%chk=000152582.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152582

0 1
 O    4.098800      0.9408000      -2.953300    
 O    3.704800       1.746800     -0.8678000    
 N   0.5751000     -0.2501000     -0.4033000    
 N   -3.529600      0.4669000      4.6900000E-02
 C  -0.8166000     -7.3000002E-03 -0.2502000    
 C   -1.266500       1.283700      4.5000002E-02
 C   -1.724600      -1.060800     -0.3968000    
 C   -2.650800       1.478100      0.1871000    
 C   -3.091100     -0.7746000     -0.2375000    
 C    1.574300     -0.6175000      0.5078000    
 C    2.900100     -0.8001000      9.4700001E-02
 C  -0.3763000       2.361000      0.1977000    
 C   -1.300400      -2.367800     -0.6934000    
 C   -3.104800       2.761100      0.4809000    
 C   -4.000000      -1.819200     -0.3825000    
 C    3.288300     -0.6067000      -1.335100    
 C    1.246000     -0.8070000       1.855700    
 C    3.881800      -1.166900       1.015300    
 C  -0.8560000       3.634000      0.4914000    
 C   -2.229400      -3.394600     -0.8332000    
 C   -2.223100       3.834100      0.6332000    
 C   -3.581900      -3.119300     -0.6772000    
 C    2.227800      -1.173600       2.776200    
 C    3.545600      -1.353700       2.356100    
 C    3.708400      0.8126000      -1.657800    
 H   0.9070000      9.1600001E-02  -1.299000    
 H   0.6984000       2.241000      8.9199997E-02
 H  -0.2508000      -2.616700     -0.8270000    
 H   -4.171700       2.943600      0.5969000    
 H   -5.065400      -1.629000     -0.2652000    
 H    2.494900     -0.9183000      -2.022200    
 H    4.145300      -1.255300      -1.561300    
 H   0.2286000     -0.6746000       2.214200    
 H    4.913400      -1.308200      0.7038000    
 H  -0.1666000       4.464500      0.6077000    
 H   -1.899500      -4.402900      -1.063500    
 H   -2.608000       4.823500      0.8621000    
 H   -4.315200      -3.913200     -0.7844000    
 H    1.966400      -1.318900       3.820400    
 H    4.310000      -1.638500       3.073100    
 H    4.370300       1.859600      -3.163600    


%chk=000152582-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152582

0 1
O 4.937411 1.293549 -1.721533
O 2.756029 1.928162 -1.279458
N 0.703529 0.121588 -0.312933
N -3.565552 0.532444 0.121826
C -0.694341 0.226561 -0.150504
C -1.290064 1.532927 -0.090787
C -1.550807 -0.925357 -0.119391
C -2.741552 1.624329 0.027771
C -2.984734 -0.707596 0.051306
C 1.590341 -0.710492 0.423335
C 2.893972 -0.977647 -0.104553
C -0.525178 2.752884 -0.121685
C -1.082819 -2.273617 -0.304460
C -3.356863 2.924952 0.070147
C -3.860313 -1.849644 0.116478
C 3.296295 -0.474402 -1.492881
C 1.232975 -1.247364 1.690990
C 3.804198 -1.747283 0.656105
C -1.157144 3.993847 -0.075555
C -1.963003 -3.351745 -0.259681
C -2.587713 4.082607 0.012985
C -3.365093 -3.141140 -0.027363
C 2.148658 -2.026930 2.423009
C 3.444715 -2.278295 1.913904
C 3.597568 1.014438 -1.486822
H 1.166448 0.913027 -0.784774
H 0.568462 2.718849 -0.169556
H -0.020991 -2.453878 -0.490374
H -4.447793 2.953249 0.150892
H -4.925174 -1.646447 0.265740
H 2.459383 -0.636049 -2.200596
H 4.180646 -1.017387 -1.857024
H 0.241124 -1.035096 2.100705
H 4.802559 -1.942939 0.246594
H -0.558562 4.911079 -0.097754
H -1.586555 -4.369552 -0.410054
H -3.067780 5.067008 0.045698
H -4.042089 -4.001476 0.017668
H 1.853514 -2.426981 3.399262
H 4.160238 -2.879278 2.484159
H 5.093055 2.277197 -1.679734


