%chk=000115667.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115667

0 1
 O   -3.920300     -0.5034000     -0.2034000    
 N    2.823600     -0.6606000      -1.330700    
 C   0.2359000      0.3434000     -0.1563000    
 C  -0.2675000     -0.9057000      0.5807000    
 C  -0.7445000       1.512300      1.2800000E-02
 C   -1.681000      -1.282400      0.1469000    
 C   -2.156700       1.128800     -0.4190000    
 C   -2.651900     -0.1164000      0.3137000    
 C    1.629300      0.7332000      0.3333000    
 C    2.688300     -0.3521000      9.2900001E-02
 C    4.044900      0.1030000      0.6291000    
 H   0.2737000      0.1193000      -1.229800    
 H  -0.2542000     -0.7346000       1.664500    
 H   0.3759000      -1.768500      0.3825000    
 H  -0.4079000       2.372600     -0.5781000    
 H  -0.7637000       1.835200       1.061600    
 H   -1.674700      -1.612700     -0.9003000    
 H   -2.034900      -2.143900      0.7261000    
 H   -2.843400       1.964200     -0.2367000    
 H   -2.182500      0.9556000      -1.502700    
 H    1.589700      0.9645000       1.406100    
 H    1.939200       1.661100     -0.1668000    
 H   -2.778600      0.1035000       1.380500    
 H    2.430200      -1.271500      0.6271000    
 H    3.987800      0.3047000       1.704200    
 H    4.389300       1.017500      0.1330000    
 H    4.806500     -0.6704000      0.4776000    
 H   -4.526100      0.2481000     -8.6199999E-02
 H    2.958900      0.1986000      -1.862000    
 H    1.968500      -1.086300      -1.683000    


%chk=000115667-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115667

0 1
O -4.034309 -0.524866 -0.188172
N 2.914650 -0.726529 -1.336786
C 0.221500 0.331255 -0.131454
C -0.328665 -0.934333 0.579560
C -0.764830 1.514182 0.058656
C -1.765726 -1.284124 0.123548
C -2.196119 1.158000 -0.410749
C -2.716112 -0.095531 0.321855
C 1.639644 0.718368 0.355827
C 2.758156 -0.337202 0.085711
C 4.117311 0.173877 0.606489
H 0.273963 0.114928 -1.222640
H -0.315605 -0.759837 1.676666
H 0.331703 -1.802679 0.393305
H -0.398763 2.403303 -0.491278
H -0.786169 1.793895 1.133708
H -1.772001 -1.550823 -0.952033
H -2.152960 -2.158914 0.677752
H -2.879708 2.014951 -0.236661
H -2.199668 0.950516 -1.499670
H 1.599366 0.922973 1.447464
H 1.941761 1.670591 -0.132665
H -2.791986 0.134694 1.410363
H 2.508760 -1.263326 0.640417
H 4.065796 0.423489 1.681973
H 4.424451 1.089129 0.062307
H 4.895526 -0.592934 0.453262
H -4.666241 0.235564 -0.116418
H 3.227853 0.046490 -1.936148
H 2.102222 -1.208006 -1.736588


