%chk=000268883.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268883

0 1
S 1.510363 -2.023357 -0.001152
S 3.707339 1.585459 -0.001069
O 0.772212 2.363825 0.001010
O -4.884877 -0.326367 -0.001510
O -4.056588 1.673130 0.004453
N -3.951228 0.459521 0.001119
C -0.181170 0.194219 -0.000005
C -0.033482 -1.197922 -0.000559
C 2.299868 0.591350 -0.000537
C 2.662583 -0.733159 -0.001086
C 0.959088 1.163347 0.000190
C -1.479603 0.740162 0.000484
C -1.151296 -2.053168 -0.000654
C -2.587202 -0.110279 0.000468
C 4.076757 -0.952691 -0.001681
C -2.429494 -1.512869 -0.000187
C 4.773818 0.227325 -0.001103
H -1.610784 1.836014 0.000990
H -1.023290 -3.138890 -0.001041
H 4.523531 -1.939135 -0.002162
H -3.318949 -2.155726 -0.000393
H 5.846703 0.351014 -0.001375


%chk=000268883-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268883

0 1
S 1.543122 -2.128687 -0.001233
S 3.747504 1.682208 0.000427
O 0.753334 2.405693 0.000966
O -4.971853 -0.327772 0.001023
O -4.064026 1.766051 0.001330
N -3.964110 0.481156 0.000886
C -0.180011 0.171515 0.000310
C -0.046790 -1.248447 -0.000524
C 2.306770 0.589925 -0.000032
C 2.701827 -0.750899 -0.000874
C 0.963246 1.148026 0.000816
C -1.486112 0.726470 0.000764
C -1.195731 -2.085673 -0.000877
C -2.604099 -0.115663 0.000461
C 4.125009 -0.951695 -0.001614
C -2.479682 -1.527068 -0.000377
C 4.817744 0.249236 -0.001704
H -1.591064 1.815847 0.001372
H -1.076810 -3.174140 -0.001523
H 4.607739 -1.931060 -0.002421
H -3.378175 -2.148778 -0.000588
H 5.896466 0.395556 -0.002387


