%chk=000066583.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066583

0 1
 S   -1.509700       1.982400      8.2699999E-02
 O   -1.131500       2.568900      -1.392400    
 O   -2.672600      -2.947600     -4.8000002E-03
 O   -2.957500       1.995100      0.1939000    
 O  -0.6755000       2.645900       1.067600    
 N    3.748600       1.443600      1.3900000E-02
 C   0.3553000     -8.0899999E-02  2.0400001E-02
 C  -0.9958000      0.3018000      4.3900002E-02
 C   0.6845000      -1.456900     -1.2500000E-02
 C    1.386900      0.8720000      2.8300000E-02
 C   -2.008000     -0.6584000      3.5399999E-02
 C  -0.3473000      -2.409700     -2.0600000E-02
 C    2.035600      -1.839400     -3.6300000E-02
 C   -1.684400      -2.011700      3.5000001E-03
 C    2.723900      0.4741000      4.6999999E-03
 C    3.047600     -0.8791000     -2.7700000E-02
 H    1.205900       1.939700      2.9000000E-03
 H   -3.059700     -0.3875000      4.9899999E-02
 H  -0.1036000      -3.470500     -4.5899998E-02
 H    2.311900      -2.891500     -6.1700001E-02
 H    4.085600      -1.201500     -4.6300001E-02
 H    3.515900       2.427400      3.8500000E-02
 H    4.717900       1.155300     -3.1000001E-03
 H   -1.586400       2.133200      -2.151000    
 H   -2.269500      -3.832600     -2.8100001E-02


%chk=000066583-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066583

0 1
S -1.644311 1.960692 0.039455
O -1.251599 2.323426 -1.748633
O -2.728923 -3.045853 0.037791
O -3.250903 1.964623 0.235808
O -0.744360 2.968134 0.936199
N 3.813273 1.418755 -0.002142
C 0.394670 -0.096148 0.016286
C -1.010988 0.190841 0.029307
C 0.721821 -1.516862 0.005033
C 1.435567 0.874694 0.013829
C -2.024945 -0.759044 0.031573
C -0.310048 -2.503252 0.009988
C 2.108150 -1.884274 -0.014576
C -1.660675 -2.135379 0.027742
C 2.787817 0.478649 -0.003085
C 3.113156 -0.925295 -0.019289
H 1.181464 1.938385 0.043448
H -3.080512 -0.470979 0.043289
H -0.023560 -3.563271 0.001936
H 2.370333 -2.948622 -0.025234
H 4.166253 -1.231308 -0.033651
H 3.604994 2.413119 0.022624
H 4.787405 1.131573 -0.007099
H -1.533185 3.269173 -1.921319
H -2.402794 -3.979677 0.035921


