%chk=000007176.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007176

0 1
 O   -1.436400     -6.3299999E-02  0.1220000    
 O  -0.7003000      -2.214100     -0.1751000    
 N    4.786000       1.083100      6.3400000E-02
 C   -3.739200      0.6556000      0.2895000    
 C   -2.780900     -0.5247000      0.1080000    
 C   -3.588300       1.675000     -0.8416000    
 C   -5.182300      0.1626000      0.3706000    
 C   0.8977000     -0.4742000     -7.7999998E-03
 C  -0.4623000      -1.019300     -3.1500001E-02
 C    1.982700      -1.330000     -0.1526000    
 C    1.087100      0.8919000      0.1603000    
 C    3.477000      0.5586000      3.9600000E-02
 C    3.277400     -0.8116000     -0.1288000    
 C    2.381800       1.410400      0.1838000    
 H   -3.488100       1.167300       1.227300    
 H   -2.920200      -1.241600      0.9265000    
 H   -2.981900      -1.033200     -0.8430000    
 H   -4.279900       2.512900     -0.7028000    
 H   -3.798900       1.220600      -1.815800    
 H   -2.573900       2.086100     -0.8714000    
 H   -5.870700      0.9989000      0.5318000    
 H   -5.307800     -0.5377000       1.203200    
 H   -5.480700     -0.3491000     -0.5508000    
 H    1.849100      -2.400100     -0.2845000    
 H   0.2604000       1.586600      0.2759000    
 H    4.122700      -1.485500     -0.2424000    
 H    2.524700       2.480000      0.3155000    
 H    4.931300       2.076400      0.1860000    
 H    5.580500      0.4660000     -4.0500000E-02


%chk=000007176-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007176

0 1
O -1.454220 -0.047977 0.168336
O -0.736558 -2.227810 -0.257107
N 4.867742 1.075136 0.092091
C -3.784316 0.672342 0.265499
C -2.856583 -0.545746 0.151660
C -3.631005 1.613518 -0.950756
C -5.245278 0.187034 0.424454
C 0.902862 -0.438916 -0.006403
C -0.459098 -1.016157 -0.050534
C 2.013085 -1.297808 -0.231972
C 1.145175 0.937589 0.253903
C 3.568793 0.578938 0.060064
C 3.324779 -0.804401 -0.201294
C 2.453802 1.442428 0.288183
H -3.495305 1.228181 1.180500
H -2.988282 -1.245900 0.998272
H -3.025929 -1.105684 -0.788088
H -4.259768 2.515116 -0.832208
H -3.943249 1.102000 -1.881973
H -2.581715 1.933910 -1.071923
H -5.931027 1.048224 0.520365
H -5.370521 -0.448666 1.320979
H -5.565547 -0.399961 -0.457904
H 1.818294 -2.357088 -0.431030
H 0.293617 1.600796 0.430512
H 4.170486 -1.479949 -0.378319
H 2.626508 2.506419 0.491320
H 5.046547 2.058048 0.277106
H 5.663310 0.463984 -0.068934


