%chk=000008698.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008698

0 1
 O   0.8505000      7.6300003E-02 -1.4500000E-02
 O  -7.0100002E-02   2.152300     -0.3913000    
 C    3.173200     -0.4934000      0.1040000    
 C    4.606000      2.7600000E-02  3.7900001E-02
 C    2.159100      0.6229000     -0.1023000    
 C    5.614500      -1.082300      0.2873000    
 C   -1.485800      0.2621000     -6.3199997E-02
 C  -0.1775000      0.9546000     -0.1785000    
 C   -2.571600      0.9641000      0.4187000    
 C   -1.575300      -1.061800     -0.4419000    
 C   -3.800800      0.3138000      0.5269000    
 C   -2.804700      -1.712100     -0.3337000    
 C   -3.917400      -1.024200      0.1507000    
 H    3.016500      -1.272900     -0.6521000    
 H    2.988600     -0.9747000       1.072600    
 H    4.750600      0.8168000      0.7849000    
 H    4.795100      0.4732000     -0.9456000    
 H    2.285100       1.391900      0.6691000    
 H    2.299200       1.078900      -1.089600    
 H    5.473400      -1.525500       1.278400    
 H    5.517800      -1.875400     -0.4610000    
 H    6.633900     -0.6874000      0.2339000    
 H   -2.492600       2.005100      0.7179000    
 H  -0.7278000      -1.615500     -0.8345000    
 H   -4.667200      0.8490000      0.9046000    
 H   -2.896600      -2.753100     -0.6295000    
 H   -4.874600      -1.530500      0.2343000    


%chk=000008698-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000008698

0 1
O 0.870632 0.032598 0.100010
O -0.049483 2.173739 0.118092
C 3.245101 -0.487824 0.038569
C 4.698726 0.041618 0.077851
C 2.228607 0.649899 0.131636
C 5.740280 -1.091248 -0.042054
C -1.521493 0.224332 0.066673
C -0.204762 0.926062 0.097539
C -2.697724 1.018251 0.042606
C -1.622468 -1.191359 0.062238
C -3.965158 0.401565 0.013688
C -2.893278 -1.803890 0.034354
C -4.065218 -1.010530 0.009774
H 3.077033 -1.051716 -0.899208
H 3.081361 -1.195013 0.874608
H 4.863611 0.598738 1.022319
H 4.848769 0.770170 -0.744756
H 2.328869 1.225333 1.071133
H 2.312364 1.358443 -0.713511
H 5.633781 -1.818326 0.784851
H 5.616806 -1.643360 -0.992488
H 6.771205 -0.694275 -0.012473
H -2.593190 2.108316 0.046998
H -0.708480 -1.791384 0.081094
H -4.871761 1.015955 -0.005570
H -2.972113 -2.896511 0.031731
H -5.050517 -1.489784 -0.012204


