%chk=000006047.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006047

0 1
 O    2.518900      -2.048200      0.5529000    
 O   -1.852500      -1.478100      -1.211400    
 O    4.051000     -3.8199998E-02 -0.6028000    
 O   -3.550000      -1.347000      0.2877000    
 N   -3.552600       1.380600     -1.4300000E-02
 C   -1.301800      0.9726000      0.8705000    
 C   -2.299300      0.6704000     -0.2586000    
 C   0.1315000      0.6987000      0.4769000    
 C   0.6662000     -0.5593000      0.6993000    
 C   0.8815000       1.711300     -9.7700000E-02
 C    1.989300     -0.8120000      0.3367000    
 C   -2.644900     -0.8068000     -0.3356000    
 C    2.204400       1.458800     -0.4603000    
 C    2.758200      0.1972000     -0.2433000    
 H   -1.549400      0.3973000       1.773200    
 H   -1.371600       2.027900       1.169900    
 H   -1.921200      0.9952000      -1.234900    
 H   7.1300000E-02  -1.347200       1.153100    
 H   0.4581000       2.696000     -0.2731000    
 H    2.792000       2.253600     -0.9119000    
 H   -3.378500       2.385100     -3.9999999E-04
 H   -3.907300       1.148000      0.9133000    
 H    3.441000      -2.044500      0.2425000    
 H   -2.090000      -2.428300      -1.264900    
 H    4.425400      0.7730000     -0.9873000    


%chk=000006047-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000006047

0 1
O 2.489093 -2.064142 0.801766
O -1.787874 -1.032019 -1.644934
O 4.035410 -0.359103 -0.603856
O -2.864577 -1.547472 0.345688
N -3.768520 1.183717 0.188694
C -1.314497 1.148160 0.913386
C -2.397944 0.812437 -0.188589
C 0.111583 0.797512 0.524665
C 0.655928 -0.469314 0.861717
C 0.905287 1.711972 -0.212696
C 1.959678 -0.813937 0.464454
C -2.396786 -0.692378 -0.441228
C 2.219495 1.374028 -0.614432
C 2.740523 0.113274 -0.275784
H -1.615547 0.619098 1.837312
H -1.404608 2.234611 1.107031
H -2.120243 1.322970 -1.126190
H 0.076188 -1.198964 1.437522
H 0.500931 2.697050 -0.472280
H 2.826951 2.091000 -1.181283
H -3.914069 2.183361 0.347943
H -4.171751 0.585642 0.916686
H 3.416245 -2.122682 0.449186
H -1.761848 -2.024410 -1.735855
H 4.550653 0.305687 -1.119421


