%chk=000022717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022717

0 1
 O    1.701100     -0.9565000     -0.1103000    
 O   0.7066000      0.9849000      0.5770000    
 N  -0.5328000     -0.8403000     -0.2058000    
 C    2.980600     -0.3950000      0.1863000    
 C    4.031900      -1.447400     -0.1622000    
 C    3.030300     -6.1299998E-02   1.677000    
 C   -1.871300     -0.3944000     -0.1177000    
 C   0.6168000     -0.1529000      0.1322000    
 C    3.183600      0.8184000     -0.6248000    
 C   -2.896400      -1.240700     -0.5093000    
 C   -2.132300      0.8800000      0.3597000    
 C   -4.217200     -0.8010000     -0.4213000    
 C   -3.453100       1.319800      0.4479000    
 C   -4.495500      0.4792000      5.7399999E-02
 C    3.347700       1.807100      -1.286200    
 H    3.872700      -2.364000      0.4175000    
 H    3.965500      -1.733300      -1.219000    
 H    5.049500      -1.088400      2.7700000E-02
 H    2.624500     -0.8836000       2.278000    
 H    2.489500      0.8461000       1.960600    
 H    4.065800      0.1077000       1.998400    
 H  -0.4028000      -1.783900     -0.5625000    
 H   -2.690700      -2.239900     -0.8833000    
 H   -1.380200       1.586200      0.6803000    
 H   -5.029000      -1.455300     -0.7252000    
 H   -3.671400       2.316600      0.8204000    
 H   -5.523900      0.8216000      0.1261000    
 H    3.492500       2.684100      -1.872500    


%chk=000022717-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022717

0 1
O 1.675921 -0.887238 0.001217
O 0.629510 1.119218 0.726092
N -0.560694 -0.730859 -0.157038
C 3.078526 -0.357657 0.242705
C 3.957936 -1.543085 -0.209516
C 3.271539 -0.039493 1.742605
C -1.916965 -0.308099 -0.086210
C 0.571367 -0.035114 0.241078
C 3.323817 0.823809 -0.612891
C -2.907741 -1.221650 -0.537390
C -2.304730 0.966169 0.406680
C -4.271144 -0.867055 -0.496280
C -3.674911 1.304072 0.441358
C -4.665420 0.399658 -0.005408
C 3.595366 1.777397 -1.343801
H 3.731016 -2.429655 0.406771
H 3.767213 -1.783095 -1.268062
H 5.023565 -1.284039 -0.090186
H 3.026311 -0.933410 2.342719
H 2.629397 0.798416 2.050762
H 4.326203 0.231150 1.926842
H -0.378397 -1.659427 -0.543888
H -2.609971 -2.206871 -0.918960
H -1.541771 1.667671 0.749783
H -5.024322 -1.581034 -0.847566
H -3.967789 2.288894 0.822496
H -5.724710 0.675330 0.026829
H 3.802880 2.629797 -1.964342


