%chk=000101004.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101004

0 1
 S  -0.3426000      -1.087900     -0.2063000    
 O   -3.434200      0.9319000     -0.7256000    
 N    1.543400      0.7694000      0.2102000    
 N    3.670000     -0.9960000     -0.2663000    
 C   -1.268400      0.4251000      0.1837000    
 C   -2.749400      0.1793000      0.1538000    
 C   -3.543900     -0.6668000      0.8505000    
 C    1.339400     -0.5256000     -0.1030000    
 C    3.874000      0.2990000      4.7100000E-02
 C   -4.852300     -0.4272000      0.3669000    
 C    2.383900      -1.392700     -0.3371000    
 C   -4.732300      0.5536000     -0.5900000    
 C    2.829400       1.166000      0.2813000    
 C    5.283100      0.7720000      0.1347000    
 H   -1.007800       1.206000     -0.5393000    
 H  -0.9925000      0.7769000       1.183900    
 H   -3.245200      -1.371500       1.613000    
 H   -5.768400     -0.9087000      0.6774000    
 H    2.236300      -2.436600     -0.5899000    
 H   -5.437200       1.063600      -1.230400    
 H    2.985000       2.208300      0.5337000    
 H    5.984700     -4.0800001E-02 -7.9800002E-02
 H    5.462000       1.572600     -0.5900000    
 H    5.497500       1.146200       1.140700    


%chk=000101004-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101004

0 1
S -0.353602 -1.134713 -0.354418
O -3.380741 0.509393 -0.985817
N 1.577159 0.712734 0.358752
N 3.722298 -0.912092 -0.544727
C -1.314191 0.380071 0.359241
C -2.774484 0.167384 0.248320
C -3.749593 -0.313218 1.112927
C 1.351241 -0.512420 -0.191404
C 3.963763 0.325963 0.009083
C -5.013471 -0.271451 0.408916
C 2.432095 -1.323228 -0.643805
C -4.750390 0.229478 -0.854988
C 2.875862 1.120537 0.452342
C 5.399817 0.783580 0.117060
H -0.966644 1.253794 -0.210936
H -0.994445 0.484230 1.405271
H -3.580920 -0.657884 2.131369
H -5.986081 -0.572043 0.792868
H 2.258105 -2.308345 -1.089244
H -5.360227 0.446331 -1.727394
H 3.040738 2.108820 0.895517
H 6.062774 -0.002587 -0.276273
H 5.573700 1.711056 -0.459456
H 5.681737 0.990711 1.165995


