%chk=000221480.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221480

0 1
S 0.665210 0.906300 -1.122841
O -0.303325 0.861520 0.357153
O -2.348713 2.582483 0.516292
O -0.826880 -1.728100 0.588899
O 0.088740 -0.043506 -2.033591
O 0.774222 2.287643 -1.490563
N -1.587767 0.436347 0.073220
N -3.076163 -1.432663 0.212689
C -4.011707 0.839987 0.372163
C -4.129207 -0.527260 -0.306136
C -2.611310 1.421473 0.359312
C -1.752452 -0.990540 0.319302
C 2.116448 0.340309 -0.406979
C 2.168352 -0.943676 0.147578
C 3.245937 1.169746 -0.375279
C 3.358288 -1.405069 0.720462
C 4.432374 0.707601 0.195917
C 4.487396 -0.581555 0.742516
H -4.341407 0.782567 1.435560
H -4.701519 1.568811 -0.109119
H -5.124662 -0.979781 -0.096077
H -4.039351 -0.414955 -1.414284
H -3.239899 -2.437712 0.165584
H 1.275446 -1.589130 0.146625
H 3.197891 2.181374 -0.795696
H 3.398612 -2.404648 1.152232
H 5.312344 1.348769 0.219951
H 5.415402 -0.941435 1.189610


%chk=000221480-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221480

0 1
S 0.529444 1.270743 -0.684233
O -0.581506 1.111871 1.196865
O -2.718240 2.669551 0.518212
O -0.862874 -1.618096 1.243692
O -0.464587 0.277285 -1.533147
O 0.893133 2.737336 -1.289543
N -1.760609 0.546275 0.840510
N -2.912766 -1.425682 0.144762
C -4.135799 0.700231 0.094316
C -3.827260 -0.600555 -0.666531
C -2.856321 1.432114 0.478646
C -1.789008 -0.923559 0.757725
C 2.151852 0.414550 -0.224751
C 2.098441 -0.807073 0.464392
C 3.334860 1.075730 -0.598561
C 3.337081 -1.418461 0.772535
C 4.556299 0.440183 -0.278294
C 4.555302 -0.801389 0.401034
H -4.707716 0.476906 1.015718
H -4.735829 1.389919 -0.520417
H -4.754986 -1.170566 -0.839615
H -3.366704 -0.368809 -1.646902
H -2.932294 -2.443106 0.057366
H 1.144431 -1.252767 0.772322
H 3.298555 2.039503 -1.115729
H 3.341762 -2.370640 1.312684
H 5.500997 0.917533 -0.558148
H 5.506639 -1.284125 0.649591


