%chk=000004907.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004907

0 1
 O  -0.8123000      -1.766000      0.8100000    
 O   0.9680000      -1.793900      -1.848200    
 O    1.472900     -0.7230000       2.045800    
 N   0.7323000       1.294500      0.2516000    
 C   0.7240000     -0.1360000     -0.1457000    
 C   -1.878400      6.8300001E-02 -0.3219000    
 C   -1.726900       1.521400      0.1084000    
 C  -0.3734000       2.082200     -0.3150000    
 C  -0.6721000     -0.7037000      0.2011000    
 C   0.9963000     -0.3985000      -1.638400    
 C    1.768300     -0.9206000      0.6817000    
 C   -3.195600     -0.5115000      0.1847000    
 C    1.997100       1.986800     -1.4100000E-02
 H   -1.874400     -4.6000001E-03  -1.415400    
 H   -1.827200       1.606900       1.198900    
 H   -2.525900       2.129100     -0.3331000    
 H  -0.3091000       2.132600      -1.408900    
 H  -0.3193000       3.114600      5.3199999E-02
 H    1.973900     -2.3000000E-02  -1.958400    
 H   0.2402000      4.9899999E-02  -2.288700    
 H    2.800900     -0.6195000      0.4814000    
 H    1.714000      -2.000300      0.5078000    
 H   -3.316000      -1.549300     -0.1445000    
 H   -3.241600     -0.5048000       1.279300    
 H   -4.046400      6.2799998E-02 -0.1964000    
 H    2.844100       1.511800      0.4877000    
 H    1.960300       3.006600      0.3879000    
 H    2.218700       2.062100      -1.083700    
 H    1.859100      -2.141900      -1.675700    
 H    1.541600      0.2290000       2.230800    


%chk=000004907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004907

0 1
O -0.834860 -1.780921 -1.233962
O 1.827173 -1.868036 -1.837481
O 0.606951 -0.409718 2.070423
N 0.716952 1.310451 0.024754
C 0.718684 -0.135559 -0.377006
C -1.980433 0.127448 -0.304666
C -1.723562 1.600553 0.099473
C -0.409912 2.122048 -0.500787
C -0.714542 -0.648434 -0.672000
C 1.614890 -0.442154 -1.630804
C 1.246779 -0.941587 0.873894
C -2.751030 -0.660685 0.795213
C 2.026676 2.003448 -0.017373
H -2.597678 0.101288 -1.226560
H -1.655135 1.681596 1.200423
H -2.573980 2.228387 -0.225689
H -0.454100 2.116090 -1.616982
H -0.240520 3.169351 -0.191265
H 2.620403 -0.019487 -1.474004
H 1.168573 0.037376 -2.531092
H 2.352402 -0.844695 0.922104
H 0.994419 -2.008772 0.792571
H -2.987755 -1.680779 0.449147
H -2.139835 -0.728736 1.712786
H -3.695281 -0.138840 1.033778
H 2.801460 1.384810 0.466610
H 1.946351 2.944207 0.555889
H 2.372076 2.257648 -1.043967
H 0.919082 -2.287657 -1.844601
H 0.518851 0.573358 1.853374


