%chk=000020040.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020040

0 1
 O   -4.653900     -3.9500002E-02 -0.7754000    
 O   -2.720300      -3.518400      2.7500000E-02
 O   -2.837700       3.508100       0.000000    
 O   -4.505300      -2.481900     -0.7201000    
 O   -4.586800       2.406800     -0.7395000    
 N   -3.349800      -2.466200     -0.2342000    
 N   -3.431700       2.433500     -0.2529000    
 C    3.050100      3.5000001E-03  0.8672000    
 C    4.164500     -4.2700000E-02 -0.1827000    
 C    1.620600      6.9799997E-02  0.3208000    
 C    5.571100     -2.1500001E-02  0.4193000    
 C    6.640700      2.1800000E-02 -0.6743000    
 C   0.5503000      5.5900000E-02   1.415000    
 C    8.047700      9.8999999E-03 -7.6899998E-02
 C  -0.8395000      3.0500000E-02  0.8301000    
 C   -1.487100       1.226800      0.5617000    
 C   -1.446700      -1.188800      0.5705000    
 C    9.113500      1.7999999E-02  -1.161100    
 C   -2.732100      -1.212400      2.9500000E-02
 C   -2.772700       1.203100      2.0700000E-02
 C   -3.395200     -1.6400000E-02 -0.2453000    
 H    3.212700      0.8738000       1.515700    
 H    3.142300     -0.8814000       1.509700    
 H    4.042400     -0.9435000     -0.7964000    
 H    4.047700      0.8161000     -0.8555000    
 H    1.512600      0.9744000     -0.2913000    
 H    1.465800     -0.7805000     -0.3560000    
 H    5.712700     -0.9106000       1.045300    
 H    5.679200      0.8541000       1.070900    
 H   0.6895000     -0.8164000       2.066500    
 H   0.6657000      0.9330000       2.064400    
 H    6.507800      0.9228000      -1.285300    
 H    6.518100     -0.8413000      -1.340100    
 H    8.184500      0.8839000      0.5705000    
 H    8.179700     -0.8808000      0.5484000    
 H  -0.9761000       2.161800      0.7774000    
 H  -0.9047000      -2.104700      0.7930000    
 H    9.029300      0.9120000      -1.787100    
 H    10.11140      1.0600000E-02 -0.7117000    
 H    9.024600     -0.8625000      -1.805400    
 H   -5.145600      0.7530000     -0.5095000    


%chk=000020040-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020040

0 1
O -4.781758 -0.155857 -0.761704
O -2.635820 -3.547594 0.102183
O -3.238444 3.548688 0.449749
O -3.940653 -2.632032 -1.532535
O -4.967074 2.344259 -0.415252
N -3.131326 -2.537470 -0.539846
N -3.738570 2.431177 0.074011
C 3.074151 0.134130 0.922208
C 4.164872 -0.026238 -0.160568
C 1.642097 0.068235 0.347625
C 5.601251 0.056072 0.404117
C 6.691723 -0.109681 -0.678157
C 0.550810 0.218581 1.444726
C 8.129396 -0.021569 -0.116649
C -0.857929 0.146124 0.883430
C -1.654674 1.293746 0.730206
C -1.403962 -1.096907 0.464244
C 9.211801 -0.186072 -1.205374
C -2.682721 -1.189954 -0.107952
C -2.954996 1.205363 0.178649
C -3.521026 -0.042736 -0.266889
H 3.216192 1.102601 1.445719
H 3.200039 -0.656990 1.690776
H 4.029700 -0.999631 -0.676581
H 4.031358 0.757361 -0.935302
H 1.507714 0.864850 -0.411456
H 1.500426 -0.895716 -0.182439
H 5.735575 -0.724745 1.181833
H 5.738933 1.031562 0.916024
H 0.696364 -0.580677 2.198399
H 0.698371 1.182000 1.968505
H 6.556767 0.668457 -1.458539
H 6.558451 -1.086755 -1.188158
H 8.261655 0.954233 0.394064
H 8.264700 -0.800187 0.661739
H -1.293324 2.278868 1.039942
H -0.834207 -2.024084 0.585509
H 9.119816 0.600821 -1.977768
H 10.229589 -0.122851 -0.778470
H 9.117982 -1.165059 -1.712269
H -5.193948 0.789375 -0.754349


