%chk=000034182.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034182

0 1
 O    2.254900      0.6739000       1.838500    
 O   -1.649700      -2.532300      0.3261000    
 N  -0.4021000       1.194300     -0.2849000    
 N   0.1112000      -1.107100     -9.4200000E-02
 C    1.924700      0.4272000     -0.5315000    
 C   0.4681000      0.1306000     -0.2915000    
 C    2.729600     -1.2400000E-02  0.6853000    
 C    2.370600     -0.3012000      -1.789700    
 C   -1.742500      0.9900000     -6.5200001E-02
 C   -2.198200     -0.2550000      0.1445000    
 C   -1.226000      -1.395300      0.1334000    
 C   -2.640500       2.187200     -7.0900001E-02
 H    2.045400       1.507800     -0.6760000    
 H    2.639600      -1.087000      0.8758000    
 H    3.792600      0.2189000      0.5599000    
 H    1.746600     -2.1800000E-02  -2.645900    
 H    3.408100     -4.8700001E-02  -2.032800    
 H    2.310000      -1.389600      -1.678600    
 H  -9.1300003E-02   2.147500     -0.4384000    
 H   -3.243400     -0.4778000      0.3233000    
 H   -2.336200       2.895700      0.7068000    
 H   -3.685800       1.917500      0.1133000    
 H   -2.592400       2.695300      -1.039800    
 H    2.367900       1.626600       1.679700    


%chk=000034182-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034182

0 1
O 1.954873 2.200168 0.818318
O -2.153169 -2.220515 -1.762965
N -0.337666 0.959187 0.032570
N -0.171191 -1.050694 -1.259940
C 1.901263 0.224779 -0.768613
C 0.385315 -0.006526 -0.673071
C 2.491365 0.841166 0.524196
C 2.648659 -1.081268 -1.117772
C -1.725923 0.856008 0.161760
C -2.356760 -0.214805 -0.436547
C -1.603429 -1.232065 -1.193574
C -2.416334 1.940848 0.951177
H 2.067294 0.949028 -1.597015
H 2.217879 0.239024 1.406588
H 3.594660 0.881259 0.451774
H 2.162473 -1.571904 -1.974408
H 3.706342 -0.871469 -1.360813
H 2.612065 -1.794261 -0.274305
H 0.207658 1.727091 0.467075
H -3.440794 -0.333334 -0.364312
H -2.026781 1.993785 1.985416
H -3.499101 1.748664 1.001062
H -2.264259 2.933790 0.486920
H 2.406760 2.866345 0.243678


