%chk=000018914.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018914

0 1
 S    1.121900      -2.151800     -0.2151000    
 S   -1.855000      -1.751800      0.2009000    
 S   -2.970000      0.1917000       2.158600    
 N   -3.204400      0.4919000     -0.5713000    
 N   3.8300000E-02  0.1385000      0.2669000    
 C    2.165600     -0.7821000     -0.1283000    
 C    1.402000      0.3584000      0.1384000    
 C  -0.2189000      -1.137800      0.1007000    
 C    3.559600     -0.7211000     -0.2850000    
 C    2.059300       1.602700      0.2520000    
 C    4.185400      0.5226000     -0.1679000    
 C    3.446900       1.670700      9.7099997E-02
 C   -2.739800     -0.2408000      0.5392000    
 C   -3.956000       1.739900     -0.4222000    
 C   -3.035100      6.8899997E-02  -1.964000    
 H    4.142700      -1.613300     -0.4920000    
 H    1.491900       2.505700      0.4586000    
 H    5.263600      0.5919000     -0.2857000    
 H    3.950800       2.629300      0.1847000    
 H   -5.007200       1.536300     -0.6481000    
 H   -3.567900       2.471400      -1.138400    
 H   -3.886300       2.177500      0.5737000    
 H   -2.195400      0.6273000      -2.388400    
 H   -3.945100      0.3068000      -2.524500    
 H   -2.851600     -0.9993000      -2.076000    


%chk=000018914-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018914

0 1
S 1.148654 -2.317508 0.202210
S -1.946596 -1.936553 0.091726
S -3.844504 -0.438977 2.000865
N -3.210406 0.489563 -0.487502
N -0.025495 0.093059 -0.164294
C 2.185039 -0.836991 0.016871
C 1.366489 0.328410 -0.153768
C -0.312266 -1.177432 0.000566
C 3.590080 -0.755440 0.034472
C 1.977543 1.595335 -0.303466
C 4.183302 0.519174 -0.117772
C 3.383975 1.681515 -0.284478
C -3.070871 -0.444163 0.494996
C -3.990642 1.711658 -0.175874
C -2.650045 0.409365 -1.853531
H 4.212602 -1.645624 0.165353
H 1.349054 2.482235 -0.427206
H 5.274814 0.607207 -0.103932
H 3.867890 2.657314 -0.398249
H -5.067493 1.474441 -0.098207
H -3.824090 2.451699 -0.974326
H -3.666806 2.123747 0.794773
H -1.758150 1.054194 -1.935791
H -3.419835 0.732765 -2.576050
H -2.356946 -0.625493 -2.083486


