%chk=000095799.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095799

0 1
 S   -4.234400     -1.9500000E-02 -6.7199998E-02
 O   -4.680300      0.3885000       1.451900    
 O   -4.678100       1.055200     -0.9429000    
 O   -4.651800      -1.392100     -0.3070000    
 N    5.948100      1.1800000E-02  3.4000002E-02
 C   0.3012000     -6.0000001E-03 -2.1100000E-02
 C    1.748100     -1.5000000E-03 -5.9000002E-03
 C   -2.488300     -1.4500000E-02 -4.9300000E-02
 C  -0.3963000       1.158500     -0.3416000    
 C  -0.3957000      -1.174800      0.2852000    
 C   -1.791100       1.154200     -0.3556000    
 C   -1.790500      -1.178900      0.2711000    
 C    2.438700       1.167400      0.3139000    
 C    2.452100      -1.166000     -0.3126000    
 C    3.833500       1.171800      0.3267000    
 C    3.847000      -1.161400     -0.2996000    
 C    4.537600      7.4000000E-03  1.9900000E-02
 H   0.1033000       2.083800     -0.6151000    
 H   0.1040000      -2.096100      0.5721000    
 H   -2.314000       2.072500     -0.6074000    
 H   -2.312200      -2.096800      0.5272000    
 H    1.933700       2.089200      0.5891000    
 H    1.958300      -2.090900     -0.5973000    
 H    4.360800       2.086900      0.5840000    
 H    4.384900      -2.073200     -0.5467000    
 H    6.459100     -0.8317000     -0.1899000    
 H    6.449300      0.8596000      0.2640000    
 H   -4.391100       1.282300       1.751700    


%chk=000095799-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095799

0 1
S -4.331044 0.061868 -0.092713
O -4.576960 0.564866 1.685999
O -4.874367 1.263152 -1.033082
O -4.900723 -1.443111 -0.274594
N 6.091750 -0.033594 0.021420
C 0.337456 0.024082 -0.027035
C 1.820501 0.009092 -0.015326
C -2.471466 0.051974 -0.052491
C -0.383193 1.209244 -0.363585
C -0.412325 -1.147844 0.290926
C -1.790312 1.237886 -0.374168
C -1.819765 -1.146708 0.282348
C 2.573526 1.185275 0.265485
C 2.554589 -1.181963 -0.283149
C 3.976914 1.179098 0.283513
C 3.957915 -1.203977 -0.277005
C 4.700366 -0.019778 0.009516
H 0.163082 2.112695 -0.651980
H 0.110703 -2.063650 0.583472
H -2.343474 2.140971 -0.649953
H -2.395567 -2.045461 0.523754
H 2.052369 2.116971 0.512962
H 2.019407 -2.103185 -0.539679
H 4.523343 2.099977 0.520600
H 4.489761 -2.135633 -0.504940
H 6.607146 -0.888586 -0.167183
H 6.620671 0.811308 0.217865
H -5.564402 0.630733 1.840622


