%chk=000055155.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055155

0 1
 O   -1.685600      0.8470000      -1.600800    
 O    1.599800       1.239300       1.836200    
 N    2.356800      0.8545000     -0.3349000    
 C    4.522300     -0.1474000      0.3004000    
 C    3.760300       1.110500     -0.1028000    
 C   4.6700001E-02  0.6398000      0.1785000    
 C    4.480000      -1.231800     -0.7786000    
 C  -0.2970000      0.9428000      -1.244800    
 C   -2.152700     -0.2042000      0.5472000    
 C  -0.8170000      0.1007000       1.041700    
 C    1.396400      0.9417000      0.6586000    
 C   -2.520700      0.1803000     -0.7465000    
 C    5.297200      -2.449100     -0.3747000    
 C   -3.082700     -0.8627000       1.360500    
 C   -3.808900     -8.4100001E-02  -1.218400    
 C   -4.366100      -1.133500      0.8832000    
 C   -4.728900     -0.7439000     -0.4046000    
 H    4.105500     -0.5478000       1.232900    
 H    5.565000      0.1241000      0.5049000    
 H    4.172100       1.529800      -1.026900    
 H    3.857400       1.867000      0.6836000    
 H    4.871500     -0.8333000      -1.721800    
 H    3.446700      -1.547000     -0.9625000    
 H   1.3900000E-02   1.963100      -1.496400    
 H   0.2253000      0.2551000      -1.918700    
 H    2.110200      0.5693000      -1.275500    
 H  -0.5705000     -0.1313000       2.071500    
 H    4.912200      -2.890400      0.5501000    
 H    5.254100      -3.211600      -1.158800    
 H    6.347200      -2.182600     -0.2178000    
 H   -2.820300      -1.169300       2.370300    
 H   -4.101800      0.2201000      -2.219900    
 H   -5.083700      -1.645600       1.517800    
 H   -5.729100     -0.9519000     -0.7735000    


%chk=000055155-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055155

0 1
O -1.674711 0.459949 -1.685473
O 1.609606 0.767078 1.971255
N 2.393478 0.842231 -0.215238
C 4.622864 -0.193127 0.368086
C 3.785614 1.098158 0.200119
C 0.010864 0.375835 0.183615
C 4.823918 -0.987108 -0.941494
C -0.259473 0.207448 -1.305356
C -2.367099 -0.126247 0.607744
C -1.014554 0.166838 1.066692
C 1.377901 0.676642 0.720932
C -2.662146 0.037451 -0.779688
C 5.682454 -2.254999 -0.741884
C -3.422551 -0.495030 1.482672
C -3.969272 -0.133157 -1.276185
C -4.730020 -0.693976 0.994550
C -5.000386 -0.505664 -0.384196
H 4.133926 -0.832348 1.128136
H 5.612479 0.091475 0.780588
H 4.255662 1.763872 -0.549396
H 3.737873 1.633628 1.163943
H 5.302386 -0.332011 -1.699361
H 3.834994 -1.277838 -1.351160
H 0.297103 0.933178 -1.924820
H 0.001919 -0.820775 -1.641364
H 2.196333 0.746675 -1.211178
H -0.799593 0.243416 2.138890
H 5.212031 -2.939084 -0.010979
H 5.814073 -2.809512 -1.689082
H 6.687457 -1.996310 -0.358697
H -3.204927 -0.617846 2.550299
H -4.161334 0.022811 -2.341861
H -5.535017 -0.983650 1.677350
H -6.016251 -0.650403 -0.767957


