%chk=000031603.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031603

0 1
 O   -1.470400      -2.304800     -0.3124000    
 O    1.330400     -6.8999999E-03 -0.2433000    
 O   -2.296500       2.151300     -0.2007000    
 O  -0.4290000       1.634200       1.024500    
 O    4.785500      0.5103000     -8.4899999E-02
 O    3.141800       1.821100     -0.7166000    
 N   -2.834100      -2.045500     -0.3770000    
 N    3.549000      0.7051000     -0.2777000    
 C  -0.8068000      -1.151000     -4.4599999E-02
 C   -1.702200     -0.1208000      7.1599998E-02
 C   0.6068000      -1.111000      7.9099998E-02
 C   -2.948100     -0.7348000     -0.1443000    
 C    1.432900      -2.118500      0.5197000    
 C   -4.281800     -0.1105000     -0.1392000    
 C    2.632900     -0.3129000     -6.3000000E-03
 C    2.748800      -1.600400      0.4641000    
 C   -1.402600       1.252600      0.3494000    
 C   -2.056300       3.542700      3.8600001E-02
 H    1.134700      -3.106100      0.8436000    
 H   -4.412000      0.5272000      0.7413000    
 H   -4.423000      0.5026000      -1.035100    
 H   -5.079600     -0.8610000     -0.1200000    
 H    3.663700      -2.107800      0.7355000    
 H   -2.095000       3.752200       1.111500    
 H   -2.842800       4.114400     -0.4610000    
 H   -1.088200       3.834900     -0.3786000    


%chk=000031603-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031603

0 1
O -1.399233 -2.287255 -0.116453
O 1.442005 -0.013333 -0.198536
O -2.471095 2.198700 -0.159862
O -0.478203 1.850839 1.003126
O 5.016158 0.179460 -0.131763
O 3.445787 1.726317 -0.792078
N -2.846156 -2.036593 -0.241918
N 3.794994 0.570987 -0.338111
C -0.754550 -1.060033 0.068736
C -1.703478 -0.033292 0.066128
C 0.681621 -1.138949 0.166067
C -2.980101 -0.692650 -0.143825
C 1.530703 -2.190642 0.533802
C -4.356375 -0.100514 -0.235193
C 2.772644 -0.394810 -0.030718
C 2.873597 -1.710130 0.414104
C -1.450294 1.394534 0.359686
C -2.309455 3.654018 0.088482
H 1.207807 -3.177853 0.855955
H -4.596854 0.475822 0.674670
H -4.416601 0.599538 -1.084632
H -5.100948 -0.902210 -0.363653
H 3.798773 -2.240168 0.622667
H -2.304376 3.857162 1.172436
H -3.175831 4.119000 -0.401339
H -1.362439 4.008655 -0.350578


