%chk=000068248.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068248

0 1
 O  -0.4236000      0.7870000     -0.1303000    
 O   0.6399000      -2.722400     -1.5799999E-02
 O   -4.350700      -2.105500      0.1956000    
 O    4.636700      0.5510000       2.037400    
 O    5.884500      0.6958000     -0.4422000    
 O   -4.784200       2.615300     -6.8999999E-03
 C   -2.394800     -0.6894000      3.3799998E-02
 C   0.3736000     -0.3479000     -0.1151000    
 C   -1.809400      0.6547000     -5.8100000E-02
 C    1.809600     -7.5900003E-02 -0.1968000    
 C  -0.1385000      -1.586500     -3.2299999E-02
 C   -1.571500      -1.757500      4.4799998E-02
 C   -3.848200     -0.8234000      0.1101000    
 C   -2.586000       1.746300     -7.2700001E-02
 C    2.554300      0.1111000      0.9694000    
 C    2.438600     -2.4000001E-03  -1.441200    
 C   -4.644200      0.2563000      9.6699998E-02
 C   -4.064700       1.622000      4.1999999E-03
 C    3.922700      0.3706000      0.8915000    
 C    3.806800      0.2571000      -1.519200    
 C    4.548900      0.4435000     -0.3529000    
 H   -1.919800      -2.783400      9.2699997E-02
 H   -2.167700       2.744400     -0.1400000    
 H    2.074300      5.6499999E-02   1.944200    
 H    1.873800     -0.1450000      -2.359500    
 H   -5.723400      0.1692000      0.1528000    
 H    4.288700      0.3127000      -2.491500    
 H    1.578000      -2.478800     -7.2300002E-02
 H   -3.772800      -2.636700      0.7668000    
 H    5.446000       1.050800       1.843500    
 H    6.318900      0.4592000      0.3931000    


%chk=000068248-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068248

0 1
O -0.447149 0.688263 -0.419156
O 0.689231 -2.647889 0.797880
O -4.452791 -1.880923 0.958936
O 5.240654 -0.570547 1.393914
O 5.920669 1.052106 -0.639285
O -4.878498 2.381427 -1.205549
C -2.393239 -0.679505 0.253783
C 0.427724 -0.323995 0.001145
C -1.858804 0.545821 -0.340024
C 1.843150 0.022562 -0.155638
C -0.100811 -1.530214 0.465564
C -1.512488 -1.700399 0.609369
C -3.845580 -0.753373 0.379055
C -2.641811 1.564130 -0.826250
C 2.827322 -0.499278 0.743657
C 2.254998 0.909707 -1.190181
C -4.654165 0.249761 -0.108716
C -4.105321 1.460048 -0.752926
C 4.174033 -0.148097 0.573408
C 3.610503 1.250818 -1.352791
C 4.581403 0.718329 -0.481068
H -1.851385 -2.677283 0.970724
H -2.203961 2.461211 -1.270330
H 2.524744 -1.090292 1.617250
H 1.500665 1.325634 -1.863061
H -5.741552 0.175413 -0.015085
H 3.935617 1.926997 -2.148120
H 1.580639 -2.585482 0.365082
H -3.828374 -2.378476 1.543465
H 4.944082 -1.130052 2.150897
H 6.456294 0.612278 0.073851


