%chk=000259521.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259521

0 1
S 1.227722 1.327813 0.107371
O 0.253366 -2.315339 0.635027
C -2.043039 0.528217 0.319158
C -0.877408 -0.246139 0.647051
C -3.129043 -0.092660 -0.357938
C 0.294078 0.350615 1.340552
C -0.868443 -1.586827 0.287493
C -3.054865 -1.477302 -0.709353
C -2.157740 1.916633 0.657308
C -1.948176 -2.221127 -0.392773
C -4.291666 0.676623 -0.683866
C -3.283948 2.629599 0.333057
C -4.368722 2.003703 -0.347500
C 2.820736 0.579397 0.026976
C 2.990161 -0.805400 0.009458
C 3.910926 1.447297 -0.089039
C 4.279588 -1.331887 -0.119239
C 5.194794 0.910390 -0.227894
C 5.380187 -0.476646 -0.239623
H -0.004473 1.037487 2.157825
H 0.937706 -0.424831 1.807551
H -3.896809 -1.930890 -1.233734
H -1.330399 2.405546 1.172456
H -1.877285 -3.273491 -0.652134
H -5.112000 0.184735 -1.205177
H -3.366530 3.685755 0.588210
H -5.247949 2.596250 -0.592448
H 0.168971 -3.263137 0.369502
H 2.128968 -1.475878 0.089191
H 3.770036 2.528084 -0.070564
H 4.424947 -2.410364 -0.130355
H 6.051830 1.574822 -0.322935
H 6.381479 -0.889848 -0.343113


%chk=000259521-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259521

0 1
S 1.306717 1.251400 -0.347515
O 0.161767 -2.419014 0.306131
C -2.145516 0.508418 0.255609
C -0.959658 -0.292145 0.457260
C -3.356353 -0.107790 -0.254484
C 0.307884 0.296199 1.008384
C -1.011633 -1.655486 0.121562
C -3.350264 -1.506125 -0.564527
C -2.171633 1.917679 0.532570
C -2.199114 -2.269001 -0.385502
C -4.532153 0.689381 -0.444653
C -3.332184 2.670338 0.334516
C -4.527038 2.054550 -0.153827
C 3.004928 0.569515 -0.120743
C 3.245227 -0.822976 -0.014910
C 4.090243 1.479664 -0.126028
C 4.572075 -1.295390 0.101298
C 5.415693 0.995237 -0.033036
C 5.661511 -0.392064 0.087597
H 0.118779 1.029011 1.807134
H 0.982776 -0.484807 1.382676
H -4.264127 -1.971503 -0.950844
H -1.264519 2.417083 0.887719
H -2.198144 -3.339295 -0.630685
H -5.439203 0.206633 -0.828030
H -3.327620 3.744790 0.548897
H -5.429046 2.657555 -0.303171
H 0.001514 -3.366285 0.072633
H 2.405182 -1.526405 -0.036054
H 3.897018 2.555481 -0.194686
H 4.754141 -2.372915 0.187006
H 6.251223 1.704370 -0.041148
H 6.688529 -0.764906 0.169353


