%chk=000238609.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238609

0 1
S -0.603896 1.593409 -1.040365
O -0.368194 1.286602 -2.440043
O -0.937030 2.953272 -0.637624
O 4.472899 -1.816483 0.749508
O 2.939843 -2.578333 -0.689148
C -1.815563 0.518223 -0.437076
C 0.831567 1.146830 -0.143793
C -2.558511 0.860982 0.696677
C -2.079384 -0.684272 -1.103226
C 1.484566 -0.055188 -0.405333
C 1.336675 2.027828 0.817581
C -3.791320 -1.221598 0.530162
C -3.538143 -0.004282 1.185269
C -3.055698 -1.554885 -0.622090
C 2.639061 -0.391398 0.323295
C 2.490400 1.699650 1.538719
C 3.143645 0.490574 1.294753
C -4.839655 -2.153905 1.036573
C 3.296158 -1.681087 0.040553
H -2.381642 1.817899 1.199946
H -1.525325 -0.939484 -2.014496
H 1.118926 -0.745511 -1.177084
H 0.829041 2.985440 1.001783
H -4.110945 0.269560 2.069049
H -3.254119 -2.490100 -1.142749
H 2.881360 2.390602 2.285429
H 4.048165 0.220489 1.849971
H -5.702954 -2.183399 0.352957
H -4.463753 -3.184410 1.120532
H -5.225139 -1.871878 2.025618
H 4.925567 -2.683249 0.560352


%chk=000238609-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238609

0 1
S -0.561202 1.480451 -1.087765
O -0.277709 0.979622 -2.619733
O -0.920699 3.029786 -0.692226
O 4.902792 -1.677811 0.622416
O 3.489855 -2.285510 -1.119411
C -1.948870 0.394668 -0.395148
C 0.987499 1.033616 -0.073335
C -2.751744 0.916330 0.629308
C -2.159803 -0.863911 -0.980792
C 1.763356 -0.053680 -0.486700
C 1.318753 1.864935 1.009054
C -4.050105 -1.181942 0.573902
C -3.805961 0.108198 1.113347
C -3.217843 -1.651529 -0.478927
C 2.934404 -0.346851 0.259288
C 2.493277 1.563097 1.737933
C 3.293933 0.460448 1.369771
C -5.194133 -2.037326 1.087007
C 3.756571 -1.513121 -0.169371
H -2.573707 1.926186 1.013665
H -1.535312 -1.200160 -1.815235
H 1.503960 -0.650950 -1.367610
H 0.688986 2.729579 1.245499
H -4.449465 0.489212 1.914291
H -3.404709 -2.639949 -0.914686
H 2.783439 2.192085 2.585302
H 4.203879 0.220092 1.926196
H -5.996334 -2.120100 0.329311
H -4.857268 -3.064563 1.316270
H -5.641726 -1.613422 2.001693
H 5.412488 -2.465579 0.292386


