%chk=000234936.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234936

0 1
S 2.728045 0.014282 -0.090960
S -2.728095 0.014086 0.090927
O 2.783965 -1.153736 0.767542
O 2.934912 1.328297 0.485870
O -2.784344 -1.154014 -0.767441
O -2.934541 1.328099 -0.486063
N 1.183405 0.025227 -0.884536
N -1.183474 0.024598 0.884561
C 0.364299 -1.202350 -0.681870
C 0.375341 1.259055 -0.674917
C -0.364287 -1.202802 0.681132
C -0.375456 1.258601 0.675756
C 3.833906 -0.208526 -1.422821
C -3.834084 -0.208197 1.422768
H 1.007245 -2.105731 -0.767689
H -0.380160 -1.265540 -1.514304
H -0.348972 1.343260 -1.520189
H 1.034557 2.155851 -0.738353
H 0.380193 -1.266452 1.513518
H -1.007180 -2.106280 0.766390
H -1.034695 2.155336 0.739762
H 0.348834 1.342274 1.521092
H 4.577462 0.600720 -1.495195
H 4.410865 -1.142868 -1.345644
H 3.339897 -0.242190 -2.406595
H -4.411274 -1.142408 1.345725
H -3.340129 -0.241839 2.406570
H -4.577438 0.601248 1.494963


%chk=000234936-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234936

0 1
S 2.790440 -0.043099 -0.053561
S -2.790573 -0.042489 0.053570
O 2.963343 -1.468531 0.732373
O 2.963149 1.381064 0.734559
O -2.963665 -1.467293 -0.733471
O -2.963079 1.382300 -0.733451
N 1.096326 -0.042650 -1.026792
N -1.096360 -0.042893 1.026853
C 0.336525 -1.287553 -0.697847
C 0.336820 1.202272 -0.697261
C -0.336870 -1.287812 0.697219
C -0.336640 1.202022 0.697803
C 3.995925 -0.041804 -1.521194
C -3.996004 -0.042200 1.521245
H 1.017810 -2.151731 -0.775826
H -0.436448 -1.382792 -1.485522
H -0.436086 1.298071 -1.484938
H 1.018292 2.066344 -0.774789
H 0.436095 -1.383640 1.484836
H -1.018355 -2.151878 0.774779
H -1.017968 2.066178 0.775725
H 0.436312 1.297338 1.485496
H 5.001686 -0.041353 -1.078182
H 3.785112 -0.953390 -2.095053
H 3.783981 0.869969 -2.094341
H -3.785171 -0.954182 2.094468
H -3.784009 0.869165 2.095017
H -5.001788 -0.041433 1.078285


