%chk=000007698.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007698

0 1
 O   -2.716600     -0.1709000     -0.2987000    
 O   -4.468200     -0.3655000       1.195000    
 O    4.328700     -0.2406000       1.189100    
 O    3.946600      -1.679700     -0.4240000    
 N    3.602700     -0.6932000      0.2711000    
 C   -1.414400       1.806000     -0.7697000    
 C  -0.1016000       1.152900     -0.4979000    
 C   -2.563000       1.200600      4.2900000E-02
 C   0.7225000       1.639100      0.5170000    
 C   0.3017000      5.5199999E-02  -1.258300    
 C    1.950000       1.027600      0.7714000    
 C    1.529300     -0.5564000      -1.003800    
 C    2.353500     -7.0100002E-02  1.1200000E-02
 C   -3.713300     -0.8395000      0.3567000    
 C   -3.757800      -2.265500     -0.1020000    
 H   -1.642300       1.718500      -1.840100    
 H   -1.347600       2.881100     -0.5616000    
 H   -3.489700       1.739000     -0.1879000    
 H   -2.356500       1.289900       1.116500    
 H   0.4181000       2.492300       1.117500    
 H  -0.3306000     -0.3338000      -2.052100    
 H    2.565700       1.433000       1.570400    
 H    1.810700      -1.409500      -1.615900    
 H   -2.805200      -2.754500      0.1166000    
 H   -3.973500      -2.303400      -1.172700    
 H   -4.551800      -2.794400      0.4330000    


%chk=000007698-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007698

0 1
O -2.807126 -0.162772 -0.388479
O -4.400010 -0.464010 1.284736
O 4.515280 -0.094689 1.113857
O 3.965842 -1.793952 -0.305175
N 3.703932 -0.681259 0.297134
C -1.446496 1.833250 -0.719315
C -0.094964 1.183385 -0.467070
C -2.586831 1.223271 0.113824
C 0.838911 1.779698 0.421383
C 0.248831 -0.042214 -1.098722
C 2.085503 1.177340 0.681793
C 1.489529 -0.660657 -0.854805
C 2.392943 -0.039334 0.035768
C -3.761185 -0.920159 0.311729
C -3.874677 -2.306713 -0.281200
H -1.719637 1.755525 -1.787794
H -1.399379 2.910436 -0.471472
H -3.524891 1.794086 -0.011075
H -2.344297 1.179389 1.190645
H 0.588860 2.728142 0.910892
H -0.469846 -0.512000 -1.777207
H 2.815311 1.625753 1.360902
H 1.770895 -1.602237 -1.333592
H -2.899832 -2.822172 -0.231240
H -4.161641 -2.245541 -1.345235
H -4.627627 -2.884368 0.273419


