%chk=000078727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078727

0 1
 O    9.313800     -0.6937000      0.1791000    
 O   -9.343400      0.7259000      0.1561000    
 O    8.327700       1.382300     -2.4100000E-02
 O   -8.369600      -1.356200     -4.2100001E-02
 C   0.6934000      0.4044000     -0.1788000    
 C  -0.5939000     -0.4222000     -0.1547000    
 C    1.929200     -0.4916000     -6.9200002E-02
 C   -1.865500      0.4315000     -0.1702000    
 C    3.218300      0.3298000     -0.1250000    
 C   -3.184600     -0.3401000     -6.1500002E-02
 C    4.454100     -0.5683000     -4.9300000E-02
 C   -4.452700      0.5186000     -2.2600001E-02
 C    5.742300      0.2553000     -7.1599998E-02
 C   -5.774400     -0.2540000      1.1300000E-02
 C    6.976200     -0.6388000      3.7500001E-02
 C   -7.001800      0.6483000      0.1314000    
 C    8.257100      0.1636000      5.5799998E-02
 C   -8.290500     -0.1403000      6.6299997E-02
 C    10.60560     -7.8400001E-02  0.2148000    
 C   -10.64130      0.1241000      0.1167000    
 H   0.6866000       1.120300      0.6519000    
 H   0.7352000      0.9863000      -1.107400    
 H  -0.6082000      -1.103500      -1.014200    
 H  -0.6025000      -1.048900      0.7458000    
 H    1.893000      -1.056700      0.8701000    
 H    1.924800      -1.222500     -0.8870000    
 H   -1.880300       1.027400      -1.091400    
 H   -1.816600       1.147800      0.6599000    
 H    3.245300      0.9113000      -1.054500    
 H    3.231300       1.046400      0.7053000    
 H   -3.156600     -0.9621000      0.8419000    
 H   -3.253600      -1.031700     -0.9105000    
 H    4.451600      -1.270900     -0.8914000    
 H    4.416700      -1.165100      0.8701000    
 H   -4.456200       1.179600     -0.8985000    
 H   -4.401600       1.172200      0.8574000    
 H    5.791300      0.8424000     -0.9972000    
 H    5.734500      0.9742000      0.7573000    
 H   -5.759300     -0.9575000      0.8535000    
 H   -5.851700     -0.8637000     -0.8978000    
 H    7.013200      -1.324400     -0.8164000    
 H    6.927700      -1.222900      0.9635000    
 H   -6.972500       1.186900       1.084900    
 H   -7.005200       1.373800     -0.6897000    
 H    11.35540     -0.8676000      0.3149000    
 H    10.68260      0.5905000       1.077300    
 H    10.79120      0.4666000     -0.7156000    
 H   -11.38730      0.9193000      0.1967000    
 H   -10.76670     -0.5613000      0.9604000    
 H   -10.78710     -0.4000000     -0.8326000    


%chk=000078727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078727

0 1
O 9.463631 -0.733710 0.021680
O -9.456681 0.729207 -0.031453
O 8.500729 1.384874 -0.067513
O -8.493651 -1.390146 0.035694
C 0.661191 0.403464 -0.012226
C -0.654112 -0.407697 -0.002468
C 1.926932 -0.482885 0.001952
C -1.919926 0.478546 -0.016926
C 3.241980 0.328500 -0.008935
C -3.234929 -0.332893 -0.006443
C 4.507040 -0.558672 0.006426
C -4.500070 0.554157 -0.021656
C 5.816572 0.259838 -0.009434
C -5.809584 -0.264399 -0.006435
C 7.066104 -0.641258 0.008502
C -7.059183 0.636600 -0.024501
C 8.368734 0.141194 -0.018554
C -8.361745 -0.146084 -0.002424
C 10.799330 -0.089887 -0.001522
C -10.792340 0.085188 -0.012126
H 0.679502 1.082195 0.866169
H 0.681753 1.057071 -0.909437
H -0.672283 -1.086598 -0.880731
H -0.674815 -1.061161 0.894864
H 1.906378 -1.136036 0.899594
H 1.907942 -1.161970 -0.876247
H -1.899197 1.131753 -0.914526
H -1.901179 1.157659 0.861275
H 3.262923 0.980656 -0.906910
H 3.260669 1.008356 0.868285
H -3.255938 -0.985454 0.891250
H -3.253460 -1.012449 -0.883907
H 4.484693 -1.240395 -0.869886
H 4.485648 -1.208600 0.906600
H -4.478586 1.204459 -0.921562
H -4.477879 1.235605 0.854885
H 5.843982 0.908379 -0.906013
H 5.843374 0.943195 0.861034
H -5.837121 -0.913176 0.890001
H -5.836157 -0.947569 -0.877019
H 7.066340 -1.333585 -0.856504
H 7.074687 -1.289691 0.906602
H -7.061322 1.327194 0.841812
H -7.065969 1.286831 -0.921377
H 11.513896 -0.924028 0.036848
H 10.918873 0.576776 0.869197
H 10.924803 0.499334 -0.925640
H -11.506948 0.919646 -0.041821
H -10.916434 -0.512383 0.906803
H -10.913197 -0.573553 -0.888676


