%chk=000174029.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174029

0 1
 S    1.920200      0.4207000      9.3000000E-03
 O    1.913500       1.958100     -0.5319000    
 O    2.745200     -0.3838000     -0.8687000    
 O    2.111300      0.4289000       1.445500    
 O  -0.9602000      -1.903300     -0.9890000    
 O   0.4230000      -2.088800      0.7992000    
 O   -2.971300      0.2908000      0.9961000    
 N   -2.466700      0.9917000      -1.136200    
 C   0.2163000      5.9900001E-02 -0.3282000    
 C  -0.7023000      0.9368000      0.5204000    
 C  -7.3399998E-02  -1.406200     -8.6900003E-02
 C   -2.155700      0.6952000      0.1705000    
 H   9.6600004E-02  0.2516000      -1.401600    
 H  -0.4919000       2.002100      0.3739000    
 H  -0.5738000      0.7232000       1.588400    
 H    1.847500       2.064100      -1.510100    
 H   -3.411600      0.8708000      -1.485600    
 H   -1.786600       1.363600      -1.791000    
 H   -1.144500      -2.854200     -0.8340000    


%chk=000174029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174029

0 1
S 1.884314 0.479688 -0.190744
O 2.231147 0.476726 -2.006693
O 2.808567 -0.619452 0.547724
O 1.904579 2.005942 0.349574
O 0.495564 -2.392151 -0.810161
O -0.688361 -1.866797 1.127032
O -2.265771 0.868361 -1.807726
N -3.262621 1.645975 0.140511
C -0.025889 -0.095864 -0.444867
C -0.917512 0.908224 0.260127
C -0.123296 -1.517931 0.068510
C -2.203385 1.123626 -0.570652
H -0.105186 -0.047452 -1.545526
H -0.398056 1.885889 0.339800
H -1.150819 0.563070 1.282439
H 3.208255 0.648648 -2.138999
H -4.130967 1.846198 -0.355989
H -3.209679 1.826697 1.141625
H 0.484715 -3.318196 -0.445885


