%chk=000018744.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018744

0 1
 O   0.7513000      -2.163800       1.022300    
 O  -0.9351000      -2.544800     -0.4490000    
 C  -0.4287000     -0.2521000      0.2621000    
 C   0.4785000      0.4494000     -0.7857000    
 C   -1.891000      0.1524000      0.1340000    
 C    1.921700      0.4911000     -0.4115000    
 C  -0.2592000      -1.764300      0.2057000    
 C   -2.409700      0.3873000      -1.122700    
 C   -2.652400      0.2711000       1.278300    
 C    2.421500       1.568300      0.3206000    
 C    2.771700     -0.5470000     -0.7931000    
 C   -3.749300      0.7577000      -1.240200    
 C   -3.992100      0.6413000       1.160700    
 C    3.771100       1.607300      0.6707000    
 C    4.121300     -0.5079000     -0.4428000    
 C   -4.540500      0.8846000     -9.8700002E-02
 C    4.620900      0.5693000      0.2891000    
 H  -0.1041000      7.5000003E-02   1.261300    
 H   0.1426000       1.483500     -0.9460000    
 H   0.3861000     -4.4300001E-02  -1.763000    
 H   -1.826600      0.2769000      -2.030400    
 H   -2.235300      8.0899999E-02   2.262600    
 H    1.769300       2.382000      0.6265000    
 H    2.397700      -1.390800      -1.366900    
 H   -4.178000      0.9424000      -2.220900    
 H   -4.608600      0.7392000       2.049400    
 H    4.160100       2.445600       1.241300    
 H    4.783200      -1.315800     -0.7405000    
 H   -5.584000       1.171600     -0.1903000    
 H    5.671800      0.5997000      0.5619000    
 H   0.8695000      -3.137400       1.007600    


%chk=000018744-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018744

0 1
O -0.024217 -2.353498 1.275931
O 0.042783 -2.177307 -1.035203
C -0.380868 -0.152486 0.339563
C 0.479061 0.738720 -0.618193
C -1.881866 0.121663 0.164257
C 1.973693 0.643519 -0.345003
C -0.095796 -1.629494 0.082451
C -2.543752 -0.198564 -1.049616
C -2.617251 0.735348 1.207957
C 2.576947 1.459333 0.647598
C 2.789514 -0.272658 -1.058732
C -3.914612 0.096558 -1.214049
C -3.989009 1.033477 1.042320
C 3.959102 1.362751 0.923988
C 4.172636 -0.371330 -0.785440
C -4.641922 0.715690 -0.170442
C 4.762227 0.444860 0.207404
H -0.098050 0.061491 1.384590
H 0.130255 1.780067 -0.489246
H 0.256049 0.438779 -1.657849
H -1.988749 -0.691420 -1.856614
H -2.116446 0.977243 2.153266
H 1.961093 2.181878 1.198854
H 2.333744 -0.908747 -1.826490
H -4.416556 -0.158460 -2.154195
H -4.545986 1.508587 1.857713
H 4.410191 2.003964 1.689947
H 4.789484 -1.081293 -1.348154
H -5.705715 0.944181 -0.299782
H 5.835293 0.370893 0.417262
H 0.132424 -3.315348 1.068306


