%chk=000095532.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095532

0 1
 S    1.032100       1.837100     -0.3582000    
 O    1.192400      -2.012800     -0.6923000    
 N  -0.6692000     -0.7864000     -0.2715000    
 C   -1.346800      0.4423000      0.1028000    
 C    1.564400      0.1853000      0.2436000    
 C  -0.7468000       1.609700     -0.6632000    
 C   -2.843000      0.3264000     -0.1832000    
 C   0.6962000     -0.9524000     -0.3011000    
 C    1.574100      0.1619000       1.777300    
 C    3.010900      1.8000000E-03 -0.2525000    
 C   -3.464400     -0.8129000      0.5983000    
 H   -1.215700      0.5894000       1.179300    
 H  -0.8734000       1.469200      -1.743100    
 H   -1.250800       2.545200     -0.3983000    
 H   -3.022400      0.1658000      -1.253400    
 H   -3.344200       1.262300      9.1600001E-02
 H   -1.223400      -1.569300     -0.6032000    
 H    1.900900     -0.8194000       2.143000    
 H    2.264500      0.9080000       2.188500    
 H   0.5915000      0.3430000       2.219500    
 H    3.063000     -2.6000001E-02  -1.348000    
 H    3.673200      0.8008000      0.1022000    
 H    3.433000     -0.9445000      0.1078000    
 H   -3.115000      -1.793500      0.2632000    
 H   -3.257300     -0.7199000       1.669400    
 H   -4.552000     -0.7997000      0.4693000    


%chk=000095532-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095532

0 1
S 1.060820 1.928276 -0.324569
O 1.231911 -2.042360 -0.769626
N -0.634719 -0.769323 -0.295033
C -1.358863 0.463233 0.082970
C 1.631605 0.156214 0.254695
C -0.776832 1.660237 -0.691926
C -2.870209 0.283975 -0.205274
C 0.737204 -0.958449 -0.329676
C 1.591672 0.092458 1.804088
C 3.075515 0.005002 -0.260309
C -3.547629 -0.797154 0.666495
H -1.237363 0.657624 1.169531
H -0.900969 1.505084 -1.777180
H -1.278331 2.594984 -0.388873
H -3.006625 0.052636 -1.281287
H -3.365619 1.257136 -0.026437
H -1.180010 -1.562700 -0.644600
H 1.978207 -0.887390 2.144273
H 2.228156 0.888687 2.227139
H 0.572920 0.223747 2.205044
H 3.110476 0.036802 -1.360899
H 3.710589 0.815523 0.140836
H 3.483833 -0.967104 0.065162
H -3.115494 -1.801737 0.503544
H -3.442109 -0.561915 1.741536
H -4.626336 -0.862088 0.438176


