%chk=000015797.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015797

0 1
 O    1.263600      -1.910500      0.2306000    
 O   -3.171900      -1.701600       1.981500    
 O   -4.955800      -1.565600     -0.9029000    
 C    5.868600     -0.1829000      0.2515000    
 C    6.944500      0.6515000     -0.4496000    
 C    4.543300     -0.2323000     -0.5119000    
 C    8.245500      0.7621000      0.3484000    
 C    3.501000      -1.056800      0.2423000    
 C    9.255800       1.663600     -0.3628000    
 C    2.191200      -1.146900     -0.5280000    
 C    10.53680       1.808800      0.4431000    
 C  -6.4400002E-02  -1.615600      6.2100001E-02
 C  -0.9603000      -1.806700       1.114100    
 C  -0.5202000      -1.126300      -1.162000    
 C   -2.767800      -1.019300     -0.2825000    
 C   -2.312100      -1.508600      0.9418000    
 C   -1.871700     -0.8282000      -1.334400    
 C   -4.174700     -0.7006000     -0.4828000    
 C   -4.735200      0.6538000     -0.1984000    
 C   -3.902600       1.667600      0.2760000    
 C   -6.091100      0.9056000     -0.4075000    
 C   -4.426100       2.933000      0.5414000    
 C   -6.614400       2.171000     -0.1421000    
 C   -5.781800       3.184800      0.3324000    
 H    5.690700      0.2326000       1.251400    
 H    6.244900      -1.203200      0.3956000    
 H    6.548300       1.658500     -0.6314000    
 H    7.156400      0.2131000      -1.432600    
 H    4.711400     -0.6661000      -1.505000    
 H    4.168500      0.7872000     -0.6629000    
 H    8.029400       1.168100       1.344100    
 H    8.674300     -0.2368000      0.4922000    
 H    3.880200      -2.069100      0.4302000    
 H    3.313700     -0.6184000       1.230600    
 H    8.820800       2.656800     -0.5246000    
 H    9.494400       1.249000      -1.349100    
 H    1.831100     -0.1236000     -0.6967000    
 H    2.356000      -1.638500      -1.493900    
 H    11.01480      0.8362000      0.5981000    
 H    11.24520       2.455400     -8.4100001E-02
 H    10.33570       2.253200       1.423100    
 H  -0.5965000      -2.188400       2.064900    
 H   0.1386000     -0.9895000      -2.014300    
 H   -2.216300     -0.4532000      -2.294800    
 H   -2.842600       1.511500      0.4517000    
 H   -6.761600      0.1342000     -0.7764000    
 H   -2.675700      -2.042700       2.745300    
 H   -3.778300       3.722500      0.9110000    
 H   -7.670100       2.367500     -0.3048000    
 H   -6.189400       4.170000      0.5390000    


%chk=000015797-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015797

0 1
O 1.294432 -0.220386 0.664916
O -3.384354 -0.732602 1.699535
O -4.386443 -0.864379 -2.250644
C 6.270256 0.100820 0.389716
C 7.507958 0.424753 -0.476563
C 4.938307 0.214959 -0.385399
C 8.843746 0.280052 0.286662
C 3.704177 -0.066449 0.502256
C 10.080511 0.621422 -0.575482
C 2.400453 -0.012983 -0.295571
C 11.412033 0.462991 0.189747
C -0.012123 -0.230199 0.172361
C -1.019013 -0.441594 1.143599
C -0.363740 -0.060669 -1.193323
C -2.763018 -0.265570 -0.597642
C -2.376024 -0.461458 0.762699
C -1.723636 -0.097126 -1.548732
C -4.170483 -0.321872 -1.118122
C -5.306689 0.316994 -0.374013
C -5.108658 1.393587 0.529105
C -6.628758 -0.115914 -0.660294
C -6.214285 2.026217 1.135323
C -7.732186 0.502520 -0.039591
C -7.527635 1.578065 0.858794
H 6.245820 0.784221 1.264074
H 6.367575 -0.925681 0.800285
H 7.420404 1.459839 -0.868416
H 7.520149 -0.242778 -1.363870
H 4.954559 -0.492903 -1.240740
H 4.856898 1.231814 -0.823091
H 8.830180 0.937504 1.181375
H 8.939320 -0.758636 0.666935
H 3.796178 -1.062982 0.975151
H 3.651487 0.675493 1.322008
H 9.988116 1.661980 -0.948555
H 10.089358 -0.030159 -1.473361
H 2.275146 0.971807 -0.791668
H 2.371921 -0.808666 -1.068114
H 11.541873 -0.575840 0.547858
H 12.279273 0.710580 -0.449682
H 11.443576 1.127644 1.073865
H -0.714499 -0.602841 2.184433
H 0.395794 0.092992 -1.963410
H -2.019188 0.006025 -2.597974
H -4.092820 1.742348 0.741876
H -6.763969 -0.932817 -1.376879
H -2.998403 -0.901266 2.595006
H -6.055455 2.866494 1.820425
H -8.748507 0.155060 -0.255895
H -8.385511 2.065788 1.335927


