%chk=000005310.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005310

0 1
 O    3.510000       1.117100      0.2914000    
 C   0.3186000     -0.5274000     -0.1182000    
 C   0.1451000      0.4377000       1.082200    
 C   -1.323800      0.8418000      0.9180000    
 C   -1.519500       1.098800     -0.6091000    
 C  -0.5085000      0.1262000      -1.270500    
 C  -0.2933000      -1.882500      0.3662000    
 C   -2.129800     -0.3745000       1.447300    
 C   -1.784000      -1.711800      0.7605000    
 C    1.251800       1.484300       1.053100    
 C    1.801400     -0.4472000     -0.3779000    
 C    2.343900      0.7537000      0.3270000    
 C   -2.957200      0.7739000      -1.077400    
 C   -1.286600       2.561500      -1.035800    
 C  -0.1637000      -3.054600     -0.6107000    
 C    2.595600      -1.196900      -1.146100    
 H   0.2824000     -9.0400003E-02   2.038800    
 H   -1.570300       1.727100       1.514000    
 H   0.1454000      0.6783000      -1.958100    
 H   -1.007300     -0.6312000      -1.884000    
 H   0.2432000      -2.189000       1.276400    
 H   -3.208200     -0.1908000       1.384000    
 H   -1.920500     -0.4819000       2.520600    
 H   -2.071400      -2.530700       1.433300    
 H   -2.407300      -1.855000     -0.1262000    
 H    1.577500       1.730300       2.068300    
 H    1.006700       2.402700      0.5278000    
 H   -3.084100       1.028300      -2.137200    
 H   -3.239300     -0.2740000     -0.9983000    
 H   -3.689500       1.362500     -0.5125000    
 H  -0.2474000       2.873500     -0.9372000    
 H   -1.543800       2.711600      -2.091200    
 H   -1.903200       3.245100     -0.4418000    
 H   0.8701000      -3.401900     -0.6772000    
 H  -0.7540000      -3.911000     -0.2650000    
 H  -0.5098000      -2.797300      -1.615400    
 H    2.210200      -2.028700      -1.721600    
 H    3.654700     -0.9854000      -1.250200    


%chk=000005310-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005310

0 1
O 3.634695 1.040664 0.357289
C 0.326485 -0.528438 -0.096450
C 0.123793 0.475509 1.102207
C -1.371215 0.851468 0.939642
C -1.582592 1.091965 -0.606125
C -0.526311 0.117832 -1.260513
C -0.267819 -1.901232 0.378505
C -2.149340 -0.390839 1.474467
C -1.775348 -1.713852 0.741644
C 1.279847 1.496612 1.026543
C 1.824875 -0.475877 -0.375842
C 2.416724 0.721121 0.342231
C -3.033085 0.811779 -1.083939
C -1.296471 2.570436 -1.002839
C -0.123417 -3.082553 -0.607192
C 2.614069 -1.237837 -1.179751
H 0.256544 -0.073468 2.055986
H -1.665072 1.745549 1.523849
H 0.133988 0.674687 -1.950806
H -1.020057 -0.666735 -1.864597
H 0.286222 -2.169536 1.303125
H -3.241754 -0.232424 1.396758
H -1.924912 -0.488432 2.555777
H -2.100085 -2.577606 1.354753
H -2.352469 -1.784635 -0.200648
H 1.606599 1.877871 2.009327
H 1.057280 2.382900 0.405453
H -3.121411 1.024004 -2.166417
H -3.348534 -0.232354 -0.926545
H -3.753974 1.466562 -0.557750
H -0.262729 2.890148 -0.794854
H -1.466611 2.709112 -2.087509
H -1.975987 3.259145 -0.465521
H 0.923580 -3.417087 -0.700919
H -0.713826 -3.947429 -0.249423
H -0.499363 -2.822751 -1.615223
H 2.239545 -2.076368 -1.773189
H 3.682236 -0.995709 -1.254205


