%chk=000268909.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268909

0 1
S -2.776126 1.055807 -0.008028
O 1.056078 0.106680 -0.002198
O 0.107200 2.158665 -0.012144
C 3.339585 -0.437444 0.002118
C 4.796357 0.041514 0.003424
C 2.378944 0.745616 -0.004740
C 5.770105 -1.133889 0.009733
C -1.268680 0.193749 -0.003461
C -0.031747 0.954759 -0.006565
C -3.706297 -0.423742 -0.001467
C -1.481031 -1.159927 0.002774
C -2.873185 -1.510687 0.003906
C -5.173525 -0.360511 -0.002471
H 3.142836 -1.084889 -0.876150
H 3.138921 -1.077746 0.884754
H 4.982481 0.685213 0.886315
H 4.986192 0.678819 -0.883299
H 2.449471 1.381072 0.894073
H 2.450551 1.371476 -0.910166
H 5.636624 -1.765797 0.895563
H 5.638893 -1.773451 -0.870929
H 6.809644 -0.786009 0.009538
H -0.687562 -1.900357 0.006514
H -3.203300 -2.539965 0.008589
H -5.565286 0.159369 -0.893152
H -5.631982 -1.362913 0.005580
H -5.566163 0.173987 0.879090


%chk=000268909-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268909

0 1
S -2.857511 1.152827 -0.003199
O 1.041048 0.021930 -0.004423
O 0.105329 2.170930 -0.008280
C 3.417656 -0.485889 0.002496
C 4.868909 0.050697 0.001488
C 2.394524 0.650406 -0.006642
C 5.915470 -1.084188 0.013474
C -1.318272 0.206343 -0.004027
C -0.038123 0.920196 -0.006165
C -3.808539 -0.382624 -0.000691
C -1.567389 -1.163745 -0.002421
C -2.964660 -1.491726 -0.000620
C -5.310969 -0.343684 0.000665
H 3.255468 -1.129952 -0.883339
H 3.252331 -1.117993 0.896314
H 5.022105 0.704100 0.884298
H 5.026409 0.689609 -0.891090
H 2.482774 1.300491 0.884113
H 2.485299 1.288533 -0.905741
H 5.800775 -1.719679 0.911680
H 5.805254 -1.734792 -0.874446
H 6.944967 -0.682038 0.012618
H -0.757773 -1.895818 -0.002638
H -3.345379 -2.516336 0.000725
H -5.709969 0.173128 -0.892026
H -5.712469 -1.371455 0.005075
H -5.708266 0.180128 0.890002


