%chk=000157520.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157520

0 1
 O    1.231000      0.5460000      0.7805000    
 O  -0.7243000      -2.719600     -0.7574000    
 O   0.7682000      -2.191600      0.8735000    
 O    1.789100      0.7975000      -1.478800    
 N   -2.051200       1.949400      7.1199998E-02
 C  -0.8017000     -0.5506000      0.1210000    
 C  -8.2199998E-02  0.5958000      0.4394000    
 C   -2.145300     -0.4485000     -0.2224000    
 C  -0.7472000       1.810800      0.4000000    
 C   -2.718000      0.8132000     -0.2322000    
 C  -0.1679000      -1.861500      0.1400000    
 C    2.114700      0.6629000     -0.3068000    
 C    3.534700      0.5963000      0.1719000    
 H   -2.754200      -1.312000     -0.4680000    
 H  -0.2363000       2.738200      0.6395000    
 H   -3.763400      0.9468000     -0.4903000    
 H    3.728700       1.417300      0.8663000    
 H    4.210700      0.6935000     -0.6823000    
 H    3.716100     -0.3675000      0.6539000    
 H  -0.2918000      -3.599900     -0.7372000    


%chk=000157520-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157520

0 1
O 1.243913 0.885037 0.618897
O -0.845853 -2.806373 -0.481796
O 1.185742 -1.938562 0.214378
O 1.929521 0.386693 -1.573657
N -2.251866 1.975788 0.209619
C -0.761787 -0.458386 -0.023920
C -0.127145 0.770678 0.310992
C -2.162906 -0.420724 -0.254614
C -0.908337 1.945989 0.419425
C -2.858859 0.797391 -0.132724
C -0.019015 -1.749541 -0.076745
C 2.229495 0.555628 -0.384114
C 3.582200 0.482914 0.266390
H -2.686275 -1.342526 -0.517694
H -0.421075 2.889172 0.687736
H -3.937953 0.849058 -0.308539
H 3.710667 1.291837 1.003109
H 4.370899 0.525610 -0.498506
H 3.647479 -0.479624 0.805136
H -0.309144 -3.643561 -0.501573


