%chk=000158749.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158749

0 1
 S   -2.796500     -0.7171000      0.6816000    
 N    1.580700     -0.9882000     -0.3043000    
 C   0.7704000      5.6899998E-02 -0.9943000    
 C  -0.6998000      4.4999998E-03 -0.6169000    
 C    1.351600       1.440700     -0.6741000    
 C   -1.118000     -0.8291000      0.4100000    
 C    1.030200      -1.725200      0.7440000    
 C   -1.786200      0.7200000      -1.199000    
 C  -0.2537000      -1.687900       1.142000    
 C    2.961700      -1.171000     -0.7283000    
 C    1.295800       1.716800      0.7932000    
 C   -2.983100      0.4233000     -0.5837000    
 C   0.6471000       2.756300       1.329800    
 H   0.8394000     -0.1184000      -2.076200    
 H   0.8111000       2.213200      -1.236200    
 H    2.397200       1.503400     -0.9984000    
 H    1.744500      -2.377600       1.234600    
 H   -1.697200       1.420300      -2.019400    
 H  -0.6137000      -2.299000       1.961600    
 H    3.122000     -0.7956000      -1.744400    
 H    3.231900      -2.232600     -0.7268000    
 H    3.638800     -0.6401000     -5.1600002E-02
 H    1.857700       1.071300       1.462900    
 H   -3.960200      0.8227000     -0.8162000    
 H   0.6646000       2.920500       2.401700    
 H   8.8799998E-02   3.455500      0.7171000    


%chk=000158749-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158749

0 1
S -2.911209 -0.741997 0.669418
N 1.546359 -1.034595 -0.348079
C 0.773060 0.086527 -0.965824
C -0.703136 -0.053847 -0.628190
C 1.349754 1.497301 -0.564092
C -1.120612 -0.838747 0.450966
C 1.081586 -1.742423 0.754925
C -1.781793 0.625752 -1.294053
C -0.220246 -1.666944 1.214581
C 2.909117 -1.243828 -0.849031
C 1.291681 1.789798 0.918124
C -3.028281 0.378480 -0.737655
C 0.716639 2.885289 1.473668
H 0.913120 0.004614 -2.067721
H 0.783569 2.264971 -1.125960
H 2.400808 1.550013 -0.920349
H 1.811242 -2.408575 1.227007
H -1.644413 1.282388 -2.158393
H -0.538409 -2.254016 2.076728
H 2.909285 -1.220671 -1.956141
H 3.280743 -2.232680 -0.531227
H 3.624434 -0.473532 -0.492838
H 1.752028 1.035850 1.574557
H -4.003718 0.760990 -1.030230
H 0.703101 3.039301 2.558527
H 0.230390 3.654181 0.859980


