%chk=000013304.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013304

0 1
 S    2.680300      -1.596800       1.058600    
 N   -4.479500       1.543600      0.5425000    
 C   0.1470000      0.4428000      0.1191000    
 C  -0.3862000     -0.8885000     -0.2294000    
 C   1.0700000E-02  -2.007400      0.5212000    
 C    1.567900      0.8430000     -5.3800002E-02
 C   0.9839000      -1.847300       1.655200    
 C  -0.7171000       1.296400      0.7026000    
 C    2.675400      4.2700000E-02  0.3072000    
 C   -2.143300      0.9593000      0.9998000    
 C   -1.279500      -1.044700      -1.299200    
 C  -0.4921000      -3.272100      0.1846000    
 C   -3.093500       1.898200      0.2576000    
 C    1.811100       2.090700     -0.6743000    
 C    3.975600      0.5328000      5.2600000E-02
 C   -1.775000      -2.307800      -1.620500    
 C   -1.382000      -3.419800     -0.8798000    
 C    3.104100       2.553800     -0.9114000    
 C    4.188500       1.774500     -0.5444000    
 C   -5.396500       2.406600     -0.1883000    
 H   0.6868000      -1.036900       2.330300    
 H   0.9879000      -2.754400       2.270700    
 H  -0.3862000       2.279700       1.031200    
 H   -2.284000       1.104000       2.080500    
 H   -2.431900     -7.9700001E-02  0.8262000    
 H   -1.589200     -0.1899000      -1.895600    
 H   -2.899600       2.936200      0.5570000    
 H   -2.907600       1.822400     -0.8211000    
 H  -0.1922000      -4.151800      0.7483000    
 H   0.9833000       2.721300     -0.9957000    
 H    4.854200     -5.4499999E-02  0.3178000    
 H   -2.465400      -2.424600      -2.450800    
 H   -1.766400      -4.403700      -1.132300    
 H    3.258700       3.517500      -1.387100    
 H    5.200100       2.124300     -0.7270000    
 H   -4.656100       1.630100       1.543000    
 H   -5.272600       3.456900      9.5100001E-02
 H   -6.427400       2.116800      3.7900001E-02
 H   -5.257600       2.308100      -1.269800    


%chk=000013304-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013304

0 1
S 2.781418 -1.569359 1.257923
N -4.579103 1.844485 0.612553
C 0.093845 0.369378 0.281034
C -0.336399 -1.000967 -0.164390
C 0.102015 -2.156856 0.542904
C 1.517671 0.784929 0.023020
C 0.983632 -1.967786 1.745683
C -0.793001 1.266710 0.813613
C 2.686510 0.032808 0.353589
C -2.266522 1.047822 1.071088
C -1.164903 -1.161901 -1.302646
C -0.291907 -3.442978 0.101642
C -3.158893 2.014028 0.250743
C 1.712855 2.032069 -0.644872
C 3.973856 0.527964 0.011410
C -1.558288 -2.447953 -1.735889
C -1.119932 -3.593315 -1.032560
C 2.988777 2.527265 -0.973380
C 4.131899 1.762303 -0.645775
C -5.513278 2.697353 -0.144013
H 0.637992 -1.150310 2.398259
H 1.092641 -2.888535 2.341436
H -0.400846 2.251934 1.110022
H -2.470676 1.227160 2.149987
H -2.571259 0.010623 0.852299
H -1.492879 -0.272096 -1.851598
H -2.794818 3.065441 0.392446
H -3.048304 1.785386 -0.827876
H 0.052363 -4.327950 0.650202
H 0.821288 2.599215 -0.933607
H 4.858772 -0.061585 0.278646
H -2.200383 -2.554973 -2.617088
H -1.421075 -4.593029 -1.364515
H 3.089704 3.486280 -1.492484
H 5.136206 2.118964 -0.898853
H -4.719921 1.918935 1.629013
H -5.298698 3.793084 -0.075790
H -6.545130 2.526457 0.210853
H -5.480630 2.420800 -1.214528


