%chk=000065691.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065691

0 1
 O  -2.9999999E-02  0.8097000     -0.1494000    
 O  -0.6560000      -1.296100      -1.902300    
 N   -3.548000      0.4949000     -0.4493000    
 C   -4.508400      0.1087000      0.5896000    
 C   -2.564400     -0.5555000     -0.6515000    
 C   -1.540900     -0.1859000      -1.727700    
 C   -5.527600       1.240500      0.7577000    
 C   -5.217200      -1.175400      0.1459000    
 C   -3.763100     -0.1294000       1.908200    
 C  -0.7136000       1.048600      -1.375800    
 C    1.180100       1.430100      1.1400000E-02
 C    2.343800      0.6931000      0.2128000    
 C    2.313200     -0.7549000      0.2591000    
 C    1.225700       2.821100     -3.0099999E-02
 C    3.562700       1.352100      0.3737000    
 C    2.444600       3.479900      0.1307000    
 C    3.613000       2.745500      0.3326000    
 C    2.118200      -1.407500       1.475200    
 C    2.478200      -1.492000     -0.9124000    
 C    2.088300      -2.801300       1.520100    
 C    2.448200      -2.885800     -0.8675000    
 C    2.253300      -3.540400      0.3488000    
 H   -3.084100       1.359200     -0.1733000    
 H   -2.004900     -0.8069000      0.2551000    
 H   -3.028500      -1.485500     -0.9960000    
 H   -2.044800     -1.5300000E-02  -2.686600    
 H   -6.062700       1.437600     -0.1786000    
 H   -6.275700      0.9905000       1.518700    
 H   -5.041900       2.173400       1.067300    
 H   -4.595000      -2.072600      0.2303000    
 H   -5.586300      -1.101400     -0.8841000    
 H   -6.092300      -1.361200      0.7814000    
 H   -3.084500      0.6982000       2.146800    
 H   -4.478100     -0.2008000       2.737600    
 H   -3.192000      -1.063300       1.927800    
 H   -1.337400       1.943200      -1.282600    
 H   1.4500000E-02   1.217900      -2.180600    
 H   -1.190100      -2.056500      -2.188700    
 H   0.3229000       3.407400     -0.1766000    
 H    4.483800      0.7961000      0.5322000    
 H    2.483600       4.565000      0.1011000    
 H    4.561900       3.258600      0.4584000    
 H    1.987100     -0.8462000       2.397300    
 H    2.629500     -0.9971000      -1.868700    
 H    1.936000      -3.311200       2.466900    
 H    2.575600      -3.461400      -1.779600    
 H    2.229500      -4.625700      0.3836000    


%chk=000065691-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065691

0 1
O 0.125317 0.752302 -1.205505
O -1.155394 -0.421128 -3.714697
N -2.741239 0.199792 -0.333810
C -3.683821 -0.446629 0.639887
C -2.299492 -0.587838 -1.504856
C -1.805695 0.349278 -2.635076
C -3.813305 0.539243 1.827151
C -5.071546 -0.625509 -0.025208
C -3.157619 -1.818555 1.158900
C -0.781272 1.388182 -2.177132
C 1.153685 1.521200 -0.639926
C 1.915927 0.890608 0.395722
C 1.657217 -0.507079 0.856038
C 1.421528 2.855052 -1.032805
C 2.943957 1.656387 1.004614
C 2.455342 3.584050 -0.404599
C 3.220886 2.986145 0.618720
C 1.737126 -0.820180 2.242439
C 1.372280 -1.563396 -0.054580
C 1.544012 -2.140020 2.705030
C 1.185265 -2.883609 0.407978
C 1.268875 -3.181085 1.788598
H -1.907754 0.543612 0.167640
H -1.482193 -1.306662 -1.278679
H -3.159994 -1.166463 -1.892423
H -2.675166 0.912987 -3.038256
H -4.176166 1.520192 1.472110
H -4.519688 0.151035 2.582500
H -2.834942 0.689911 2.323916
H -5.040002 -1.349302 -0.860756
H -5.430080 0.342501 -0.417248
H -5.803076 -1.004785 0.711547
H -2.163778 -1.704093 1.631602
H -3.849694 -2.248825 1.907097
H -3.059391 -2.547706 0.333401
H -1.298254 2.238548 -1.691863
H -0.215588 1.742089 -3.060040
H -1.755703 -1.158714 -3.992283
H 0.830622 3.330145 -1.820559
H 3.555776 1.180885 1.779397
H 2.658418 4.613324 -0.720441
H 4.029702 3.541862 1.104145
H 1.927365 -0.017170 2.964256
H 1.302633 -1.344971 -1.123580
H 1.602401 -2.353693 3.778464
H 0.978363 -3.683151 -0.312660
H 1.120355 -4.206768 2.144729


