%chk=000004882.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004882

0 1
 O  -0.8514000       2.219200     -0.1844000    
 O   -2.629200      -2.781000      0.4778000    
 O    1.766500      -1.804900     -0.6053000    
 N   0.9908000      0.2170000      0.2431000    
 C   -2.716100      0.7849000     -8.1000000E-02
 C   -3.185600     -0.5189000      9.2399999E-02
 C  -0.3451000     -6.2500000E-02  0.2013000    
 C   -1.268600       1.076400     -3.4200002E-02
 C   -2.242800      -1.628700      0.3247000    
 C  -0.8008000      -1.307700      0.3661000    
 C   -3.623000       1.828400     -0.3010000    
 C   -4.559800     -0.7803000      4.7200002E-02
 C   -4.992500       1.564200     -0.3462000    
 C   -5.459800      0.2628000     -0.1721000    
 C    1.970600     -0.6762000     -0.1650000    
 C    3.369700     -0.1847000     -6.7100003E-02
 C    4.319800     -0.7071000     -0.9197000    
 C    3.672700      0.7780000      0.8729000    
 C    5.632900     -0.2457000     -0.8280000    
 C    4.985900       1.239400      0.9644000    
 C    5.965900      0.7275000      0.1140000    
 H  -0.1656000      -2.156400      0.5923000    
 H   -3.284200       2.851700     -0.4391000    
 H   -4.948000      -1.786600      0.1799000    
 H    1.235400       1.197900      0.3498000    
 H   -5.695400       2.374400     -0.5169000    
 H   -6.526400      6.0300000E-02 -0.2075000    
 H    4.075900      -1.461100      -1.662000    
 H    2.944300       1.177900       1.570900    
 H    6.396000     -0.6435000      -1.490700    
 H    5.247400       1.992300       1.702300    
 H    6.988700       1.085800      0.1863000    


%chk=000004882-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004882

0 1
O -0.704083 2.075879 0.146603
O -2.888937 -2.938563 -0.244208
O 1.928555 -2.073037 -0.247534
N 0.960808 0.039776 -0.024814
C -2.731535 0.747847 0.047979
C -3.287949 -0.560408 -0.053671
C -0.391864 -0.297614 -0.046463
C -1.262996 0.931578 0.056612
C -2.393364 -1.765923 -0.153740
C -0.938361 -1.562837 -0.146784
C -3.582757 1.877337 0.141115
C -4.690984 -0.723187 -0.060903
C -4.981917 1.705776 0.132925
C -5.535844 0.404865 0.031968
C 2.066827 -0.821229 -0.102453
C 3.417386 -0.165892 -0.016807
C 4.540142 -0.971672 -0.342278
C 3.624221 1.183282 0.380411
C 5.843136 -0.438843 -0.287059
C 4.930599 1.714121 0.437993
C 6.042227 0.907503 0.100924
H -0.300917 -2.445544 -0.225268
H -3.129446 2.870639 0.217959
H -5.092842 -1.738201 -0.139948
H 1.105426 1.058159 0.038080
H -5.641085 2.577092 0.204471
H -6.623227 0.274197 0.025962
H 4.359822 -2.011961 -0.631841
H 2.790014 1.831672 0.674218
H 6.701385 -1.068562 -0.544370
H 5.081146 2.752867 0.750494
H 7.054612 1.323682 0.145626


