%chk=000041531.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041531

0 1
 O  -0.4278000      -1.634400     -0.1403000    
 O   -1.609100       2.383100      0.8172000    
 O    6.195000     -0.7393000     -0.1827000    
 O    4.574700     -0.3858000       1.367800    
 C  -3.2299999E-02  0.8008000      7.2899997E-02
 C   -2.637500     -0.9424000      0.3676000    
 C   0.3640000     -0.5197000     -0.1836000    
 C   -2.621500      0.4296000      0.1051000    
 C   -1.413900      -1.625900      0.8847000    
 C   -1.424000       1.254700      0.3651000    
 C    2.639600      0.2234000     -0.6185000    
 C    1.692100     -0.7940000     -0.5479000    
 C   0.9411000       1.816400      3.1000001E-03
 C    2.264900       1.529600     -0.3352000    
 C   -3.813000      -1.669500      0.1313000    
 C   -3.776100       1.069700     -0.3672000    
 C    4.048900     -8.8000000E-02 -0.9912000    
 C   -4.957700      -1.033200     -0.3492000    
 C   -4.939400      0.3362000     -0.5971000    
 C    4.932100     -0.4113000      0.1981000    
 H   -1.050400      -1.171400       1.816400    
 H   -1.631600      -2.672600       1.126600    
 H    1.986300      -1.820600     -0.7603000    
 H   0.6848000       2.856800      0.1920000    
 H    2.988400       2.339200     -0.3824000    
 H   -3.846000      -2.739400      0.3219000    
 H   -3.782300       2.138000     -0.5686000    
 H    4.491400      0.7632000      -1.522800    
 H    4.070800     -0.9444000      -1.676100    
 H   -5.862900      -1.606200     -0.5279000    
 H   -5.830600      0.8336000     -0.9685000    
 H    6.766100     -0.9477000      0.5873000    


%chk=000041531-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041531

0 1
O -0.310801 -1.691697 0.088951
O -1.588614 2.541873 0.612420
O 5.771301 0.063879 0.576326
O 4.816220 -2.016481 0.174942
C 0.007083 0.812239 0.126343
C -2.648787 -0.948703 0.434991
C 0.448162 -0.531810 -0.103846
C -2.607804 0.439618 0.129234
C -1.441899 -1.612249 1.046603
C -1.397785 1.308679 0.350891
C 2.700245 0.242578 -0.714014
C 1.768063 -0.797607 -0.545942
C 0.991550 1.840580 -0.011595
C 2.305467 1.575940 -0.415405
C -3.835416 -1.681951 0.203375
C -3.769306 1.071932 -0.387725
C 4.123028 -0.062636 -1.182523
C -4.981318 -1.049850 -0.328074
C -4.946554 0.333773 -0.622472
C 4.908077 -0.802976 -0.107021
H -1.090874 -1.072226 1.949039
H -1.645017 -2.662946 1.305321
H 2.051674 -1.842515 -0.708290
H 0.656367 2.864666 0.181096
H 3.025240 2.394995 -0.517401
H -3.862558 -2.750643 0.446562
H -3.723772 2.145941 -0.592533
H 4.651368 0.868254 -1.438709
H 4.093695 -0.716780 -2.071572
H -5.894217 -1.628679 -0.505657
H -5.832290 0.831351 -1.031509
H 6.243572 -0.438048 1.295794


