%chk=000155065.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155065

1 1
 S   -3.703800      0.4845000       1.890700    
 S   -5.031300      0.7600000     -0.7927000    
 N  -0.3036000      -1.030000     -0.1527000    
 C   0.9625000     -0.5794000     -6.8700001E-02
 C    1.199900      0.8116000     -0.1320000    
 C   -1.359400     -0.2178000     -0.2952000    
 C   0.1034000       1.671800     -0.2811000    
 C   -1.184700       1.154400     -0.3633000    
 C    2.027400      -1.473500      7.9200000E-02
 C    2.521000       1.277900     -4.3699998E-02
 C   -2.735000     -0.7913000     -0.3824000    
 C    3.579500      0.3790000      0.1035000    
 C  -0.5776000      -2.475000     -8.9299999E-02
 C    3.333100     -0.9921000      0.1648000    
 C    4.979300      0.8870000      0.1940000    
 C   -3.810800      0.1330000      0.1689000    
 H   0.2473000       2.748100     -0.3395000    
 H   -2.004700       1.849400     -0.5042000    
 H    1.918100      -2.546600      0.1752000    
 H    2.723700       2.346200     -9.2699997E-02
 H   -2.849300      -1.699100      0.2211000    
 H   -2.946900      -1.050200      -1.426600    
 H  -0.7125000      -2.753900      0.9586000    
 H   -1.441300      -2.753600     -0.6957000    
 H   0.2194000      -3.054500     -0.5559000    
 H    4.152500      -1.696100      0.2860000    
 H    5.012800       1.863500      0.6891000    
 H    5.610100      0.2097000      0.7797000    
 H    5.408400      0.9859000     -0.8081000    
 H   -4.778100       1.284000       1.958100    


%chk=000155065-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155065

1 1
S -4.593257 0.643287 1.503312
S -4.433312 0.893231 -1.590897
N -0.332308 -1.101892 -0.043657
C 1.000815 -0.626405 -0.029814
C 1.239457 0.794059 0.063992
C -1.410887 -0.244179 0.007886
C 0.115190 1.667404 0.133657
C -1.180758 1.153208 0.099987
C 2.116074 -1.508616 -0.107433
C 2.582561 1.285766 0.083227
C -2.823709 -0.818579 -0.037162
C 3.681057 0.420872 0.010001
C -0.521670 -2.581552 -0.117999
C 3.413904 -0.987250 -0.087928
C 5.106919 0.923284 0.029164
C -3.928321 0.239506 -0.131457
H 0.275923 2.747882 0.209019
H -2.045806 1.815593 0.141076
H 1.988463 -2.589404 -0.188392
H 2.738473 2.367900 0.155440
H -2.991595 -1.458962 0.852932
H -2.934081 -1.461232 -0.930343
H 0.006605 -3.062639 0.720363
H -1.581685 -2.844125 -0.049996
H -0.124757 -2.960972 -1.073752
H 4.260966 -1.679788 -0.151109
H 5.156287 2.021532 0.099430
H 5.663736 0.502653 0.886810
H 5.647903 0.616480 -0.884903
H -5.532788 1.565839 1.073648


