%chk=000124000.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124000

0 1
 S    2.571500      0.4914000      -1.243000    
 O   -4.774300      0.1592000      0.1206000    
 O   -2.429200      -1.919300     -0.4000000    
 O   0.4006000      -2.662500       1.189900    
 O    1.658600      -2.583100     -0.7184000    
 N  -0.8412000     -0.3960000      0.4555000    
 N    5.807800       1.386800       1.029300    
 C   -1.107800       1.050600      0.2965000    
 C   -2.464200      0.6356000     -0.3354000    
 C   8.9900002E-02   1.571300     -0.5061000    
 C   -2.006000     -0.8227000     -0.1112000    
 C   -3.693400       1.034100      0.4455000    
 C   0.4136000     -0.6912000      3.7000000E-03
 C    1.013000      0.3791000     -0.5327000    
 C   -4.123500       2.468600      0.1557000    
 C   0.9051000      -2.063300      8.9000002E-02
 C    3.553400      0.9195000      0.2157000    
 C    5.026200       1.042000     -0.1545000    
 H   -1.189800       1.538700       1.277100    
 H   -2.545100      0.8646000      -1.406300    
 H   0.5542000       2.422400      3.5000001E-03
 H  -0.2045000       1.872400      -1.516900    
 H   -3.524300      0.9348000       1.524500    
 H   -4.368400       2.594300     -0.9049000    
 H   -5.025600       2.721200      0.7227000    
 H   -3.332300       3.179600      0.4120000    
 H   -4.551700     -0.7249000      0.4580000    
 H    3.183700       1.865500      0.6276000    
 H    3.419200      0.1436000      0.9785000    
 H    5.403600      9.5799997E-02 -0.5583000    
 H    5.173500       1.817500     -0.9149000    
 H   0.7103000      -3.589000       1.279500    
 H    5.492400       2.282400       1.400000    
 H    6.783300       1.515400      0.7637000    


%chk=000124000-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124000

0 1
S 2.925383 -0.479335 -0.045947
O -4.725688 0.906453 -0.588226
O -2.839223 -1.634542 -1.167360
O -0.461680 -3.657374 0.396586
O 1.802803 -3.250339 -0.010584
N -1.067131 -0.907486 0.379714
N 5.464674 2.787033 0.047822
C -1.033317 0.581553 0.645741
C -2.304036 0.735700 -0.263411
C 0.390892 1.008112 0.191435
C -2.188247 -0.803572 -0.505143
C -3.638727 1.189796 0.363036
C 0.272481 -1.401849 0.232690
C 1.150962 -0.329267 0.153110
C -3.697146 2.691946 0.651644
C 0.635464 -2.815198 0.189133
C 3.481394 1.340966 0.140485
C 5.007370 1.395825 -0.080816
H -1.208241 0.810360 1.711045
H -2.123376 1.300113 -1.195943
H 0.843060 1.730110 0.891043
H 0.400974 1.472709 -0.815894
H -3.799659 0.617626 1.305002
H -3.555023 3.266109 -0.280990
H -4.684499 2.954470 1.067997
H -2.919761 2.988195 1.379459
H -4.649470 -0.036731 -0.896315
H 2.956527 1.952192 -0.612551
H 3.236982 1.698915 1.152876
H 5.507021 0.786664 0.694453
H 5.255232 0.931838 -1.061947
H -0.157989 -4.601946 0.324511
H 5.349551 3.375769 -0.778634
H 6.351042 2.929585 0.531879


