%chk=000016577.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016577

0 1
 O   -1.974100       1.791300     -0.4458000    
 O   -2.803500     -0.8374000     -8.9500003E-02
 O    4.841100      0.1410000      8.0399998E-02
 N    3.588800     -0.4776000      0.1200000    
 C   -1.061900      0.7966000     -0.2610000    
 C   -1.478200     -0.5226000     -8.1600003E-02
 C    1.242000      9.6400000E-02 -6.3500002E-02
 C   0.2982000       1.106000     -0.2518000    
 C  -0.5345000      -1.532200      0.1070000    
 C   0.8257000      -1.222800      0.1159000    
 C    2.660100      0.4190000     -5.2999999E-02
 C   -2.458700       2.451400      0.7221000    
 C   -3.145100      -2.209000      0.1008000    
 H   0.6146000       2.136900     -0.3929000    
 H  -0.7846000      -2.577400      0.2524000    
 H    1.539300      -2.029000      0.2649000    
 H    2.935300       1.479700     -0.1998000    
 H   -1.637800       2.945200       1.251700    
 H   -2.961000       1.740900       1.386100    
 H   -3.181400       3.210800      0.4114000    
 H   -2.835700      -2.568700       1.088100    
 H   -2.761900      -2.836900     -0.7108000    
 H   -4.237400      -2.276800      6.6100001E-02
 H    5.436600     -0.6149000      0.2183000    


%chk=000016577-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016577

0 1
O -1.755132 1.985458 -0.339830
O -2.770072 -0.643653 0.075045
O 5.100724 0.080680 -0.115918
N 3.772349 -0.530646 0.006372
C -0.913020 0.884166 -0.112408
C -1.379311 -0.454929 0.076844
C 1.420754 0.075994 -0.039639
C 0.472946 1.125897 -0.173284
C -0.436001 -1.503597 0.230632
C 0.945478 -1.246199 0.172724
C 2.849586 0.401610 -0.118931
C -2.848136 2.232795 0.624185
C -3.271557 -2.017818 0.176095
H 0.796131 2.160361 -0.333633
H -0.779636 -2.531125 0.383469
H 1.666249 -2.061467 0.285749
H 3.135928 1.452853 -0.288411
H -2.436882 2.381189 1.641631
H -3.571219 1.401450 0.625905
H -3.324255 3.161757 0.275352
H -2.994619 -2.478011 1.144073
H -2.894919 -2.641629 -0.656690
H -4.365597 -1.927742 0.107542
H 5.706112 -0.697495 -0.011374


