%chk=000089035.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089035

0 1
 O  -0.7829000     -0.3849000      -1.629300    
 O   -5.529000       1.078800     -0.6588000    
 O   -4.779200      0.3009000       1.338900    
 N   2.8700000E-02  -1.151800      0.4089000    
 C    1.356200      -1.508000     -3.7300002E-02
 C    2.294800     -0.3217000      1.5900001E-02
 C    1.875000      -2.702600      0.7603000    
 C   -2.230800     -0.3387000      0.3083000    
 C  -0.9352000     -0.6162000     -0.4329000    
 C    2.142400      0.6154000       1.022900    
 C    3.285100     -0.2004000     -0.9434000    
 C   -3.306300      0.2512000     -0.5981000    
 C    3.007400       1.708500       1.072100    
 C    4.150100      0.8928000     -0.8939000    
 C    4.011200       1.847200      0.1138000    
 C   -4.587600      0.5294000      0.1526000    
 H    1.259700      -1.820900      -1.085600    
 H  -0.1876000      -1.255400       1.396600    
 H    1.972600      -2.460800       1.825100    
 H    1.189800      -3.553300      0.6766000    
 H    2.858800      -3.021600      0.3996000    
 H   -2.584300      -1.278900      0.7492000    
 H   -2.014700      0.3512000       1.133300    
 H    1.381000      0.5244000       1.791600    
 H    3.402600     -0.9393000      -1.730600    
 H   -3.531400     -0.4458000      -1.413300    
 H   -2.951900       1.193500      -1.031300    
 H    2.902100       2.449800       1.858900    
 H    4.932400       1.000600      -1.639700    
 H    4.685500       2.697700      0.1528000    
 H   -6.363700       1.263000     -0.1775000    


%chk=000089035-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089035

0 1
O -1.106412 -1.478270 -1.460203
O -6.008356 -0.300688 -0.568345
O -4.735255 1.636754 -0.666194
N 0.040230 -0.488675 0.302968
C 1.328724 -1.170300 0.012277
C 2.484051 -0.182460 0.225950
C 1.433648 -2.492766 0.801569
C -2.315725 0.143448 -0.055884
C -1.091924 -0.688759 -0.462898
C 3.556541 -0.437145 1.115246
C 2.486457 1.034077 -0.509081
C -3.620650 -0.566065 -0.455706
C 4.604214 0.501434 1.270415
C 3.529304 1.971586 -0.357112
C 4.594702 1.708191 0.537190
C -4.787337 0.389850 -0.565191
H 1.269198 -1.428451 -1.063568
H 0.003121 0.142998 1.105889
H 1.445476 -2.320013 1.893422
H 0.564635 -3.126986 0.559099
H 2.348213 -3.047218 0.524031
H -2.301617 0.371460 1.026314
H -2.268952 1.116783 -0.582661
H 3.585145 -1.368849 1.689559
H 1.664325 1.239022 -1.205693
H -3.884629 -1.382961 0.237966
H -3.464704 -1.047369 -1.442866
H 5.426842 0.287819 1.962307
H 3.516155 2.901991 -0.935832
H 5.407009 2.433688 0.657027
H -6.751627 0.351973 -0.684296


