%chk=000041161.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041161

0 1
 O   0.7703000      -2.104500      0.2835000    
 O    3.715400       3.411600      0.2945000    
 O    2.480700      -3.395000     -0.5583000    
 O    1.541700       2.999700      0.9746000    
 C   -4.216500     -0.4121000     -0.2887000    
 C   -3.521200      -1.456900      0.5865000    
 C   -5.587900      1.4600000E-02  0.2438000    
 C   -2.144400      -1.822000      2.5599999E-02
 C   -6.323500       1.076300     -0.5795000    
 C   -1.435400      -2.846000      0.9169000    
 C   -7.659100       1.502200      3.0400001E-02
 C  -7.2400004E-02  -3.244900      0.3644000    
 C   -8.304800       2.619900     -0.7743000    
 C    4.283200       1.285000     -0.3057000    
 C    2.980200       1.280400      0.1487000    
 C    2.803400      -1.055500     -0.2300000    
 C    4.829500       2.652200     -0.2389000    
 C    2.211500      0.1324000      0.2008000    
 C    2.026500      -2.320300     -0.1972000    
 C    4.880400      0.1140000     -0.7349000    
 C    4.129800      -1.065100     -0.6950000    
 C    2.612600       2.633900      0.5327000    
 H   -3.577300      0.4758000     -0.3703000    
 H   -4.336600     -0.8097000      -1.304000    
 H   -4.145500      -2.356100      0.6508000    
 H   -3.411400      -1.065100       1.604900    
 H   -5.460600      0.3925000       1.266400    
 H   -6.227400     -0.8739000      0.3212000    
 H   -2.256600      -2.230800     -0.9859000    
 H   -1.534600     -0.9145000     -5.7999998E-02
 H   -5.674600       1.955500     -0.6784000    
 H   -6.490800      0.6920000      -1.593200    
 H   -2.057700      -3.741900       1.023400    
 H   -1.304400      -2.411800       1.915700    
 H   -8.338200      0.6430000      7.2400004E-02
 H   -7.505100       1.845400       1.059900    
 H   0.3831000      -3.986400       1.031100    
 H  -0.1885000      -3.689000     -0.6314000    
 H   -7.662100       3.505700     -0.8024000    
 H   -8.496700       2.301200      -1.803900    
 H   -9.259900       2.907600     -0.3240000    
 H    5.672300       2.734500      0.4524000    
 H    5.085400       3.051000      -1.224000    
 H    1.192600      0.1892000      0.5672000    
 H    5.903800      0.1041000      -1.094100    
 H    4.594300      -1.988900      -1.031400    


%chk=000041161-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000041161

0 1
O 0.781792 -2.088964 0.310311
O 4.055927 3.498186 0.407873
O 2.451495 -3.392239 -0.663633
O 1.876515 3.194587 1.214485
C -4.311730 -0.373931 -0.263674
C -3.572136 -1.412929 0.608729
C -5.694131 0.024851 0.300350
C -2.199557 -1.823246 0.030542
C -6.426470 1.077231 -0.562316
C -1.453506 -2.839321 0.923680
C -7.814290 1.467355 -0.004375
C -0.109032 -3.292248 0.356532
C -8.536306 2.524114 -0.868161
C 4.482605 1.269340 -0.319644
C 3.179497 1.325849 0.221834
C 2.853723 -1.023364 -0.234527
C 5.100799 2.648918 -0.227798
C 2.344870 0.195592 0.276015
C 2.047502 -2.283792 -0.230612
C 4.994366 0.059949 -0.827507
C 4.168082 -1.083516 -0.779158
C 2.887549 2.710162 0.683853
H -3.681174 0.534043 -0.363477
H -4.438038 -0.778806 -1.289749
H -4.209149 -2.315396 0.723510
H -3.431608 -0.999128 1.629197
H -5.569517 0.419208 1.330707
H -6.329316 -0.881657 0.389465
H -2.341909 -2.257742 -0.981189
H -1.568328 -0.922730 -0.099728
H -5.796579 1.987809 -0.643693
H -6.544663 0.688557 -1.595713
H -2.078027 -3.746645 1.057247
H -1.296889 -2.410419 1.932697
H -8.444495 0.557608 0.072753
H -7.695724 1.851429 1.029489
H 0.383457 -4.054461 0.987381
H -0.197575 -3.692104 -0.670661
H -7.942427 3.455445 -0.932811
H -8.691319 2.154192 -1.899475
H -9.526424 2.783159 -0.449729
H 5.999567 2.684478 0.413403
H 5.337469 3.088203 -1.213349
H 1.337619 0.252442 0.696614
H 6.002435 -0.002723 -1.250078
H 4.518548 -2.048046 -1.161310


