%chk=000070497.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070497

0 1
 S    2.428800      -1.149600     -0.3181000    
 N   0.6737000      0.8562000     -0.1610000    
 N  -0.2184000      -1.379900     -5.7700001E-02
 N  -0.7957000       2.725200     -3.2800000E-02
 N   -2.565000      -1.709500      0.1745000    
 C  -0.5860000       1.324600     -4.1700002E-02
 C   -1.450700     -0.8430000      5.8499999E-02
 C   -1.697200      0.5147000      7.2800003E-02
 C   0.7833000     -0.4859000     -0.1617000    
 C    3.427300      0.1473000      0.4671000    
 H   -2.699400      0.9173000      0.1669000    
 H   2.4800001E-02   3.313200     -0.1113000    
 H   -1.600900       3.089100      0.4618000    
 H   -3.049300      -1.634800       1.065000    
 H   -3.214500      -1.646100     -0.6047000    
 H    3.074600      0.3391000       1.484200    
 H    3.387300       1.071400     -0.1159000    
 H    4.467800     -0.1847000      0.5164000    


%chk=000070497-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070497

0 1
S 2.331414 -1.304272 0.111494
N 0.647731 0.863123 0.207726
N -0.344551 -1.357534 0.052326
N -0.658689 2.793412 0.298346
N -2.652014 -1.676401 -0.013383
C -0.616349 1.415367 0.214189
C -1.597571 -0.788939 0.060121
C -1.787362 0.618568 0.140994
C 0.698174 -0.490575 0.126452
C 3.464995 0.190810 0.217863
H -2.786660 1.062652 0.147089
H 0.225155 3.294529 0.350937
H -1.537300 3.302175 0.316205
H -3.618156 -1.363591 -0.012842
H -2.434288 -2.669231 -0.067442
H 3.262229 0.747707 1.143139
H 3.305149 0.843812 -0.651344
H 4.488595 -0.217012 0.220428


