%chk=000040082.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040082

0 1
 O    2.875700     -0.1531000     -0.4283000    
 O   -2.500900      -2.738600      0.9250000    
 O    1.106500       2.479900      3.4699999E-02
 O  -0.4328000      -2.408700      4.1400000E-02
 O    3.166700       1.102500       1.505600    
 N   0.2004000      0.2946000      0.2224000    
 C   -1.165700      0.4559000     -2.6000001E-02
 C   -2.036200     -0.6333000      1.1700000E-02
 C   -1.655000       1.730300     -0.3125000    
 C   -3.396200     -0.4481000     -0.2371000    
 C   -3.015000       1.915500     -0.5613000    
 C   -3.885600      0.8263000     -0.5236000    
 C    1.181300       1.277300      0.2225000    
 C   -1.557700      -1.978100      0.3070000    
 C    4.170100     -0.7445000     -0.2844000    
 C    2.541400      0.7286000      0.5329000    
 C    4.403000      -1.706300      -1.430000    
 H   -1.044900       2.621400     -0.3615000    
 H   0.5116000     -0.6518000      0.4256000    
 H   -4.098800      -1.277400     -0.2291000    
 H   -3.397300       2.907100     -0.7856000    
 H   -4.943900      0.9704000     -0.7207000    
 H    4.934600      4.0600002E-02 -0.2986000    
 H    4.221700      -1.283800      0.6681000    
 H    5.386200      -2.178500      -1.350800    
 H    3.635200      -2.487000      -1.439500    
 H    4.337400      -1.184600      -2.390600    
 H   -2.171400      -3.641700       1.120400    


%chk=000040082-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000040082

0 1
O 2.767201 -0.212514 -0.181622
O -2.105640 -2.949405 -0.537800
O 0.917149 2.837292 0.203010
O 0.032640 -2.085295 -0.419547
O 3.648622 1.930764 0.120718
N 0.293929 0.567267 -0.088587
C -1.115636 0.640829 -0.089190
C -1.883706 -0.570536 -0.244650
C -1.806755 1.876919 0.059429
C -3.303945 -0.504349 -0.247406
C -3.213413 1.907984 0.052425
C -3.972549 0.722024 -0.100835
C 1.195070 1.616467 0.052023
C -1.218480 -1.878518 -0.400797
C 4.142332 -0.804601 -0.245997
C 2.675688 1.163487 0.006263
C 3.964111 -2.304622 -0.448231
H -1.225199 2.792311 0.178025
H 0.692144 -0.387594 -0.207714
H -3.862958 -1.435872 -0.366579
H -3.721994 2.871386 0.168494
H -5.066186 0.758419 -0.105206
H 4.680305 -0.318291 -1.079618
H 4.661791 -0.555686 0.696889
H 4.955064 -2.791606 -0.496552
H 3.395265 -2.749700 0.385196
H 3.423735 -2.515087 -1.386216
H -1.578186 -3.786573 -0.638225


