%chk=000079929.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079929

0 1
 O    3.319800     -8.3999997E-03  0.3465000    
 C   0.9566000     -2.5599999E-02 -4.1600000E-02
 C  -0.1640000     -2.5500000E-02  -1.088500    
 C    2.337900      8.2999999E-03 -0.6805000    
 C   -1.519100     -9.9999998E-03 -0.4653000    
 C   -2.162200      -1.210700     -0.1643000    
 C   -2.143300       1.205100     -0.1838000    
 C    4.635900      2.1800000E-02 -0.1891000    
 C   -3.429700      -1.196100      0.4181000    
 C   -3.410700       1.219700      0.3987000    
 C   -4.053800      1.8999999E-02  0.6996000    
 C    5.632500      2.3000001E-03  0.9502000    
 H   0.8758000     -0.9107000      0.6029000    
 H   0.8511000      0.8352000      0.6318000    
 H  -5.3599998E-02  0.8433000      -1.750500    
 H  -6.4300001E-02 -0.9043000      -1.738800    
 H    2.471800     -0.8647000      -1.330000    
 H    2.450700      0.9177000      -1.282200    
 H   -1.685700      -2.164100     -0.3770000    
 H   -1.652100       2.147400     -0.4116000    
 H    4.794400     -0.8509000     -0.8325000    
 H    4.773400      0.9319000     -0.7837000    
 H   -3.930300      -2.130900      0.6530000    
 H   -3.896600       2.165800      0.6185000    
 H   -5.040400      3.0500000E-02   1.153400    
 H    6.658600      2.4700001E-02  0.5727000    
 H    5.480200      0.8624000       1.610600    
 H    5.500900     -0.8960000       1.562400    


%chk=000079929-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079929

0 1
O 3.349396 0.000161 0.323514
C 0.966338 0.005267 -0.096851
C -0.174943 -0.000677 -1.150780
C 2.352890 0.005644 -0.749312
C -1.554457 0.000240 -0.507027
C -2.201772 -1.217811 -0.173844
C -2.206864 1.219091 -0.186829
C 4.727558 0.003091 -0.180364
C -3.463443 -1.220304 0.462616
C -3.468570 1.222998 0.449565
C -4.102115 0.001726 0.777382
C 5.661240 -0.004791 1.030750
H 0.878588 -0.880899 0.559463
H 0.874329 0.894907 0.554057
H -0.064955 0.886958 -1.805657
H -0.062655 -0.893999 -1.797405
H 2.482348 -0.892467 -1.398877
H 2.485035 0.908042 -1.392332
H -1.713824 -2.170050 -0.419132
H -1.722968 2.170707 -0.442347
H 4.898871 -0.892276 -0.821555
H 4.899151 0.906455 -0.810140
H -3.948939 -2.171739 0.709174
H -3.958138 2.174959 0.685872
H -5.082096 0.002323 1.268043
H 6.718207 -0.002768 0.706119
H 5.482854 0.885439 1.658219
H 5.482734 -0.903027 1.646681


