%chk=000017541.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017541

0 1
 O   -2.456600     -0.3236000     -0.3340000    
 O   -1.432700      0.5786000       1.524800    
 N    1.011500      3.5999999E-03  0.2950000    
 C  -0.1774000     -0.7653000     -7.1099997E-02
 C   0.9271000       1.361500     -0.2414000    
 C    2.220100     -0.6628000     -0.1884000    
 C   -1.396800     -8.1900001E-02  0.4955000    
 C    2.104700       2.191000      0.1691000    
 C    2.332600      -2.057400      0.3463000    
 C   -3.699700      0.2620000      6.6699997E-02
 C   -4.763600     -9.6199997E-02 -0.9489000    
 C    2.967200       2.743000     -0.6919000    
 C    2.363700      -3.152500     -0.4217000    
 H  -0.2710000     -0.8485000      -1.161400    
 H  -0.1846000      -1.771000      0.3624000    
 H   5.0099999E-02   1.902600      0.1281000    
 H   0.8358000       1.340700      -1.336400    
 H    3.121900     -0.1430000      0.1559000    
 H    2.253500     -0.6687000      -1.286500    
 H    2.254900       2.358500       1.233000    
 H    2.402400      -2.178200       1.424700    
 H   -3.983900     -0.1234000       1.052200    
 H   -3.589800       1.350900      0.1194000    
 H   -5.729300      0.3364000     -0.6731000    
 H   -4.484600      0.2669000      -1.943600    
 H   -4.872100      -1.183100      -1.026300    
 H    3.798700       3.338100     -0.3305000    
 H    2.862400       2.611600      -1.763100    
 H    2.451100      -4.135700      2.7300000E-02
 H    2.301400      -3.089800      -1.502400    


%chk=000017541-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017541

0 1
O -2.617918 -0.346268 -0.416986
O -1.483015 1.222310 0.880796
N 1.039132 0.165847 -0.133016
C -0.245476 -0.337561 -0.632746
C 1.317199 1.577879 -0.508474
C 2.167234 -0.756730 -0.426528
C -1.461747 0.288962 0.049598
C 2.421634 2.179890 0.333877
C 2.056499 -2.052467 0.349546
C -3.913830 0.156379 0.136563
C -5.018226 -0.680839 -0.499992
C 3.493989 2.851835 -0.154908
C 2.151601 -3.293211 -0.191311
H -0.382556 -0.202724 -1.737156
H -0.297534 -1.427444 -0.455266
H 0.390442 2.149744 -0.315919
H 1.565595 1.684390 -1.594938
H 3.092161 -0.229936 -0.119920
H 2.267765 -0.976012 -1.519934
H 2.285187 2.062006 1.418509
H 1.898024 -1.929555 1.430911
H -3.883934 0.054960 1.236498
H -4.001177 1.231098 -0.106350
H -6.003289 -0.350022 -0.123173
H -5.012132 -0.573058 -1.598125
H -4.893214 -1.749328 -0.254825
H 4.239167 3.304599 0.508640
H 3.651695 2.975797 -1.234177
H 2.095493 -4.195557 0.427711
H 2.298232 -3.440682 -1.269206


