.103539
C 1.626612 0.149120 -0.768366
C 1.957906 0.278606 0.612837
C -5.418409 -2.297628 0.186677
C 2.148101 -0.942573 -1.503363
C 2.805295 -0.680596 1.226024
C 3.006369 -1.882847 -0.893473
C 3.334868 -1.750014 0.476898
H -1.137629 2.635863 -0.316012
H -2.184064 -0.057053 -1.366778
H -3.129565 1.216941 -0.544319
H -3.707954 -0.372576 1.311068
H -2.723994 -1.649198 0.554396
H -0.857378 -0.081910 0.892243
H -4.211260 -1.598473 -1.490386
H -5.206134 -0.334325 -0.738698
H 2.063424 1.662585 2.193295
H -4.815693 -3.201903 0.394343
H -5.814081 -1.929119 1.151648
H -6.278553 -2.601709 -0.437117
H 1.882674 -1.042204 -2.561223
H 3.047180 -0.579081 2.291254
H 3.409996 -2.713584 -1.481382
H 3.994144 -2.478040 0.960950


