%chk=000247208.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247208

0 1
S -0.606599 -1.378512 -0.330243
O -0.679201 -1.117507 -1.750783
O -1.063098 -2.637325 0.226018
O 5.097892 1.254338 -0.091031
O 3.400901 1.927463 -1.253962
N -1.454200 -0.150489 0.508223
N 3.939762 1.171167 -0.463897
C -2.010047 1.004567 -0.259719
C -3.182438 0.610829 -1.183696
C -2.440343 2.102276 0.738273
C -4.448622 0.241395 -0.405682
C -3.722905 1.746733 1.500930
C -4.864365 1.370178 0.547258
C 1.040123 -1.134554 0.190064
C 1.802136 -0.102941 -0.353644
C 1.586830 -1.990821 1.152166
C 3.123062 0.071107 0.091060
C 2.907604 -1.815662 1.584220
C 3.683032 -0.783379 1.057797
H -1.177029 1.406855 -0.898330
H -2.881213 -0.220350 -1.855412
H -3.397180 1.460448 -1.861907
H -2.590909 3.045169 0.176719
H -1.619525 2.300096 1.454718
H -4.289964 -0.695797 0.160987
H -5.270998 0.024786 -1.114641
H -4.027968 2.603626 2.131879
H -3.528195 0.912922 2.202284
H -5.170614 2.258622 -0.038329
H -5.755582 1.065811 1.127252
H -2.111386 -0.466704 1.238396
H 1.396286 0.568631 -1.125502
H 0.980054 -2.809788 1.565693
H 3.330314 -2.488684 2.332080
H 4.719287 -0.628405 1.383460


%chk=000247208-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247208

0 1
S -0.490762 -1.234314 -0.689287
O -0.369347 -0.642614 -2.203602
O -1.008662 -2.746666 -0.356919
O 5.427681 1.163552 0.364062
O 3.860908 1.918770 -1.113062
N -1.501735 -0.028045 0.342670
N 4.267767 1.108577 -0.197115
C -2.234713 0.993264 -0.479565
C -3.537747 0.459576 -1.132738
C -2.526360 2.200627 0.452881
C -4.635309 0.148635 -0.085836
C -3.628874 1.890159 1.494061
C -4.920823 1.375984 0.813524
C 1.220549 -1.061387 0.102287
C 2.063194 -0.044240 -0.360194
C 1.579279 -1.985915 1.096701
C 3.333345 0.037019 0.248252
C 2.864759 -1.873292 1.677112
C 3.748585 -0.855837 1.260481
H -1.532435 1.307098 -1.274448
H -3.308994 -0.429269 -1.750793
H -3.911581 1.239947 -1.825647
H -2.856572 3.041748 -0.190017
H -1.590426 2.509556 0.951779
H -4.330388 -0.711404 0.549170
H -5.558233 -0.174386 -0.603174
H -3.845059 2.800067 2.085259
H -3.259103 1.131286 2.214079
H -5.350707 2.187817 0.190766
H -5.680737 1.122207 1.577170
H -2.149182 -0.660087 0.857326
H 1.775034 0.642640 -1.161429
H 0.880619 -2.778689 1.383762
H 3.174693 -2.580879 2.451777
H 4.746240 -0.745404 1.693405


