%chk=000113669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113669

0 1
 S    1.480000       1.485800      9.3800001E-02
 N   -1.069800      0.6025000      0.5898000    
 N  -0.4472000       1.229400      -1.636100    
 N    4.344800      -1.375800     -6.8999998E-02
 C   -2.238400     -0.2194000      0.2878000    
 C   -3.179300      0.5606000     -0.6229000    
 C  -0.1787000       1.067800     -0.3757000    
 C  -0.9492000       1.041800       1.978200    
 C   -1.771700      -1.487700     -0.3676000    
 C    2.245600     -0.1318000     -0.1606000    
 C    3.737600     -6.4800002E-02  0.1403000    
 C   -1.973700      -2.708500      0.1420000    
 H   -2.785900     -0.4645000       1.206700    
 H   -4.153700      5.9099998E-02 -0.6669000    
 H   -2.829600      0.6360000      -1.656800    
 H   -3.349900       1.574800     -0.2447000    
 H  -0.2022000      0.4369000       2.502300    
 H   -1.894900      0.9516000       2.523600    
 H  -0.6620000       2.097300       2.035900    
 H   -1.256100      -1.420600      -1.322700    
 H    1.755000     -0.8611000      0.4939000    
 H    2.080800     -0.4450000      -1.197800    
 H    4.233000      0.6581000     -0.5174000    
 H    3.912400      0.2454000       1.177000    
 H   -1.620700      -3.588600     -0.3844000    
 H   -2.489000      -2.852300       1.085200    
 H   0.3933000       1.580500      -2.108300    
 H    3.918500      -2.055800      0.5592000    
 H    5.331700      -1.334600      0.1822000    


%chk=000113669-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000113669

0 1
S 1.545008 1.549797 -0.343722
N -0.917762 0.404446 0.389995
N -0.730096 0.954097 -1.902343
N 4.545414 -1.116156 0.715500
C -2.238253 -0.297969 0.187462
C -3.356310 0.699805 -0.212707
C -0.222824 0.914897 -0.695715
C -0.613776 0.733628 1.792507
C -2.139266 -1.458441 -0.790030
C 2.367124 -0.073436 0.242872
C 3.897871 0.107980 0.218258
C -2.350111 -2.750077 -0.437382
H -2.480989 -0.721775 1.181740
H -4.329731 0.178792 -0.249445
H -3.136639 1.128301 -1.203492
H -3.428872 1.522999 0.522618
H -0.424998 -0.183979 2.382846
H -1.464708 1.273402 2.254956
H 0.271533 1.386357 1.842337
H -1.910909 -1.182098 -1.826224
H 2.011917 -0.300269 1.262881
H 2.064025 -0.884878 -0.436029
H 4.220245 0.277072 -0.825018
H 4.169844 1.025423 0.790683
H -2.303088 -3.559765 -1.174847
H -2.581238 -3.041088 0.596270
H -0.051065 1.245204 -2.623443
H 4.536241 -1.247309 1.728477
H 5.432113 -1.367861 0.277996


