%chk=000124872.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124872

0 1
 O   -2.475000      0.8353000     -0.1314000    
 O  -0.9133000      -1.098700      -1.776600    
 O   -3.439700      -1.279800     -5.9799999E-02
 N  -0.2917000      -1.253500      0.4853000    
 C    1.058000      -1.727100      0.2175000    
 C    2.032800     -0.5943000      7.3899999E-02
 C    2.257200     -3.5100002E-02  -1.178700    
 C    2.700700     -0.1155000       1.195000    
 C  -0.6462000      -1.100300       1.893100    
 C   -1.147400     -0.9910000     -0.5789000    
 C    3.162700       1.017600      -1.312200    
 C    3.605900      0.9373000       1.061400    
 C    3.836900       1.503800     -0.1922000    
 C   -2.517600     -0.5069000     -0.2296000    
 C   -3.712200       1.454700      0.2311000    
 C   -3.511000       2.953500      0.3020000    
 H    1.052100      -2.319400     -0.7066000    
 H    1.369700      -2.416700       1.011700    
 H  -2.5400000E-02 -0.3160000       2.333900    
 H  -0.4635000      -2.047000       2.410000    
 H   -1.693600     -0.8295000       2.033900    
 H    1.743600     -0.4061000      -2.060700    
 H    2.531900     -0.5507000       2.176000    
 H    3.343600       1.457900      -2.288400    
 H    4.131700       1.315500       1.933300    
 H    4.542200       2.323200     -0.2962000    
 H   -4.473700       1.218200     -0.5206000    
 H   -4.037000       1.078000       1.207600    
 H   -4.439900       3.460300      0.5780000    
 H   -2.739300       3.204100       1.037300    
 H   -3.169000       3.342500     -0.6628000    


%chk=000124872-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124872

0 1
O -2.905404 0.950200 -0.250722
O -1.117336 -0.890683 -1.573612
O -3.267102 -0.945604 1.061298
N -0.203599 -1.043809 0.578507
C 1.060501 -1.615734 0.047170
C 2.225482 -0.632153 0.097367
C 2.135049 0.607176 -0.588574
C 3.410113 -0.941153 0.808514
C -0.263552 -0.818998 2.032559
C -1.211333 -0.743185 -0.314998
C 3.213092 1.517572 -0.562261
C 4.492733 -0.030796 0.833962
C 4.395846 1.201530 0.149212
C -2.550287 -0.274991 0.279373
C -4.280007 1.448142 0.092186
C -4.441376 2.792023 -0.607938
H 0.849470 -1.913486 -0.995485
H 1.299704 -2.525200 0.631335
H 0.606811 -0.216580 2.350475
H -0.247197 -1.784019 2.573417
H -1.184910 -0.289298 2.312674
H 1.222990 0.846424 -1.147985
H 3.489103 -1.897438 1.341304
H 3.135786 2.469611 -1.099360
H 5.405331 -0.281466 1.386404
H 5.233001 1.908333 0.166976
H -5.008264 0.693987 -0.255883
H -4.356616 1.524380 1.192074
H -5.446707 3.201806 -0.400581
H -3.689813 3.516887 -0.251758
H -4.328009 2.680821 -1.699349


