%chk=000074296.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074296

0 1
 S   0.8218000      -1.866000     -0.1080000    
 O    1.766100      -2.703200      0.6083000    
 O   0.4450000      -2.205200      -1.466800    
 N  -0.5875000      -1.655100      0.8600000    
 C    1.498300     -0.2306000     -0.1272000    
 C   -1.519300     -0.6332000      0.5052000    
 C    2.398200      0.1373000      0.8564000    
 C    1.112100      0.6464000      -1.124300    
 C   -2.143900     -0.6614000     -0.7418000    
 C   -1.805700      0.3927000       1.405600    
 C    2.930300       1.426700      0.8424000    
 C    1.644200       1.935700      -1.138400    
 C    2.553300       2.325800     -0.1550000    
 C   -3.054900      0.3367000      -1.088200    
 C   -2.716700       1.390700       1.059300    
 C   -3.341200       1.362600     -0.1877000    
 H  -0.4619000      -1.793800       1.871400    
 H    2.697500     -0.5447000       1.646000    
 H   0.4127000      0.3625000      -1.903800    
 H   -1.961700      -1.463400      -1.450100    
 H   -1.323700      0.4260000       2.379300    
 H    3.636500       1.731300       1.609300    
 H    1.351800       2.635500      -1.915800    
 H    2.967300       3.329800     -0.1657000    
 H   -3.546000      0.3116000      -2.056600    
 H   -2.939400       2.189800       1.760200    
 H   -4.051500       2.138900     -0.4569000    


%chk=000074296-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000074296

0 1
S 0.841342 -1.811152 -0.133187
O 1.767192 -2.817831 0.744053
O 0.361172 -2.126594 -1.649429
N -0.787664 -1.677489 0.913313
C 1.683683 -0.109360 -0.151341
C -1.713108 -0.662720 0.544469
C 2.640150 0.154087 0.843905
C 1.319536 0.801798 -1.156800
C -2.374183 -0.762005 -0.713233
C -2.029974 0.410227 1.426027
C 3.265198 1.422416 0.828335
C 1.953146 2.066580 -1.149403
C 2.916696 2.374332 -0.159925
C -3.335640 0.203100 -1.072979
C -3.024580 1.345683 1.070563
C -3.672869 1.253522 -0.183636
H -0.451783 -1.632775 1.892287
H 2.905226 -0.615322 1.576709
H 0.590322 0.523662 -1.923916
H -2.129631 -1.597780 -1.375081
H -1.509581 0.496825 2.388475
H 4.024423 1.661601 1.580139
H 1.696939 2.803399 -1.917546
H 3.405459 3.354561 -0.164833
H -3.841560 0.123445 -2.041452
H -3.281790 2.153683 1.764330
H -4.436420 1.987510 -0.462743


