%chk=000027244.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027244

0 1
 O    1.060600     -0.4766000      0.6464000    
 O    3.561900       1.671500       1.220000    
 O    1.404600     -0.6971000      -1.633000    
 N    3.194400     -0.1087000     -0.2667000    
 C   -1.218400      0.1773000      0.1851000    
 C   -2.564200     -0.2131000     -1.3400000E-02
 C  -0.2501000     -0.8055000      0.4474000    
 C  -0.8809000       1.538700      0.1152000    
 C   -2.901900      -1.574600      5.6100000E-02
 C   -3.532700      0.7695000     -0.2759000    
 C  -0.6034000      -2.153700      0.5134000    
 C   -1.926800      -2.537500      0.3178000    
 C   -1.856100       2.501400     -0.1463000    
 C   -3.179600       2.117600     -0.3415000    
 C    1.860200     -0.4500000     -0.5172000    
 C    3.683700      0.2672000       1.056200    
 C    4.148600     -2.6300000E-02  -1.363500    
 H   0.1421000       1.875700      0.2660000    
 H   -3.930200      -1.897400     -9.3400002E-02
 H   -4.573200      0.4923000     -0.4318000    
 H   0.1495000      -2.910300      0.7178000    
 H   -2.201300      -3.587100      0.3692000    
 H   -1.582000       3.551200     -0.1968000    
 H   -3.938300       2.867600     -0.5449000    
 H    3.106000     -0.2261000       1.842600    
 H    4.733800     -2.1199999E-02   1.160600    
 H    4.503200       1.005200      -1.444700    
 H    3.696900     -0.3231000      -2.313300    
 H    4.991700     -0.6891000      -1.148500    
 H    2.646200       1.903000      0.9900000    


%chk=000027244-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027244

0 1
O 1.085476 -0.242420 -0.144064
O 2.869206 2.048418 -0.847771
O 2.293900 -2.257082 -0.552827
N 3.360132 -0.221077 -0.043471
C -1.240434 0.241288 0.122778
C -2.634059 -0.147982 0.053449
C -0.247147 -0.748027 -0.211144
C -0.909397 1.580275 0.514013
C -2.976521 -1.486962 -0.329587
C -3.639282 0.823998 0.373525
C -0.592763 -2.048477 -0.585105
C -1.976132 -2.408302 -0.636588
C -1.913776 2.502432 0.819352
C -3.291137 2.123412 0.747000
C 2.265421 -1.037331 -0.266723
C 3.208168 1.203793 0.292845
C 4.708159 -0.741821 -0.343890
H 0.142122 1.871935 0.583586
H -4.033356 -1.772687 -0.377280
H -4.692940 0.525552 0.319488
H 0.181128 -2.776018 -0.829781
H -2.237307 -3.430845 -0.928870
H -1.647201 3.522065 1.118127
H -4.068963 2.856058 0.987946
H 2.458078 1.298941 1.098471
H 4.184458 1.575624 0.637687
H 5.173707 -0.147448 -1.150741
H 4.619554 -1.789234 -0.668539
H 5.349142 -0.700295 0.555208
H 1.946062 1.823014 -1.134192


