%chk=000085550.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085550

0 1
 O    3.550400      0.3501000     -8.5600004E-02
 O   -1.000800      -1.584600     -2.7899999E-02
 O   -3.433900      0.1895000      -1.290200    
 N   0.8023000     -0.1548000      0.2798000    
 C    1.779400      -1.240700      0.3591000    
 C    1.358300       1.176200      0.5459000    
 C    3.006400     -0.9124000     -0.4794000    
 C    2.607100       1.403900     -0.2966000    
 C  -0.5468000     -0.4434000      8.6300001E-02
 C   -1.482900      0.7362000      1.1700000E-02
 C   -2.921600      0.3427000     -0.1823000    
 C   -3.718000      0.1373000       1.079300    
 H    1.340800      -2.190500      3.8800001E-02
 H    2.056600      -1.332900       1.415800    
 H    1.614600       1.194500       1.611700    
 H   0.6369000       1.973100      0.3599000    
 H    3.778900      -1.673100     -0.3301000    
 H    2.764800     -0.8841000      -1.548600    
 H    2.363000       1.461400      -1.364100    
 H    3.086000       2.345700     -1.1400000E-02
 H   -1.197400       1.371400     -0.8342000    
 H   -1.408300       1.332600      0.9270000    
 H   -3.242200     -0.6277000       1.697800    
 H   -4.728300     -0.1962000      0.8259000    
 H   -3.785600       1.079400       1.628900    


%chk=000085550-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085550

0 1
O 3.571108 0.265775 -0.261012
O -1.002690 -1.486123 0.175032
O -3.533576 1.025682 -1.199005
N 0.793577 -0.040105 0.434921
C 1.736231 -1.173240 0.600038
C 1.441015 1.286715 0.514997
C 2.895741 -1.039321 -0.403635
C 2.614434 1.357058 -0.489363
C -0.559007 -0.295622 0.234698
C -1.474676 0.936203 0.075164
C -2.956698 0.591659 -0.167809
C -3.670314 -0.236101 0.881414
H 1.171763 -2.107285 0.443571
H 2.136374 -1.161826 1.633481
H 1.836184 1.436826 1.540417
H 0.717931 2.089582 0.302856
H 3.674984 -1.794258 -0.211448
H 2.514983 -1.153168 -1.441109
H 2.221806 1.307402 -1.528537
H 3.188911 2.288360 -0.355574
H -1.143078 1.554639 -0.778557
H -1.408885 1.561414 0.989650
H -3.236911 -1.253691 0.865543
H -4.748658 -0.278083 0.665667
H -3.500848 0.171112 1.896100


