%chk=000019382.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019382

0 1
 O   -1.238000      0.3856000      0.2043000    
 O    4.979600      0.2118000      0.1241000    
 O  -0.8874000       2.659100      0.1160000    
 N   -4.778800     -0.6094000      0.3060000    
 C   -5.478600      -1.889800      0.4048000    
 C   -5.298500      1.4500000E-02 -0.9106000    
 C   -6.908700      -1.525400      3.4800000E-02
 C   -6.790100     -0.2760000     -0.8326000    
 C   -3.332400     -0.7677000      0.2748000    
 C   -2.645200      0.5872000      0.2158000    
 C  -0.4729000       1.510900      0.1527000    
 C   0.9711000       1.165800      0.1446000    
 C    1.853300       2.005500     -0.5042000    
 C    1.386800      1.6799999E-02  0.7861000    
 C    3.655500      0.5263000      0.1297000    
 C    5.318200      -1.173600      0.1710000    
 C    6.646600      -1.379300     -0.5406000    
 C    3.210200       1.682200     -0.5116000    
 C    2.743700     -0.3063000      0.7785000    
 C    7.065500      -2.838500     -0.5437000    
 H   -5.419000      -2.316900       1.410700    
 H   -5.086600      -2.623900     -0.3109000    
 H   -4.879000     -0.4415000      -1.816600    
 H   -5.126000       1.094500     -0.9459000    
 H   -7.406800      -2.342400     -0.4967000    
 H   -7.497400      -1.299300      0.9317000    
 H   -7.326000      0.5554000     -0.3595000    
 H   -7.221100     -0.4308000      -1.826900    
 H   -3.003800      -1.386800     -0.5707000    
 H   -2.993800      -1.290100       1.178900    
 H   -2.918300       1.190900       1.090100    
 H   -2.914600       1.132700     -0.6951000    
 H    1.518500       2.906400      -1.009700    
 H   0.6995000     -0.6370000       1.314600    
 H    5.398900      -1.486200       1.218500    
 H    4.564700      -1.789400     -0.3373000    
 H    7.420400     -0.7704000     -5.7799999E-02
 H    6.573500      -1.011500      -1.571200    
 H    3.915800       2.334400      -1.019200    
 H    3.052400      -1.198300       1.315700    
 H    7.178900      -3.216200      0.4775000    
 H    8.024600      -2.956500      -1.057600    
 H    6.325700      -3.458700      -1.059600    


%chk=000019382-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019382

0 1
O -1.338547 0.308352 0.051667
O 5.080519 0.094062 -0.188083
O -0.894477 2.590314 -0.132728
N -4.977654 -0.508659 0.270140
C -5.738992 -1.720521 0.670142
C -5.653603 0.001866 -0.955567
C -7.206384 -1.275287 0.494649
C -7.164717 -0.312588 -0.737564
C -3.522974 -0.711100 0.151254
C -2.789725 0.633133 0.093290
C -0.473135 1.406988 -0.062789
C 0.953654 0.998031 -0.089399
C 1.945661 2.013577 -0.189531
C 1.358439 -0.358557 -0.020022
C 3.702850 0.318407 -0.150252
C 5.566228 -1.300601 -0.124908
C 7.094105 -1.247779 -0.189550
C 3.306747 1.681048 -0.219347
C 2.723544 -0.705785 -0.050306
C 7.712775 -2.661882 -0.136449
H -5.491338 -2.009603 1.707187
H -5.516330 -2.595007 0.004471
H -5.275903 -0.524582 -1.869579
H -5.462325 1.081251 -1.088795
H -7.885704 -2.132008 0.342775
H -7.537727 -0.728893 1.394312
H -7.744496 0.604462 -0.539136
H -7.593857 -0.787274 -1.637307
H -3.249336 -1.319211 -0.749155
H -3.169734 -1.262614 1.042073
H -3.005782 1.243539 0.987473
H -3.045434 1.224581 -0.804177
H 1.621120 3.057843 -0.242479
H 0.594692 -1.137334 0.057500
H 5.223669 -1.769151 0.821207
H 5.151039 -1.875623 -0.978746
H 7.466080 -0.634194 0.651806
H 7.394315 -0.732521 -1.120731
H 4.082518 2.448538 -0.295227
H 3.011914 -1.759260 0.003884
H 7.441271 -3.187370 0.798398
H 8.814528 -2.606763 -0.181579
H 7.372909 -3.283723 -0.985920


