%chk=000047466.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047466

0 1
 N  -0.7061000       1.636900     -0.1414000    
 C   0.9384000     -9.6400000E-02  0.1414000    
 C    2.290800     -0.4660000      0.2454000    
 C   0.5800000       1.250300     -3.8699999E-02
 C    2.714100      -1.888900      0.4379000    
 C  -9.0700001E-02  -1.040800      0.2121000    
 C   -1.427800     -0.6451000      0.1056000    
 C   -1.693600      0.7231000     -7.2800003E-02
 C    3.291600      0.4983000      0.1708000    
 C    1.600200       2.195300     -0.1099000    
 C    2.945200       1.831600     -7.1000000E-03
 C   -2.481900      -1.572700      0.1729000    
 C    2.937600      -2.606800     -0.8881000    
 C   -3.022800       1.123400     -0.1792000    
 C   -3.802200      -1.146600      6.3600004E-02
 C   -4.072900      0.2043000     -0.1126000    
 H    3.656700      -1.910600       1.002200    
 H    2.019200      -2.448500       1.072100    
 H   0.1132000      -2.100900      0.3357000    
 H    4.341100      0.2274000      0.2465000    
 H    1.354400       3.246500     -0.2492000    
 H    3.718200       2.592100     -6.7299999E-02
 H   -2.280000      -2.632600      0.3110000    
 H    2.017800      -2.646800      -1.480800    
 H    3.269900      -3.634300     -0.7091000    
 H    3.702900      -2.103900      -1.489100    
 H   -3.260800       2.176500     -0.3179000    
 H   -4.614300      -1.865100      0.1160000    
 H   -5.099700      0.5474000     -0.1990000    


%chk=000047466-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047466

0 1
N -0.713663 1.680781 -0.147096
C 0.981034 -0.126467 0.163307
C 2.388524 -0.466435 0.283495
C 0.590780 1.273530 -0.027274
C 2.841309 -1.911969 0.440648
C -0.062501 -1.083078 0.227096
C -1.416628 -0.687334 0.105200
C -1.700311 0.732081 -0.086181
C 3.331464 0.561152 0.221297
C 1.611363 2.285337 -0.090885
C 2.950242 1.933618 0.032179
C -2.513772 -1.617357 0.161703
C 2.838015 -2.697166 -0.900542
C -3.070169 1.156125 -0.214097
C -3.825872 -1.171897 0.034246
C -4.105354 0.227807 -0.155683
H 3.866053 -1.923771 0.855888
H 2.204487 -2.442408 1.174970
H 0.167201 -2.144284 0.375178
H 4.395881 0.315008 0.318892
H 1.286384 3.319863 -0.234956
H 3.728780 2.703296 -0.011833
H -2.298072 -2.683229 0.306334
H 1.831058 -2.718892 -1.353889
H 3.168221 -3.740441 -0.744067
H 3.520845 -2.225302 -1.629396
H -3.254057 2.225404 -0.356998
H -4.657072 -1.884195 0.077465
H -5.145669 0.557321 -0.254002


