%chk=000033525.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033525

0 1
 O    1.903400      -1.740300     -0.3828000    
 O   0.3756000       2.031900     -0.1579000    
 O  -0.1440000      -2.541300     -0.9496000    
 N   -3.619600      1.2400000E-02  4.8999999E-02
 N   5.3100001E-02 -0.2429000     -0.5921000    
 C   -2.213000     -0.2018000      0.3637000    
 C   -1.363000     -6.0199998E-02 -0.8904000    
 C   -3.827100       1.353200     -0.5019000    
 C   -4.450300     -0.1806000       1.239200    
 C   0.8080000      0.8858000     -0.2440000    
 C   -5.278500       1.566000     -0.8967000    
 C   -4.251300      -1.566700       1.828700    
 C    2.228500      0.6345000      3.7099998E-02
 C   0.5439000      -1.561100     -0.6631000    
 C    2.721700     -0.6577000     -4.3699998E-02
 C    3.089700       1.680000      0.3842000    
 C    4.064300     -0.9335000      0.2149000    
 C    4.435900       1.413700      0.6452000    
 C    4.922700      0.1087000      0.5603000    
 H   -2.035200      -1.213400      0.7431000    
 H   -1.866800      0.4951000       1.138900    
 H   -1.439000      0.9285000      -1.347600    
 H   -1.676200     -0.7902000      -1.647000    
 H   -3.509200       2.139200      0.1945000    
 H   -3.278300       1.494300      -1.435700    
 H   -4.249700      0.5778000       2.006500    
 H   -5.512600     -0.1189000      0.9816000    
 H   -5.664700      0.7316000      -1.492300    
 H   -5.930200       1.716900     -3.0600000E-02
 H   -5.363900       2.470500      -1.510000    
 H   -4.298400      -2.347300       1.061700    
 H   -3.308400      -1.658200       2.376700    
 H   -5.049100      -1.773800       2.551200    
 H    2.735100       2.704500      0.4564000    
 H    4.444400      -1.948900      0.1502000    
 H    5.106000       2.225100      0.9147000    
 H    5.970000     -9.4499998E-02  0.7639000    


%chk=000033525-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033525

0 1
O 1.965973 -1.731203 0.395803
O 0.344470 1.878956 -0.834387
O -0.136702 -2.644898 0.301532
N -3.604854 0.223157 0.324609
N 0.094988 -0.391873 -0.317339
C -2.192243 -0.021412 0.682389
C -1.368630 -0.299728 -0.599840
C -3.891527 1.653426 0.031721
C -4.583861 -0.422160 1.236890
C 0.879481 0.796568 -0.466357
C -5.055533 1.844598 -0.959344
C -4.663880 -1.948132 1.039017
C 2.317009 0.636969 -0.167713
C 0.570860 -1.638188 0.130662
C 2.817866 -0.617427 0.249350
C 3.213989 1.728183 -0.293944
C 4.182271 -0.812306 0.540117
C 4.579640 1.553334 -0.008952
C 5.059972 0.282368 0.407453
H -2.123651 -0.901850 1.345014
H -1.740912 0.841177 1.226474
H -1.501942 0.521971 -1.320343
H -1.698657 -1.248153 -1.049944
H -4.097299 2.225272 0.971693
H -2.976969 2.096672 -0.405428
H -4.360213 -0.190089 2.308854
H -5.576742 0.014022 1.023822
H -4.832549 1.331480 -1.911011
H -6.004025 1.435022 -0.566841
H -5.214771 2.919894 -1.163968
H -4.961866 -2.180103 0.001690
H -3.692933 -2.440497 1.229724
H -5.405922 -2.390337 1.730028
H 2.807546 2.691850 -0.617199
H 4.528202 -1.798930 0.859890
H 5.273512 2.393747 -0.107253
H 6.123703 0.147020 0.629432


