%chk=000221428.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221428

0 1
S 0.476681 0.017854 0.335195
O 5.426733 0.061247 1.157109
O 4.937203 -0.065663 -1.022554
C -0.650125 -0.072042 -1.097157
C -2.016908 -0.030166 -0.496034
C 2.112090 -0.038124 -0.469151
C 3.131319 0.036898 0.655102
C -2.660175 1.201123 -0.290008
C -2.665315 -1.221811 -0.132901
C -3.940232 1.236225 0.268697
C -3.945353 -1.179060 0.425312
C -4.585678 0.048025 0.625809
C 4.529603 0.001754 0.111781
H -0.472295 -0.999587 -1.673750
H -0.468288 0.772883 -1.788144
H 2.226857 -0.968357 -1.058539
H 2.228850 0.804055 -1.178439
H 2.999325 0.961809 1.267604
H 2.999868 -0.798758 1.384727
H -2.160346 2.130362 -0.558398
H -2.169484 -2.180030 -0.278899
H -4.435262 2.193001 0.427829
H -4.444375 -2.105173 0.706539
H -5.582664 0.078327 1.060531
H 6.373371 0.041710 0.853737


%chk=000221428-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221428

0 1
S 0.533864 0.018967 0.626761
O 5.708455 0.061364 0.970040
O 4.911851 -0.038196 -1.209346
C -0.643193 -0.089371 -0.883269
C -2.080036 -0.041222 -0.423068
C 2.172242 -0.021990 -0.322425
C 3.321377 0.036594 0.692773
C -2.747754 1.201615 -0.270341
C -2.784099 -1.236517 -0.124805
C -4.090447 1.249468 0.165234
C -4.127150 -1.191703 0.310676
C -4.784808 0.051984 0.456443
C 4.679663 0.013392 0.017926
H -0.409615 -1.034096 -1.402812
H -0.394761 0.761196 -1.540632
H 2.217772 -0.950324 -0.916105
H 2.209043 0.839376 -1.010091
H 3.259108 0.951488 1.312955
H 3.271491 -0.812569 1.400997
H -2.210177 2.131662 -0.491064
H -2.275375 -2.202083 -0.232478
H -4.594178 2.216240 0.276190
H -4.659546 -2.122863 0.534807
H -5.827028 0.087494 0.792891
H 6.588702 0.046596 0.504739


