%chk=000229583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229583

0 1
S 0.522255 0.886037 -0.098298
O -1.000530 0.894002 -0.856516
O 0.357450 1.426897 1.224889
O 1.439760 1.490611 -1.021895
C 0.655246 -0.906704 -0.040085
C -0.809706 -1.364777 0.045914
C -1.767578 -0.265784 -0.486625
C 1.462162 -1.309046 1.186621
C 1.322074 -1.387424 -1.324208
C -2.804799 0.161537 0.541130
H -1.072578 -1.629235 1.090399
H -0.960511 -2.301773 -0.522211
H -2.245532 -0.572708 -1.445372
H 1.442170 -2.397145 1.336193
H 2.520608 -1.027336 1.099313
H 1.079069 -0.849315 2.111908
H 2.309342 -0.924926 -1.479245
H 1.477813 -2.473858 -1.310529
H 0.724413 -1.157409 -2.217786
H -2.337820 0.547579 1.459867
H -3.415129 0.987756 0.147298
H -3.479077 -0.654579 0.815639


%chk=000229583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229583

0 1
S 0.794771 1.060666 -0.014246
O -1.106558 1.228688 0.058215
O 1.377104 1.710473 1.346706
O 1.345406 1.593517 -1.441894
C 0.686847 -1.026232 0.047933
C -0.805623 -1.197410 0.358745
C -1.666493 -0.088803 -0.317053
C 1.634198 -1.409885 1.181561
C 1.125594 -1.471017 -1.345886
C -3.119308 -0.082410 0.169901
H -0.970903 -1.150248 1.450742
H -1.141800 -2.187227 -0.006455
H -1.631390 -0.200354 -1.421434
H 1.503502 -2.485869 1.408606
H 2.690095 -1.242906 0.908121
H 1.424103 -0.835624 2.100266
H 2.122017 -1.075076 -1.603525
H 1.181455 -2.577042 -1.358984
H 0.425580 -1.148273 -2.134108
H -3.160133 0.075195 1.261344
H -3.683718 0.728153 -0.319328
H -3.605645 -1.045915 -0.072827


