%chk=000100962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100962

0 1
 S    2.541700      0.8299000     -1.9000000E-03
 N   -3.641600      0.4275000     -6.2000002E-03
 C  -0.1585000      0.2855000      1.4300000E-02
 C    1.205000     -0.3992000     -1.7700000E-02
 C   -1.288700     -0.7455000      7.7000000E-03
 C    3.945000     -0.3091000      3.8999999E-03
 C   -2.602800     -8.9299999E-02 -9.9999997E-05
 H  -0.2458000      0.9146000      0.9102000    
 H  -0.2659000      0.9495000     -0.8539000    
 H    1.297800      -1.009800     -0.9219000    
 H    1.315300      -1.052400      0.8543000    
 H   -1.199600      -1.389900     -0.8745000    
 H   -1.207400      -1.392300      0.8889000    
 H    3.930800     -0.9362000     -0.8913000    
 H    3.920700     -0.9399000      0.8962000    
 H    4.875000      0.2654000      1.0400000E-02


%chk=000100962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100962

0 1
S 2.566674 0.853394 0.020064
N -3.732779 0.457647 0.005337
C -0.174595 0.284536 0.008888
C 1.182363 -0.439674 0.002174
C -1.348413 -0.737861 -0.002024
C 4.045206 -0.311732 -0.002636
C -2.668867 -0.084198 0.002776
H -0.254278 0.926051 0.905400
H -0.253180 0.944273 -0.874306
H 1.300282 -1.058908 -0.905992
H 1.297535 -1.081093 0.895171
H -1.280219 -1.385616 -0.897791
H -1.282311 -1.402063 0.881769
H 4.037168 -0.926288 -0.917312
H 4.042784 -0.954692 0.892342
H 4.943631 0.325022 0.004540


