%chk=000070362.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070362

0 1
 S  -0.2618000       2.381700     -0.3266000    
 O   -4.269200     -0.7396000     -0.2879000    
 N   -1.626500      0.1335000      9.8999999E-03
 C   -2.184700     -0.8322000      0.9465000    
 C   -2.272900      0.2011000      -1.293200    
 C   -3.696500     -0.6704000       1.022700    
 C   -3.781400      0.3172000      -1.122100    
 C  -0.5133000      0.8503000      0.2967000    
 C   0.4780000      0.1659000       1.212400    
 C    1.807100     -7.8299999E-02  0.5388000    
 C    2.013600      -1.265300     -0.1455000    
 C    2.795900      0.8893000      0.6177000    
 C    3.241500      -1.490800     -0.7676000    
 C    4.023800      0.6638000     -4.4999998E-03
 C    4.246600     -0.5262000     -0.6972000    
 H   -1.791700     -0.7022000       1.958200    
 H   -1.921500      -1.830000      0.5780000    
 H   -2.038800     -0.7494000      -1.789700    
 H   -1.896600      0.9947000      -1.941500    
 H   -4.132600      -1.474000       1.624200    
 H   -3.974500      0.2843000       1.485400    
 H   -4.061900       1.282000     -0.6831000    
 H   -4.278200      0.2330000      -2.093600    
 H   0.6232000      0.7956000       2.100800    
 H   0.1491000     -0.8023000       1.595400    
 H    1.235900      -2.021100     -0.2084000    
 H    2.641300       1.815300       1.163800    
 H    3.414700      -2.417200      -1.307600    
 H    4.807400       1.413600      5.2600000E-02
 H    5.202800     -0.7020000      -1.181300    


%chk=000070362-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070362

0 1
S -0.703504 3.104915 0.535551
O -3.811624 -0.968993 -0.813744
N -1.445335 0.560112 -0.133155
C -1.425826 -0.924970 -0.110977
C -2.438434 1.088973 -1.102081
C -2.844209 -1.465386 0.173186
C -3.830121 0.506604 -0.798897
C -0.636340 1.382736 0.613885
C 0.390949 0.723448 1.539894
C 1.547384 0.025457 0.813943
C 2.075968 -1.191164 1.314280
C 2.138248 0.604877 -0.338260
C 3.173953 -1.818090 0.681178
C 3.232152 -0.022184 -0.974438
C 3.754514 -1.235825 -0.468389
H -0.715201 -1.298243 0.639151
H -1.087944 -1.284649 -1.103045
H -2.121438 0.796555 -2.122608
H -2.437542 2.190114 -1.024934
H -2.864059 -2.563977 0.083137
H -3.161243 -1.171588 1.197850
H -4.184123 0.868074 0.189927
H -4.552713 0.799158 -1.577474
H 0.792406 1.537955 2.165997
H -0.101972 0.009388 2.229940
H 1.634174 -1.646350 2.210367
H 1.742182 1.551290 -0.725377
H 3.572887 -2.756217 1.083428
H 3.681079 0.437515 -1.862346
H 4.604535 -1.719239 -0.962689


