%chk=000087998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087998

0 1
 O   -3.319600     -0.3778000     -0.2391000    
 O   0.8821000      0.5502000      -1.082500    
 O  -0.1760000      7.4000000E-03  0.9326000    
 N   -3.063000       1.807200      0.6269000    
 C   -1.441500      0.8811000     -0.9453000    
 C   -2.690200      0.8196000     -0.1151000    
 C    2.087100      0.1459000     -0.5031000    
 C   -4.534100     -0.6098000      0.4882000    
 C  -0.2031000      0.4191000     -0.2196000    
 C    2.474200      -1.169800     -0.6306000    
 C    2.841400       1.078300      0.1741000    
 C   -5.041000      -2.000500      0.1705000    
 C    3.677100      -1.573800     -5.1300000E-02
 C    4.044200      0.6745000      0.7534000    
 C    4.462000     -0.6516000      0.6407000    
 H   -1.579000      0.2622000      -1.838800    
 H   -1.293100       1.919800      -1.261100    
 H   -4.336100     -0.5286000       1.562400    
 H   -5.284600      0.1307000      0.1912000    
 H    1.863600      -1.887200      -1.169600    
 H    2.516600       2.110400      0.2614000    
 H   -5.968300      -2.211800      0.7103000    
 H   -5.224500      -2.107600     -0.9037000    
 H   -4.294200      -2.754000      0.4418000    
 H    4.002400      -2.606300     -0.1392000    
 H    4.655600       1.392500       1.292300    
 H    5.398600     -0.9660000       1.091900    
 H   -3.926200       1.595300       1.130900    


%chk=000087998-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087998

0 1
O -3.300979 -0.326986 -0.163469
O 0.732108 0.208897 -0.935680
O -0.503876 0.582045 1.038921
N -3.504384 2.099738 -0.420777
C -1.525198 0.878136 -1.204066
C -2.887614 0.964196 -0.553720
C 2.006987 -0.118494 -0.369873
C -4.554593 -0.432196 0.620510
C -0.423082 0.544644 -0.202515
C 2.991343 -0.382864 -1.348802
C 2.301995 -0.186763 1.012026
C -4.723442 -1.903550 0.988896
C 4.298012 -0.722494 -0.942622
C 3.619959 -0.529034 1.396942
C 4.618178 -0.797066 0.434103
H -1.517924 0.114010 -2.000282
H -1.297065 1.853060 -1.666031
H -4.466906 0.205309 1.523254
H -5.402942 -0.069086 0.004450
H 2.718173 -0.317903 -2.406270
H 1.533309 0.019613 1.756858
H -5.643688 -2.042265 1.584945
H -4.796587 -2.527863 0.082266
H -3.863713 -2.253315 1.584528
H 5.062713 -0.927542 -1.699510
H 3.860054 -0.584216 2.464504
H 5.633070 -1.060427 0.750309
H -4.433509 2.061817 0.040706


